NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
528663 | 2lnu | 18180 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 -19.866 2.169 -14.541 2 H2 MET 1 2H MET 1 -19.065 3.617 -14.244 3 H3 MET 1 3H MET 1 -20.015 2.921 -13.038 4 HA MET 1 HA MET 1 -17.652 2.630 -12.647 5 HB2 MET 1 2HB MET 1 -19.203 0.980 -11.702 6 HB3 MET 1 1HB MET 1 -19.215 0.072 -13.206 7 HG2 MET 1 2HG MET 1 -16.905 -0.580 -12.898 8 HG3 MET 1 1HG MET 1 -16.755 0.472 -11.494 9 HE1 MET 1 3HE MET 1 -17.687 -0.065 -9.109 10 HE2 MET 1 1HE MET 1 -18.821 -1.372 -8.766 11 HE3 MET 1 2HE MET 1 -19.327 -0.006 -9.763 12 H ASP 2 H ASP 2 -18.755 0.891 -15.582 13 HA ASP 2 HA ASP 2 -16.345 -0.316 -16.308 14 HB2 ASP 2 2HB ASP 2 -18.646 0.591 -18.082 15 HB3 ASP 2 1HB ASP 2 -17.346 -0.466 -18.626 16 H GLU 3 H GLU 3 -17.162 3.020 -16.583 17 HA GLU 3 HA GLU 3 -15.667 3.724 -18.916 18 HB2 GLU 3 2HB GLU 3 -16.470 5.711 -16.744 19 HB3 GLU 3 1HB GLU 3 -16.337 5.965 -18.476 20 HG2 GLU 3 2HG GLU 3 -18.650 6.070 -18.025 21 HG3 GLU 3 1HG GLU 3 -18.407 4.466 -18.717 22 H ASP 4 H ASP 4 -15.285 4.206 -15.413 23 HA ASP 4 HA ASP 4 -12.581 5.242 -15.611 24 HB2 ASP 4 2HB ASP 4 -12.678 5.373 -13.135 25 HB3 ASP 4 1HB ASP 4 -14.089 6.114 -13.870 26 H THR 5 H THR 5 -14.082 2.123 -15.150 27 HA THR 5 HA THR 5 -11.882 0.937 -13.707 28 HB THR 5 HB THR 5 -14.345 -0.410 -14.895 29 HG1 THR 5 HG1 THR 5 -14.475 1.397 -13.196 30 HG21 THR 5 3HG2 THR 5 -13.935 -2.155 -13.199 31 HG22 THR 5 1HG2 THR 5 -12.476 -1.320 -12.660 32 HG23 THR 5 2HG2 THR 5 -12.547 -2.025 -14.277 33 H GLU 6 H GLU 6 -13.049 0.854 -17.102 34 HA GLU 6 HA GLU 6 -11.129 -0.960 -18.093 35 HB2 GLU 6 2HB GLU 6 -11.509 0.003 -20.306 36 HB3 GLU 6 1HB GLU 6 -13.039 -0.159 -19.457 37 HG2 GLU 6 2HG GLU 6 -13.001 2.263 -18.935 38 HG3 GLU 6 1HG GLU 6 -11.472 2.417 -19.799 39 H ASP 7 H ASP 7 -10.900 2.479 -17.343 40 HA ASP 7 HA ASP 7 -8.222 2.867 -18.323 41 HB2 ASP 7 2HB ASP 7 -9.819 4.756 -18.131 42 HB3 ASP 7 1HB ASP 7 -9.866 4.550 -16.378 43 H TRP 8 H TRP 8 -9.682 2.207 -15.177 44 HA TRP 8 HA TRP 8 -7.417 2.042 -13.567 45 HB2 TRP 8 2HB TRP 8 -9.588 1.934 -12.540 46 HB3 TRP 8 1HB TRP 8 -10.047 0.521 -13.478 47 HD1 TRP 8 HD1 TRP 8 -7.610 1.443 -10.568 48 HE1 TRP 8 HE1 TRP 8 -7.342 -0.644 -9.091 49 HE3 TRP 8 HE3 TRP 8 -10.297 -1.912 -13.356 50 HZ2 TRP 8 HZ2 TRP 8 -8.175 -3.340 -9.080 51 HZ3 TRP 8 HZ3 TRP 8 -10.521 -4.223 -12.537 52 HH2 TRP 8 HH2 TRP 8 -9.475 -4.924 -10.443 53 H GLU 9 H GLU 9 -8.713 -0.305 -15.895 54 HA GLU 9 HA GLU 9 -6.762 -2.355 -15.331 55 HB2 GLU 9 2HB GLU 9 -8.602 -1.956 -17.725 56 HB3 GLU 9 1HB GLU 9 -7.599 -3.384 -17.463 57 HG2 GLU 9 2HG GLU 9 -8.823 -3.913 -15.410 58 HG3 GLU 9 1HG GLU 9 -9.789 -2.449 -15.589 59 H THR 10 H THR 10 -6.913 0.432 -17.483 60 HA THR 10 HA THR 10 -4.758 -0.165 -19.212 61 HB THR 10 HB THR 10 -5.675 2.595 -18.252 62 HG1 THR 10 HG1 THR 10 -7.023 0.778 -19.636 63 HG21 THR 10 3HG2 THR 10 -4.209 1.775 -20.797 64 HG22 THR 10 1HG2 THR 10 -3.522 2.700 -19.463 65 HG23 THR 10 2HG2 THR 10 -4.813 3.395 -20.447 66 H GLN 11 H GLN 11 -4.857 1.911 -16.273 67 HA GLN 11 HA GLN 11 -2.085 2.181 -15.945 68 HB2 GLN 11 2HB GLN 11 -2.528 3.087 -13.774 69 HB3 GLN 11 1HB GLN 11 -3.868 3.582 -14.798 70 HG2 GLN 11 2HG GLN 11 -5.252 1.757 -13.820 71 HG3 GLN 11 1HG GLN 11 -3.897 1.330 -12.774 72 HE21 GLN 11 1HE2 GLN 11 -5.188 1.668 -10.929 73 HE22 GLN 11 2HE2 GLN 11 -5.582 3.255 -10.374 74 H LEU 12 H LEU 12 -4.227 -0.507 -15.133 75 HA LEU 12 HA LEU 12 -2.612 -1.547 -12.995 76 HB2 LEU 12 2HB LEU 12 -5.016 -1.796 -12.933 77 HB3 LEU 12 1HB LEU 12 -5.012 -2.691 -14.443 78 HG LEU 12 HG LEU 12 -3.965 -4.617 -13.373 79 HD11 LEU 12 1HD1 LEU 12 -2.449 -3.502 -11.815 80 HD12 LEU 12 2HD1 LEU 12 -3.425 -4.710 -10.987 81 HD13 LEU 12 3HD1 LEU 12 -3.815 -2.997 -10.816 82 HD21 LEU 12 3HD2 LEU 12 -6.413 -4.399 -13.209 83 HD22 LEU 12 1HD2 LEU 12 -6.244 -3.580 -11.652 84 HD23 LEU 12 2HD2 LEU 12 -5.740 -5.264 -11.834 85 H GLN 13 H GLN 13 -3.214 -2.633 -16.374 86 HA GLN 13 HA GLN 13 -1.557 -4.886 -16.335 87 HB2 GLN 13 2HB GLN 13 -1.393 -4.579 -18.821 88 HB3 GLN 13 1HB GLN 13 -3.034 -4.510 -18.194 89 HG2 GLN 13 2HG GLN 13 -2.833 -1.976 -18.246 90 HG3 GLN 13 1HG GLN 13 -1.332 -2.198 -19.144 91 HE21 GLN 13 1HE2 GLN 13 -4.222 -4.213 -19.523 92 HE22 GLN 13 2HE2 GLN 13 -4.599 -3.679 -21.120 93 H ALA 14 H ALA 14 -0.729 -1.467 -16.725 94 HA ALA 14 HA ALA 14 2.108 -1.881 -17.081 95 HB1 ALA 14 3HB ALA 14 2.265 0.554 -16.750 96 HB2 ALA 14 1HB ALA 14 0.581 0.607 -16.216 97 HB3 ALA 14 2HB ALA 14 0.969 0.157 -17.879 98 H ASN 15 H ASN 15 -0.064 -1.231 -14.372 99 HA ASN 15 HA ASN 15 1.690 -0.492 -12.342 100 HB2 ASN 15 2HB ASN 15 -0.971 -0.549 -12.493 101 HB3 ASN 15 1HB ASN 15 -0.808 -2.110 -11.721 102 HD21 ASN 15 1HD2 ASN 15 -0.741 1.283 -11.338 103 HD22 ASN 15 2HD2 ASN 15 -0.516 1.317 -9.632 104 H ARG 16 H ARG 16 0.094 -3.660 -12.648 105 HA ARG 16 HA ARG 16 1.510 -5.072 -10.725 106 HB2 ARG 16 2HB ARG 16 0.630 -7.105 -11.780 107 HB3 ARG 16 1HB ARG 16 -0.606 -5.852 -11.793 108 HG2 ARG 16 2HG ARG 16 -0.125 -5.385 -14.170 109 HG3 ARG 16 1HG ARG 16 1.136 -6.620 -14.160 110 HD2 ARG 16 2HD ARG 16 -0.814 -7.572 -15.174 111 HD3 ARG 16 1HD ARG 16 -0.633 -8.315 -13.583 112 HE ARG 16 HE ARG 16 -2.367 -6.031 -13.548 113 HH11 ARG 16 1HH1 ARG 16 -2.283 -9.482 -14.236 114 HH12 ARG 16 2HH1 ARG 16 -3.987 -9.694 -13.972 115 HH21 ARG 16 1HH2 ARG 16 -4.611 -6.327 -13.285 116 HH22 ARG 16 2HH2 ARG 16 -5.299 -7.910 -13.441 117 H ASP 17 H ASP 17 2.343 -4.395 -14.056 118 HA ASP 17 HA ASP 17 4.419 -6.316 -14.385 119 HB2 ASP 17 2HB ASP 17 2.955 -5.337 -16.195 120 HB3 ASP 17 1HB ASP 17 3.812 -3.813 -16.015 121 H GLU 18 H GLU 18 4.388 -2.783 -13.730 122 HA GLU 18 HA GLU 18 7.252 -2.544 -13.724 123 HB2 GLU 18 2HB GLU 18 6.913 -0.204 -13.135 124 HB3 GLU 18 1HB GLU 18 5.784 -0.658 -14.403 125 HG2 GLU 18 2HG GLU 18 4.009 -0.911 -12.619 126 HG3 GLU 18 1HG GLU 18 5.164 -0.249 -11.466 127 H LYS 19 H LYS 19 4.753 -2.927 -11.242 128 HA LYS 19 HA LYS 19 6.429 -2.569 -8.963 129 HB2 LYS 19 2HB LYS 19 3.679 -3.744 -9.383 130 HB3 LYS 19 1HB LYS 19 4.503 -4.100 -7.873 131 HG2 LYS 19 2HG LYS 19 3.026 -2.241 -7.520 132 HG3 LYS 19 1HG LYS 19 4.684 -1.652 -7.422 133 HD2 LYS 19 2HD LYS 19 4.510 -0.692 -9.661 134 HD3 LYS 19 1HD LYS 19 2.905 -1.397 -9.871 135 HE2 LYS 19 2HE LYS 19 2.736 0.983 -9.349 136 HE3 LYS 19 1HE LYS 19 2.046 0.022 -8.039 137 HZ1 LYS 19 3HZ LYS 19 3.966 0.399 -6.725 138 HZ2 LYS 19 1HZ LYS 19 3.492 1.901 -7.337 139 HZ3 LYS 19 2HZ LYS 19 4.808 1.088 -8.013 140 H ASP 20 H ASP 20 5.520 -5.388 -10.896 141 HA ASP 20 HA ASP 20 6.703 -7.430 -9.376 142 HB2 ASP 20 2HB ASP 20 5.201 -7.979 -11.199 143 HB3 ASP 20 1HB ASP 20 6.244 -7.196 -12.382 144 H ARG 21 H ARG 21 8.076 -5.403 -11.981 145 HA ARG 21 HA ARG 21 10.687 -6.691 -11.739 146 HB2 ARG 21 2HB ARG 21 11.425 -5.290 -13.576 147 HB3 ARG 21 1HB ARG 21 9.896 -6.055 -13.982 148 HG2 ARG 21 2HG ARG 21 8.701 -3.959 -13.591 149 HG3 ARG 21 1HG ARG 21 10.197 -3.179 -13.067 150 HD2 ARG 21 2HD ARG 21 9.602 -2.598 -15.407 151 HD3 ARG 21 1HD ARG 21 11.157 -3.428 -15.298 152 HE ARG 21 HE ARG 21 10.195 -5.359 -16.255 153 HH11 ARG 21 1HH1 ARG 21 7.876 -2.728 -16.084 154 HH12 ARG 21 2HH1 ARG 21 6.791 -3.448 -17.226 155 HH21 ARG 21 1HH2 ARG 21 8.760 -6.294 -17.752 156 HH22 ARG 21 2HH2 ARG 21 7.291 -5.467 -18.166 157 H PHE 22 H PHE 22 9.112 -3.982 -10.276 158 HA PHE 22 HA PHE 22 11.387 -2.583 -9.352 159 HB2 PHE 22 2HB PHE 22 8.995 -1.843 -9.112 160 HB3 PHE 22 1HB PHE 22 8.764 -3.061 -7.869 161 HD1 PHE 22 HD2 PHE 22 9.820 -2.767 -5.635 162 HD2 PHE 22 HD1 PHE 22 10.187 0.238 -8.639 163 HE1 PHE 22 HE2 PHE 22 10.484 -1.138 -3.928 164 HE2 PHE 22 HE1 PHE 22 10.864 1.865 -6.929 165 HZ PHE 22 HZ PHE 22 11.010 1.180 -4.569 166 H PHE 23 H PHE 23 9.787 -5.524 -8.266 167 HA PHE 23 HA PHE 23 11.544 -5.917 -5.961 168 HB2 PHE 23 2HB PHE 23 9.096 -7.344 -7.038 169 HB3 PHE 23 1HB PHE 23 10.118 -8.132 -5.842 170 HD1 PHE 23 HD2 PHE 23 8.902 -4.557 -6.145 171 HD2 PHE 23 HD1 PHE 23 8.994 -8.141 -3.806 172 HE1 PHE 23 HE2 PHE 23 7.688 -3.419 -4.329 173 HE2 PHE 23 HE1 PHE 23 7.793 -6.992 -2.005 174 HZ PHE 23 HZ PHE 23 7.148 -4.639 -2.253 175 H SER 24 H SER 24 11.849 -6.592 -9.251 176 HA SER 24 HA SER 24 13.434 -9.061 -8.773 177 HB2 SER 24 2HB SER 24 11.883 -8.266 -11.276 178 HB3 SER 24 1HB SER 24 12.836 -9.743 -11.086 179 HG SER 24 HG SER 24 10.634 -10.125 -10.662 180 H GLU 25 H GLU 25 13.365 -5.963 -10.545 181 HA GLU 25 HA GLU 25 16.039 -6.507 -11.710 182 HB2 GLU 25 2HB GLU 25 13.839 -4.695 -12.791 183 HB3 GLU 25 1HB GLU 25 15.384 -5.018 -13.563 184 HG2 GLU 25 2HG GLU 25 13.193 -7.051 -13.092 185 HG3 GLU 25 1HG GLU 25 13.508 -6.224 -14.616 186 H HIS 26 H HIS 26 13.885 -3.958 -10.438 187 HA HIS 26 HA HIS 26 15.802 -1.851 -10.362 188 HB2 HIS 26 2HB HIS 26 13.396 -1.352 -10.386 189 HB3 HIS 26 1HB HIS 26 13.150 -2.229 -8.876 190 HD2 HIS 26 HD2 HIS 26 14.411 1.250 -10.121 191 HE1 HIS 26 HE1 HIS 26 14.287 1.243 -5.896 192 HE2 HIS 26 HE2 HIS 26 14.394 2.692 -7.969 193 H ARG 27 H ARG 27 14.259 -3.650 -7.730 194 HA ARG 27 HA ARG 27 16.813 -3.718 -6.240 195 HB2 ARG 27 2HB ARG 27 13.935 -3.859 -5.226 196 HB3 ARG 27 1HB ARG 27 15.341 -4.191 -4.219 197 HG2 ARG 27 2HG ARG 27 14.679 -1.555 -5.561 198 HG3 ARG 27 1HG ARG 27 14.547 -1.918 -3.842 199 HD2 ARG 27 2HD ARG 27 16.987 -2.234 -3.714 200 HD3 ARG 27 1HD ARG 27 17.124 -1.898 -5.443 201 HE ARG 27 HE ARG 27 15.884 0.314 -4.395 202 HH11 ARG 27 1HH1 ARG 27 18.939 -1.333 -3.826 203 HH12 ARG 27 2HH1 ARG 27 19.766 0.110 -3.347 204 HH21 ARG 27 1HH2 ARG 27 16.995 2.204 -3.754 205 HH22 ARG 27 2HH2 ARG 27 18.665 2.110 -3.307 206 H GLN 28 H GLN 28 17.636 -5.647 -5.750 207 HA GLN 28 HA GLN 28 16.869 -8.044 -7.001 208 HB2 GLN 28 2HB GLN 28 18.556 -9.104 -5.457 209 HB3 GLN 28 1HB GLN 28 19.164 -7.691 -6.314 210 HG2 GLN 28 2HG GLN 28 18.662 -6.324 -4.246 211 HG3 GLN 28 1HG GLN 28 18.315 -7.838 -3.414 212 HE21 GLN 28 1HE2 GLN 28 20.810 -5.845 -4.821 213 HE22 GLN 28 2HE2 GLN 28 22.155 -6.710 -4.162 214 H SER 29 H SER 29 16.008 -9.994 -6.077 215 HA SER 29 HA SER 29 13.473 -9.585 -5.105 216 HB2 SER 29 2HB SER 29 15.063 -12.178 -4.968 217 HB3 SER 29 1HB SER 29 13.306 -12.045 -4.903 218 HG SER 29 HG SER 29 13.426 -11.065 -7.004 219 HA PRO 30 HA PRO 30 14.210 -9.334 -0.575 220 HB2 PRO 30 2HB PRO 30 11.788 -8.355 0.130 221 HB3 PRO 30 1HB PRO 30 12.947 -7.339 -0.750 222 HG2 PRO 30 2HG PRO 30 10.584 -8.839 -1.826 223 HG3 PRO 30 1HG PRO 30 11.105 -7.172 -2.159 224 HD2 PRO 30 2HD PRO 30 11.667 -9.285 -3.829 225 HD3 PRO 30 1HD PRO 30 12.677 -7.829 -3.718 226 H ILE 31 H ILE 31 11.839 -11.127 -2.342 227 HA ILE 31 HA ILE 31 10.744 -12.768 -0.353 228 HB ILE 31 HB ILE 31 11.377 -13.580 -3.238 229 HG12 ILE 31 2HG1 ILE 31 10.203 -11.410 -3.292 230 HG13 ILE 31 1HG1 ILE 31 9.149 -12.681 -3.890 231 HG21 ILE 31 1HG2 ILE 31 9.393 -15.039 -3.038 232 HG22 ILE 31 2HG2 ILE 31 9.186 -14.526 -1.361 233 HG23 ILE 31 3HG2 ILE 31 10.620 -15.438 -1.834 234 HD11 ILE 31 3HD1 ILE 31 9.012 -11.358 -1.175 235 HD12 ILE 31 1HD1 ILE 31 7.975 -12.684 -1.707 236 HD13 ILE 31 2HD1 ILE 31 7.907 -11.126 -2.528 237 HA PRO 32 HA PRO 32 14.617 -14.634 1.190 238 HB2 PRO 32 2HB PRO 32 12.737 -16.930 1.832 239 HB3 PRO 32 1HB PRO 32 13.950 -16.142 2.868 240 HG2 PRO 32 2HG PRO 32 11.364 -15.604 3.153 241 HG3 PRO 32 1HG PRO 32 12.593 -14.331 3.330 242 HD2 PRO 32 2HD PRO 32 10.669 -14.791 1.089 243 HD3 PRO 32 1HD PRO 32 11.372 -13.276 1.683 244 HA PRO 33 HA PRO 33 16.022 -17.562 -2.010 245 HB2 PRO 33 2HB PRO 33 17.630 -18.750 0.265 246 HB3 PRO 33 1HB PRO 33 18.172 -18.224 -1.346 247 HG2 PRO 33 2HG PRO 33 18.705 -16.734 0.787 248 HG3 PRO 33 1HG PRO 33 18.242 -15.972 -0.753 249 HD2 PRO 33 2HD PRO 33 16.590 -16.378 1.729 250 HD3 PRO 33 1HD PRO 33 16.630 -14.998 0.607 251 H GLU 34 H GLU 34 15.081 -18.599 1.218 252 HA GLU 34 HA GLU 34 14.470 -21.326 0.698 253 HB2 GLU 34 2HB GLU 34 13.341 -19.498 2.865 254 HB3 GLU 34 1HB GLU 34 13.353 -21.259 2.886 255 HG2 GLU 34 2HG GLU 34 15.804 -21.261 3.033 256 HG3 GLU 34 1HG GLU 34 15.821 -19.499 2.953 257 H GLU 35 H GLU 35 12.406 -18.417 0.994 258 HA GLU 35 HA GLU 35 9.935 -19.638 0.478 259 HB2 GLU 35 2HB GLU 35 10.167 -17.458 1.601 260 HB3 GLU 35 1HB GLU 35 10.813 -16.748 0.128 261 HG2 GLU 35 2HG GLU 35 8.552 -16.018 0.360 262 HG3 GLU 35 1HG GLU 35 8.602 -17.152 -0.984 263 H ARG 36 H ARG 36 12.107 -17.801 -1.754 264 HA ARG 36 HA ARG 36 10.334 -18.165 -3.982 265 HB2 ARG 36 2HB ARG 36 11.778 -16.760 -5.239 266 HB3 ARG 36 1HB ARG 36 11.726 -16.060 -3.628 267 HG2 ARG 36 2HG ARG 36 13.954 -16.864 -3.130 268 HG3 ARG 36 1HG ARG 36 13.994 -17.826 -4.610 269 HD2 ARG 36 2HD ARG 36 14.021 -14.796 -4.387 270 HD3 ARG 36 1HD ARG 36 15.308 -15.841 -4.999 271 HE ARG 36 HE ARG 36 12.789 -15.157 -6.353 272 HH11 ARG 36 1HH1 ARG 36 15.916 -16.754 -6.568 273 HH12 ARG 36 2HH1 ARG 36 15.825 -16.941 -8.286 274 HH21 ARG 36 1HH2 ARG 36 12.676 -15.464 -8.602 275 HH22 ARG 36 2HH2 ARG 36 14.001 -16.214 -9.433 276 H ASP 37 H ASP 37 12.534 -20.203 -2.527 277 HA ASP 37 HA ASP 37 13.710 -21.568 -4.670 278 HB2 ASP 37 2HB ASP 37 14.343 -22.060 -2.377 279 HB3 ASP 37 1HB ASP 37 12.716 -22.594 -1.981 280 H ASP 38 H ASP 38 10.522 -22.147 -3.107 281 HA ASP 38 HA ASP 38 9.647 -23.837 -5.345 282 HB2 ASP 38 2HB ASP 38 9.141 -24.470 -2.985 283 HB3 ASP 38 1HB ASP 38 8.206 -22.993 -2.781 284 H PHE 39 H PHE 39 8.987 -20.639 -3.957 285 HA PHE 39 HA PHE 39 6.764 -20.087 -5.830 286 HB2 PHE 39 2HB PHE 39 7.792 -18.589 -3.374 287 HB3 PHE 39 1HB PHE 39 6.501 -17.987 -4.412 288 HD1 PHE 39 HD1 PHE 39 7.362 -21.105 -2.461 289 HD2 PHE 39 HD2 PHE 39 4.296 -18.412 -3.734 290 HE1 PHE 39 HE1 PHE 39 5.715 -22.321 -1.097 291 HE2 PHE 39 HE2 PHE 39 2.662 -19.635 -2.364 292 HZ PHE 39 HZ PHE 39 3.368 -21.586 -1.041 293 H ASP 40 H ASP 40 6.783 -18.058 -7.097 294 HA ASP 40 HA ASP 40 9.252 -16.508 -7.136 295 HB2 ASP 40 2HB ASP 40 9.707 -18.364 -8.754 296 HB3 ASP 40 1HB ASP 40 8.285 -17.896 -9.679 297 H GLY 41 H GLY 41 8.257 -14.641 -6.626 298 HA2 GLY 41 2HA GLY 41 7.389 -12.867 -8.426 299 HA3 GLY 41 1HA GLY 41 5.880 -13.695 -8.038 300 H LEU 42 H LEU 42 6.471 -10.951 -7.612 301 HA LEU 42 HA LEU 42 6.453 -10.321 -4.831 302 HB2 LEU 42 2HB LEU 42 6.602 -8.723 -6.843 303 HB3 LEU 42 1HB LEU 42 4.903 -9.003 -7.132 304 HG LEU 42 HG LEU 42 6.046 -7.623 -4.654 305 HD11 LEU 42 1HD1 LEU 42 6.391 -6.281 -6.672 306 HD12 LEU 42 2HD1 LEU 42 5.200 -5.534 -5.615 307 HD13 LEU 42 3HD1 LEU 42 4.673 -6.393 -7.066 308 HD21 LEU 42 3HD2 LEU 42 3.886 -8.646 -4.126 309 HD22 LEU 42 1HD2 LEU 42 3.145 -7.876 -5.534 310 HD23 LEU 42 2HD2 LEU 42 3.735 -6.895 -4.188 311 H SER 43 H SER 43 5.012 -11.416 -3.425 312 HA SER 43 HA SER 43 2.745 -12.818 -4.195 313 HB2 SER 43 2HB SER 43 3.239 -11.555 -1.464 314 HB3 SER 43 1HB SER 43 2.128 -12.882 -1.808 315 HG SER 43 HG SER 43 4.177 -13.580 -1.002 316 H TYR 44 H TYR 44 0.894 -12.187 -4.926 317 HA TYR 44 HA TYR 44 0.033 -9.352 -4.768 318 HB2 TYR 44 2HB TYR 44 1.369 -9.705 -6.804 319 HB3 TYR 44 1HB TYR 44 0.444 -11.138 -7.215 320 HD1 TYR 44 HD1 TYR 44 -0.010 -7.408 -6.752 321 HD2 TYR 44 HD2 TYR 44 -1.286 -10.935 -8.816 322 HE1 TYR 44 HE1 TYR 44 -1.401 -6.039 -8.257 323 HE2 TYR 44 HE2 TYR 44 -2.674 -9.561 -10.307 324 HH TYR 44 HH TYR 44 -3.783 -7.326 -10.256 325 H PHE 45 H PHE 45 -2.117 -9.095 -4.596 326 HA PHE 45 HA PHE 45 -3.938 -11.404 -4.636 327 HB2 PHE 45 2HB PHE 45 -4.500 -8.462 -4.018 328 HB3 PHE 45 1HB PHE 45 -5.649 -9.786 -3.838 329 HD1 PHE 45 HD1 PHE 45 -4.385 -11.874 -2.410 330 HD2 PHE 45 HD2 PHE 45 -3.762 -7.671 -1.939 331 HE1 PHE 45 HE1 PHE 45 -3.660 -12.244 -0.092 332 HE2 PHE 45 HE2 PHE 45 -3.040 -8.052 0.380 333 HZ PHE 45 HZ PHE 45 -2.988 -10.334 1.306 334 H ASP 46 H ASP 46 -5.680 -11.505 -6.178 335 HA ASP 46 HA ASP 46 -4.943 -10.412 -8.774 336 HB2 ASP 46 2HB ASP 46 -7.191 -12.330 -7.980 337 HB3 ASP 46 1HB ASP 46 -6.868 -11.809 -9.628 338 HA PRO 47 HA PRO 47 -7.349 -6.711 -8.644 339 HB2 PRO 47 2HB PRO 47 -8.540 -6.756 -11.207 340 HB3 PRO 47 1HB PRO 47 -6.908 -6.182 -10.833 341 HG2 PRO 47 2HG PRO 47 -7.761 -8.873 -11.839 342 HG3 PRO 47 1HG PRO 47 -6.386 -7.861 -12.350 343 HD2 PRO 47 2HD PRO 47 -5.950 -9.920 -10.735 344 HD3 PRO 47 1HD PRO 47 -5.128 -8.374 -10.418 345 H ASP 48 H ASP 48 -8.980 -6.825 -7.219 346 HA ASP 48 HA ASP 48 -11.562 -8.033 -7.987 347 HB2 ASP 48 2HB ASP 48 -10.409 -9.236 -6.144 348 HB3 ASP 48 1HB ASP 48 -10.328 -7.741 -5.209 349 HA PRO 49 HA PRO 49 -12.588 -3.603 -7.830 350 HB2 PRO 49 2HB PRO 49 -15.359 -4.482 -8.512 351 HB3 PRO 49 1HB PRO 49 -14.243 -3.435 -9.417 352 HG2 PRO 49 2HG PRO 49 -14.809 -5.919 -10.253 353 HG3 PRO 49 1HG PRO 49 -13.190 -5.211 -10.470 354 HD2 PRO 49 2HD PRO 49 -14.126 -7.174 -8.372 355 HD3 PRO 49 1HD PRO 49 -12.628 -7.173 -9.334 356 H ASP 50 H ASP 50 -14.246 -6.095 -5.956 357 HA ASP 50 HA ASP 50 -15.822 -4.320 -4.343 358 HB2 ASP 50 2HB ASP 50 -14.911 -7.151 -3.703 359 HB3 ASP 50 1HB ASP 50 -16.187 -6.273 -2.866 360 H TYR 51 H TYR 51 -12.517 -5.382 -4.220 361 HA TYR 51 HA TYR 51 -12.084 -3.985 -1.635 362 HB2 TYR 51 2HB TYR 51 -10.453 -6.096 -3.089 363 HB3 TYR 51 1HB TYR 51 -9.735 -5.100 -1.818 364 HD1 TYR 51 HD2 TYR 51 -10.917 -5.039 0.470 365 HD2 TYR 51 HD1 TYR 51 -11.742 -8.036 -2.461 366 HE1 TYR 51 HE2 TYR 51 -11.924 -6.446 2.199 367 HE2 TYR 51 HE1 TYR 51 -12.755 -9.444 -0.728 368 HH TYR 51 HH TYR 51 -12.822 -9.760 1.592 369 H ARG 52 H ARG 52 -12.316 -3.160 -4.672 370 HA ARG 52 HA ARG 52 -10.288 -1.030 -4.514 371 HB2 ARG 52 2HB ARG 52 -10.628 -2.149 -6.730 372 HB3 ARG 52 1HB ARG 52 -12.334 -1.707 -6.692 373 HG2 ARG 52 2HG ARG 52 -11.653 0.704 -6.677 374 HG3 ARG 52 1HG ARG 52 -9.973 0.188 -6.846 375 HD2 ARG 52 2HD ARG 52 -10.730 0.798 -9.018 376 HD3 ARG 52 1HD ARG 52 -10.663 -0.967 -9.004 377 HE ARG 52 HE ARG 52 -13.181 -0.725 -8.442 378 HH11 ARG 52 1HH1 ARG 52 -11.412 1.355 -10.663 379 HH12 ARG 52 2HH1 ARG 52 -12.817 1.722 -11.616 380 HH21 ARG 52 1HH2 ARG 52 -15.008 -0.199 -9.674 381 HH22 ARG 52 2HH2 ARG 52 -14.849 0.839 -11.056 382 H VAL 53 H VAL 53 -11.015 0.486 -3.036 383 HA VAL 53 HA VAL 53 -13.908 1.172 -2.967 384 HB VAL 53 HB VAL 53 -13.739 1.663 -0.607 385 HG11 VAL 53 1HG1 VAL 53 -13.224 -0.558 0.372 386 HG12 VAL 53 2HG1 VAL 53 -12.404 -1.030 -1.118 387 HG13 VAL 53 3HG1 VAL 53 -14.138 -0.709 -1.131 388 HG21 VAL 53 3HG2 VAL 53 -11.656 1.381 0.706 389 HG22 VAL 53 1HG2 VAL 53 -11.500 2.639 -0.519 390 HG23 VAL 53 2HG2 VAL 53 -10.766 1.056 -0.782 391 H GLU 54 H GLU 54 -14.231 3.478 -2.003 392 HA GLU 54 HA GLU 54 -12.263 5.351 -3.200 393 HB2 GLU 54 2HB GLU 54 -14.259 6.825 -3.701 394 HB3 GLU 54 1HB GLU 54 -14.200 5.327 -4.617 395 HG2 GLU 54 2HG GLU 54 -15.811 4.370 -2.827 396 HG3 GLU 54 1HG GLU 54 -16.046 6.045 -2.333 397 H ALA 55 H ALA 55 -11.594 6.994 -1.945 398 HA ALA 55 HA ALA 55 -12.694 7.282 0.790 399 HB1 ALA 55 3HB ALA 55 -10.693 5.841 0.842 400 HB2 ALA 55 1HB ALA 55 -10.397 7.377 1.664 401 HB3 ALA 55 2HB ALA 55 -9.756 7.101 0.041 402 H THR 56 H THR 56 -12.556 9.307 1.698 403 HA THR 56 HA THR 56 -11.994 11.584 -0.066 404 HB THR 56 HB THR 56 -13.272 11.480 2.716 405 HG1 THR 56 HG1 THR 56 -14.593 11.971 0.250 406 HG21 THR 56 3HG2 THR 56 -14.043 13.773 2.243 407 HG22 THR 56 1HG2 THR 56 -13.173 13.766 0.700 408 HG23 THR 56 2HG2 THR 56 -12.283 13.704 2.222 409 H VAL 57 H VAL 57 -10.136 12.616 0.108 410 HA VAL 57 HA VAL 57 -8.086 11.846 1.963 411 HB VAL 57 HB VAL 57 -7.960 14.102 -0.102 412 HG11 VAL 57 1HG1 VAL 57 -5.531 13.673 -0.060 413 HG12 VAL 57 2HG1 VAL 57 -5.760 12.409 1.148 414 HG13 VAL 57 3HG1 VAL 57 -6.125 14.089 1.546 415 HG21 VAL 57 3HG2 VAL 57 -7.318 11.161 -0.540 416 HG22 VAL 57 1HG2 VAL 57 -7.055 12.465 -1.703 417 HG23 VAL 57 2HG2 VAL 57 -8.695 12.030 -1.220 418 H THR 58 H THR 58 -7.613 12.819 3.801 419 HA THR 58 HA THR 58 -8.562 15.562 4.414 420 HB THR 58 HB THR 58 -8.179 13.211 6.333 421 HG1 THR 58 HG1 THR 58 -10.035 13.171 4.817 422 HG21 THR 58 3HG2 THR 58 -7.812 15.371 7.455 423 HG22 THR 58 1HG2 THR 58 -9.330 14.650 7.988 424 HG23 THR 58 2HG2 THR 58 -9.346 15.978 6.825 425 H VAL 59 H VAL 59 -6.719 16.751 4.033 426 HA VAL 59 HA VAL 59 -4.088 15.515 4.459 427 HB VAL 59 HB VAL 59 -4.929 17.967 2.846 428 HG11 VAL 59 1HG1 VAL 59 -2.072 17.018 3.342 429 HG12 VAL 59 2HG1 VAL 59 -2.773 18.541 3.890 430 HG13 VAL 59 3HG1 VAL 59 -2.556 18.247 2.167 431 HG21 VAL 59 3HG2 VAL 59 -4.003 16.647 0.958 432 HG22 VAL 59 1HG2 VAL 59 -5.315 15.800 1.778 433 HG23 VAL 59 2HG2 VAL 59 -3.640 15.323 2.068 434 H HIS 60 H HIS 60 -2.826 16.036 6.053 435 HA HIS 60 HA HIS 60 -3.576 18.099 7.989 436 HB2 HIS 60 2HB HIS 60 -1.546 15.811 8.087 437 HB3 HIS 60 1HB HIS 60 -1.893 16.913 9.427 438 HD1 HIS 60 HD1 HIS 60 -3.105 13.813 7.857 439 HD2 HIS 60 HD2 HIS 60 -4.661 16.752 10.352 440 HE1 HIS 60 HE1 HIS 60 -5.285 12.909 8.706 441 HE2 HIS 60 HE2 HIS 60 -6.120 14.627 10.326 442 H GLU 61 H GLU 61 -2.468 19.908 8.205 443 HA GLU 61 HA GLU 61 -0.621 20.676 6.097 444 HB2 GLU 61 2HB GLU 61 -0.882 22.969 6.970 445 HB3 GLU 61 1HB GLU 61 -2.436 22.195 6.691 446 HG2 GLU 61 2HG GLU 61 -2.599 21.724 9.144 447 HG3 GLU 61 1HG GLU 61 -1.095 22.616 9.381 448 H THR 62 H THR 62 -0.362 19.713 9.385 449 HA THR 62 HA THR 62 2.531 20.339 9.431 450 HB THR 62 HB THR 62 2.241 20.308 11.993 451 HG1 THR 62 HG1 THR 62 -0.214 21.146 12.210 452 HG21 THR 62 3HG2 THR 62 2.601 22.432 10.792 453 HG22 THR 62 1HG2 THR 62 1.464 22.656 12.117 454 HG23 THR 62 2HG2 THR 62 0.870 22.552 10.458 455 HA PRO 63 HA PRO 63 2.006 15.787 9.358 456 HB2 PRO 63 2HB PRO 63 4.127 15.171 7.821 457 HB3 PRO 63 1HB PRO 63 2.719 16.002 7.136 458 HG2 PRO 63 2HG PRO 63 5.376 17.136 7.930 459 HG3 PRO 63 1HG PRO 63 4.375 17.504 6.508 460 HD2 PRO 63 2HD PRO 63 4.443 19.037 8.843 461 HD3 PRO 63 1HD PRO 63 3.131 19.068 7.643 462 H GLU 64 H GLU 64 2.590 14.349 10.914 463 HA GLU 64 HA GLU 64 4.928 14.741 12.605 464 HB2 GLU 64 2HB GLU 64 4.038 12.797 13.886 465 HB3 GLU 64 1HB GLU 64 2.811 14.034 13.643 466 HG2 GLU 64 2HG GLU 64 1.793 12.730 11.838 467 HG3 GLU 64 1HG GLU 64 3.054 11.510 11.976 468 H SER 65 H SER 65 6.391 12.898 13.081 469 HA SER 65 HA SER 65 7.393 11.702 10.601 470 HB2 SER 65 2HB SER 65 9.421 11.249 12.038 471 HB3 SER 65 1HB SER 65 8.982 12.953 11.923 472 HG SER 65 HG SER 65 9.016 11.282 14.103 473 H VAL 66 H VAL 66 6.738 9.681 10.088 474 HA VAL 66 HA VAL 66 6.287 7.637 12.200 475 HB VAL 66 HB VAL 66 4.843 7.775 9.504 476 HG11 VAL 66 1HG1 VAL 66 4.270 6.086 11.970 477 HG12 VAL 66 2HG1 VAL 66 4.952 5.515 10.447 478 HG13 VAL 66 3HG1 VAL 66 3.297 6.119 10.495 479 HG21 VAL 66 3HG2 VAL 66 2.839 8.582 10.745 480 HG22 VAL 66 1HG2 VAL 66 4.172 9.735 10.785 481 HG23 VAL 66 2HG2 VAL 66 3.822 8.745 12.202 482 H ASP 67 H ASP 67 7.831 6.075 12.065 483 HA ASP 67 HA ASP 67 9.592 5.851 9.774 484 HB2 ASP 67 2HB ASP 67 9.475 4.311 12.402 485 HB3 ASP 67 1HB ASP 67 10.672 3.984 11.151 486 H LEU 68 H LEU 68 9.091 4.693 8.035 487 HA LEU 68 HA LEU 68 7.709 2.087 8.303 488 HB2 LEU 68 2HB LEU 68 7.318 3.965 5.943 489 HB3 LEU 68 1HB LEU 68 6.471 2.462 6.251 490 HG LEU 68 HG LEU 68 6.176 4.983 7.935 491 HD11 LEU 68 1HD1 LEU 68 4.054 5.347 6.864 492 HD12 LEU 68 2HD1 LEU 68 4.238 3.890 5.889 493 HD13 LEU 68 3HD1 LEU 68 5.309 5.268 5.632 494 HD21 LEU 68 3HD2 LEU 68 5.679 2.959 9.231 495 HD22 LEU 68 1HD2 LEU 68 4.540 2.423 7.990 496 HD23 LEU 68 2HD2 LEU 68 4.213 3.885 8.926 497 H GLU 69 H GLU 69 8.081 0.870 6.036 498 HA GLU 69 HA GLU 69 10.973 0.514 5.957 499 HB2 GLU 69 2HB GLU 69 10.484 -1.576 4.787 500 HB3 GLU 69 1HB GLU 69 9.429 -1.428 6.187 501 HG2 GLU 69 2HG GLU 69 7.643 -0.519 4.561 502 HG3 GLU 69 1HG GLU 69 8.695 -1.080 3.264 503 H THR 70 H THR 70 12.261 0.615 4.120 504 HA THR 70 HA THR 70 11.034 1.447 1.541 505 HB THR 70 HB THR 70 12.466 3.250 2.531 506 HG1 THR 70 HG1 THR 70 12.811 3.684 0.517 507 HG21 THR 70 3HG2 THR 70 14.121 1.856 3.729 508 HG22 THR 70 1HG2 THR 70 14.909 2.995 2.638 509 HG23 THR 70 2HG2 THR 70 14.770 1.296 2.186 510 H SER 71 H SER 71 12.802 0.890 -0.270 511 HA SER 71 HA SER 71 12.820 -2.034 -0.281 512 HB2 SER 71 2HB SER 71 13.451 -0.148 -2.587 513 HB3 SER 71 1HB SER 71 12.829 -1.798 -2.670 514 HG SER 71 HG SER 71 11.436 0.397 -2.705 515 H ASP 72 H ASP 72 14.970 -0.386 1.128 516 HA ASP 72 HA ASP 72 17.379 -1.014 -0.476 517 HB2 ASP 72 2HB ASP 72 16.688 1.400 -0.707 518 HB3 ASP 72 1HB ASP 72 16.784 1.582 1.041 519 H ASP 73 H ASP 73 16.331 -2.654 1.535 520 HA ASP 73 HA ASP 73 16.643 -3.699 3.506 521 HB2 ASP 73 2HB ASP 73 18.925 -4.372 4.071 522 HB3 ASP 73 1HB ASP 73 18.704 -4.398 2.334 523 H ARG 74 H ARG 74 15.879 -0.986 3.836 524 HA ARG 74 HA ARG 74 17.269 -0.110 6.299 525 HB2 ARG 74 2HB ARG 74 18.202 0.982 4.185 526 HB3 ARG 74 1HB ARG 74 16.616 1.665 3.885 527 HG2 ARG 74 2HG ARG 74 16.797 2.999 5.957 528 HG3 ARG 74 1HG ARG 74 18.384 2.295 6.268 529 HD2 ARG 74 2HD ARG 74 17.660 3.991 3.848 530 HD3 ARG 74 1HD ARG 74 18.541 4.555 5.271 531 HE ARG 74 HE ARG 74 19.817 2.294 4.072 532 HH11 ARG 74 1HH1 ARG 74 19.453 5.782 3.664 533 HH12 ARG 74 2HH1 ARG 74 20.958 5.953 2.824 534 HH21 ARG 74 1HH2 ARG 74 21.777 2.544 2.973 535 HH22 ARG 74 2HH2 ARG 74 22.277 4.117 2.432 536 H THR 75 H THR 75 16.013 1.884 7.120 537 HA THR 75 HA THR 75 13.100 1.670 6.869 538 HB THR 75 HB THR 75 14.573 1.821 9.556 539 HG1 THR 75 HG1 THR 75 12.843 -0.274 8.721 540 HG21 THR 75 3HG2 THR 75 11.582 1.651 8.975 541 HG22 THR 75 1HG2 THR 75 12.431 3.092 9.544 542 HG23 THR 75 2HG2 THR 75 12.331 1.665 10.572 543 H VAL 76 H VAL 76 12.177 3.727 6.988 544 HA VAL 76 HA VAL 76 13.969 6.040 7.176 545 HB VAL 76 HB VAL 76 13.063 6.993 4.991 546 HG11 VAL 76 1HG1 VAL 76 14.691 5.817 3.544 547 HG12 VAL 76 2HG1 VAL 76 14.831 4.527 4.742 548 HG13 VAL 76 3HG1 VAL 76 15.366 6.161 5.138 549 HG21 VAL 76 3HG2 VAL 76 12.225 4.119 4.461 550 HG22 VAL 76 1HG2 VAL 76 12.216 5.431 3.277 551 HG23 VAL 76 2HG2 VAL 76 11.149 5.498 4.678 552 H ARG 77 H ARG 77 12.983 7.910 7.652 553 HA ARG 77 HA ARG 77 10.459 7.803 8.994 554 HB2 ARG 77 2HB ARG 77 12.276 9.124 9.910 555 HB3 ARG 77 1HB ARG 77 12.456 10.044 8.427 556 HG2 ARG 77 2HG ARG 77 9.841 10.212 9.908 557 HG3 ARG 77 1HG ARG 77 11.237 11.054 10.567 558 HD2 ARG 77 2HD ARG 77 10.096 11.464 7.778 559 HD3 ARG 77 1HD ARG 77 9.844 12.528 9.163 560 HE ARG 77 HE ARG 77 12.232 13.027 9.131 561 HH11 ARG 77 1HH1 ARG 77 10.972 11.557 6.181 562 HH12 ARG 77 2HH1 ARG 77 12.262 12.170 5.197 563 HH21 ARG 77 1HH2 ARG 77 13.891 13.844 7.795 564 HH22 ARG 77 2HH2 ARG 77 13.908 13.458 6.102 565 H TYR 78 H TYR 78 8.574 8.164 8.118 566 HA TYR 78 HA TYR 78 8.209 9.675 5.608 567 HB2 TYR 78 2HB TYR 78 6.468 7.652 7.067 568 HB3 TYR 78 1HB TYR 78 5.815 8.697 5.811 569 HD1 TYR 78 HD2 TYR 78 8.828 6.439 6.233 570 HD2 TYR 78 HD1 TYR 78 5.613 7.690 3.718 571 HE1 TYR 78 HE2 TYR 78 9.487 4.782 4.548 572 HE2 TYR 78 HE1 TYR 78 6.282 6.045 2.032 573 HH TYR 78 HH TYR 78 8.533 3.549 2.675 574 H LEU 79 H LEU 79 6.254 11.058 5.578 575 HA LEU 79 HA LEU 79 5.722 12.401 8.164 576 HB2 LEU 79 2HB LEU 79 5.955 13.575 5.365 577 HB3 LEU 79 1HB LEU 79 5.315 14.462 6.736 578 HG LEU 79 HG LEU 79 8.158 13.399 6.499 579 HD11 LEU 79 1HD1 LEU 79 7.147 16.260 6.423 580 HD12 LEU 79 2HD1 LEU 79 7.726 15.331 5.039 581 HD13 LEU 79 3HD1 LEU 79 8.835 15.741 6.343 582 HD21 LEU 79 3HD2 LEU 79 6.892 15.016 8.746 583 HD22 LEU 79 1HD2 LEU 79 8.610 14.630 8.599 584 HD23 LEU 79 2HD2 LEU 79 7.438 13.340 8.839 585 H HIS 80 H HIS 80 3.638 12.553 8.778 586 HA HIS 80 HA HIS 80 1.608 11.172 7.247 587 HB2 HIS 80 2HB HIS 80 1.689 10.856 9.665 588 HB3 HIS 80 1HB HIS 80 1.519 12.585 9.940 589 HD2 HIS 80 HD2 HIS 80 -0.826 10.389 7.642 590 HE1 HIS 80 HE1 HIS 80 -3.061 12.072 10.808 591 HE2 HIS 80 HE2 HIS 80 -3.117 10.500 8.826 592 H VAL 81 H VAL 81 1.050 12.287 5.513 593 HA VAL 81 HA VAL 81 0.471 15.178 5.656 594 HB VAL 81 HB VAL 81 0.623 15.159 3.191 595 HG11 VAL 81 1HG1 VAL 81 3.050 14.699 3.008 596 HG12 VAL 81 2HG1 VAL 81 3.007 13.841 4.552 597 HG13 VAL 81 3HG1 VAL 81 2.662 15.572 4.491 598 HG21 VAL 81 3HG2 VAL 81 1.315 13.125 1.968 599 HG22 VAL 81 1HG2 VAL 81 -0.229 12.872 2.777 600 HG23 VAL 81 2HG2 VAL 81 1.245 12.184 3.460 601 H ALA 82 H ALA 82 -1.173 12.118 5.311 602 HA ALA 82 HA ALA 82 -3.727 13.522 4.979 603 HB1 ALA 82 3HB ALA 82 -2.969 13.211 2.648 604 HB2 ALA 82 1HB ALA 82 -4.398 12.230 2.982 605 HB3 ALA 82 2HB ALA 82 -2.801 11.477 2.919 606 H THR 83 H THR 83 -5.559 12.218 5.364 607 HA THR 83 HA THR 83 -5.171 9.401 6.129 608 HB THR 83 HB THR 83 -7.007 11.348 7.626 609 HG1 THR 83 HG1 THR 83 -4.929 10.011 8.915 610 HG21 THR 83 3HG2 THR 83 -7.395 9.461 9.180 611 HG22 THR 83 1HG2 THR 83 -6.387 8.410 8.180 612 HG23 THR 83 2HG2 THR 83 -7.914 9.031 7.551 613 H LEU 84 H LEU 84 -6.701 8.104 5.236 614 HA LEU 84 HA LEU 84 -8.447 9.331 3.187 615 HB2 LEU 84 2HB LEU 84 -7.170 6.559 3.076 616 HB3 LEU 84 1HB LEU 84 -7.935 7.437 1.763 617 HG LEU 84 HG LEU 84 -5.259 8.107 3.053 618 HD11 LEU 84 1HD1 LEU 84 -5.852 7.052 0.274 619 HD12 LEU 84 2HD1 LEU 84 -5.136 6.141 1.606 620 HD13 LEU 84 3HD1 LEU 84 -4.259 7.496 0.899 621 HD21 LEU 84 3HD2 LEU 84 -6.355 10.189 2.405 622 HD22 LEU 84 1HD2 LEU 84 -6.646 9.562 0.779 623 HD23 LEU 84 2HD2 LEU 84 -4.997 9.854 1.336 624 H SER 85 H SER 85 -10.440 9.292 4.153 625 HA SER 85 HA SER 85 -11.292 6.951 5.727 626 HB2 SER 85 2HB SER 85 -12.489 9.734 5.416 627 HB3 SER 85 1HB SER 85 -13.220 8.444 6.380 628 HG SER 85 HG SER 85 -11.735 8.685 7.860 629 H PHE 86 H PHE 86 -12.664 5.509 4.940 630 HA PHE 86 HA PHE 86 -14.340 6.001 2.576 631 HB2 PHE 86 2HB PHE 86 -13.499 3.807 1.577 632 HB3 PHE 86 1HB PHE 86 -12.328 5.112 1.547 633 HD1 PHE 86 HD1 PHE 86 -10.341 5.066 3.007 634 HD2 PHE 86 HD2 PHE 86 -13.108 1.803 2.971 635 HE1 PHE 86 HE1 PHE 86 -8.693 3.653 4.150 636 HE2 PHE 86 HE2 PHE 86 -11.451 0.401 4.117 637 HZ PHE 86 HZ PHE 86 -9.246 1.320 4.707 638 H ASP 87 H ASP 87 -15.812 4.076 2.229 639 HA ASP 87 HA ASP 87 -16.581 2.764 4.751 640 HB2 ASP 87 2HB ASP 87 -18.430 3.707 3.469 641 HB3 ASP 87 1HB ASP 87 -17.926 2.861 2.009 642 H LEU 88 H LEU 88 -16.270 0.671 5.111 643 HA LEU 88 HA LEU 88 -15.901 -1.347 3.128 644 HB2 LEU 88 2HB LEU 88 -13.584 -0.440 3.169 645 HB3 LEU 88 1HB LEU 88 -13.520 -0.666 4.905 646 HG LEU 88 HG LEU 88 -13.759 -3.168 4.517 647 HD11 LEU 88 1HD1 LEU 88 -14.778 -3.146 2.297 648 HD12 LEU 88 2HD1 LEU 88 -13.287 -4.081 2.282 649 HD13 LEU 88 3HD1 LEU 88 -13.309 -2.453 1.602 650 HD21 LEU 88 3HD2 LEU 88 -11.573 -2.173 5.004 651 HD22 LEU 88 1HD2 LEU 88 -11.315 -1.849 3.287 652 HD23 LEU 88 2HD2 LEU 88 -11.407 -3.512 3.872 653 H ASP 89 H ASP 89 -16.920 -3.025 3.946 654 HA ASP 89 HA ASP 89 -17.824 -4.585 5.287 655 HB2 ASP 89 2HB ASP 89 -15.429 -4.902 5.990 656 HB3 ASP 89 1HB ASP 89 -15.707 -3.791 7.325 657 H GLY 90 H GLY 90 -19.088 -2.206 5.149 658 HA2 GLY 90 2HA GLY 90 -21.166 -1.595 5.916 659 HA3 GLY 90 1HA GLY 90 -20.930 -2.594 7.335 660 H GLU 91 H GLU 91 -18.297 -0.494 7.054 661 HA GLU 91 HA GLU 91 -19.512 1.774 8.422 662 HB2 GLU 91 2HB GLU 91 -18.163 1.579 10.464 663 HB3 GLU 91 1HB GLU 91 -19.150 0.136 10.260 664 HG2 GLU 91 2HG GLU 91 -17.214 -1.106 9.409 665 HG3 GLU 91 1HG GLU 91 -16.214 0.340 9.545 666 H SER 92 H SER 92 -17.829 3.408 9.035 667 HA SER 92 HA SER 92 -16.120 3.876 6.747 668 HB2 SER 92 2HB SER 92 -17.431 5.743 7.658 669 HB3 SER 92 1HB SER 92 -16.630 5.584 9.226 670 HG SER 92 HG SER 92 -15.352 6.193 6.745 671 H ARG 93 H ARG 93 -14.202 2.922 6.682 672 HA ARG 93 HA ARG 93 -12.480 2.620 9.077 673 HB2 ARG 93 2HB ARG 93 -11.989 1.599 6.242 674 HB3 ARG 93 1HB ARG 93 -11.144 1.112 7.697 675 HG2 ARG 93 2HG ARG 93 -14.059 0.525 7.132 676 HG3 ARG 93 1HG ARG 93 -12.737 -0.589 6.798 677 HD2 ARG 93 2HD ARG 93 -12.192 -0.623 9.223 678 HD3 ARG 93 1HD ARG 93 -13.572 0.438 9.531 679 HE ARG 93 HE ARG 93 -14.682 -1.620 8.169 680 HH11 ARG 93 1HH1 ARG 93 -12.724 -1.503 11.084 681 HH12 ARG 93 2HH1 ARG 93 -13.434 -2.938 11.757 682 HH21 ARG 93 1HH2 ARG 93 -15.625 -3.478 9.082 683 HH22 ARG 93 2HH2 ARG 93 -15.067 -4.051 10.621 684 H ASP 94 H ASP 94 -10.297 3.558 8.990 685 HA ASP 94 HA ASP 94 -9.783 5.439 6.751 686 HB2 ASP 94 2HB ASP 94 -8.932 7.133 8.253 687 HB3 ASP 94 1HB ASP 94 -10.561 6.710 8.753 688 H LEU 95 H LEU 95 -7.778 5.488 5.967 689 HA LEU 95 HA LEU 95 -5.572 4.066 7.350 690 HB2 LEU 95 2HB LEU 95 -6.117 4.091 4.349 691 HB3 LEU 95 1HB LEU 95 -4.686 3.410 5.110 692 HG LEU 95 HG LEU 95 -7.531 2.384 5.366 693 HD11 LEU 95 1HD1 LEU 95 -6.473 1.843 3.233 694 HD12 LEU 95 2HD1 LEU 95 -6.673 0.398 4.219 695 HD13 LEU 95 3HD1 LEU 95 -5.082 1.150 4.076 696 HD21 LEU 95 3HD2 LEU 95 -6.608 0.557 6.735 697 HD22 LEU 95 1HD2 LEU 95 -6.402 2.122 7.517 698 HD23 LEU 95 2HD2 LEU 95 -5.028 1.344 6.730 699 H HIS 96 H HIS 96 -3.730 5.245 7.501 700 HA HIS 96 HA HIS 96 -3.897 8.047 6.676 701 HB2 HIS 96 2HB HIS 96 -1.904 6.589 8.476 702 HB3 HIS 96 1HB HIS 96 -1.946 8.330 8.204 703 HD2 HIS 96 HD2 HIS 96 -4.502 5.641 9.630 704 HE1 HIS 96 HE1 HIS 96 -4.953 9.315 11.661 705 HE2 HIS 96 HE2 HIS 96 -5.949 7.029 11.255 706 H ALA 97 H ALA 97 -2.677 8.920 5.103 707 HA ALA 97 HA ALA 97 -0.931 7.178 3.492 708 HB1 ALA 97 3HB ALA 97 -2.847 8.182 2.314 709 HB2 ALA 97 1HB ALA 97 -1.326 8.812 1.677 710 HB3 ALA 97 2HB ALA 97 -2.306 9.796 2.769 711 H PHE 98 H PHE 98 1.186 7.527 3.533 712 HA PHE 98 HA PHE 98 2.271 10.087 4.586 713 HB2 PHE 98 2HB PHE 98 3.664 7.391 4.892 714 HB3 PHE 98 1HB PHE 98 3.959 8.888 5.762 715 HD1 PHE 98 HD1 PHE 98 2.495 9.540 7.653 716 HD2 PHE 98 HD2 PHE 98 1.969 5.815 5.641 717 HE1 PHE 98 HE1 PHE 98 1.185 8.691 9.550 718 HE2 PHE 98 HE2 PHE 98 0.669 4.971 7.545 719 HZ PHE 98 HZ PHE 98 0.272 6.409 9.501 720 H ARG 99 H ARG 99 4.478 10.475 3.881 721 HA ARG 99 HA ARG 99 5.604 9.033 1.629 722 HB2 ARG 99 2HB ARG 99 5.725 10.998 0.147 723 HB3 ARG 99 1HB ARG 99 4.059 10.571 0.491 724 HG2 ARG 99 2HG ARG 99 4.445 12.441 2.430 725 HG3 ARG 99 1HG ARG 99 5.580 13.032 1.218 726 HD2 ARG 99 2HD ARG 99 2.630 12.501 0.792 727 HD3 ARG 99 1HD ARG 99 3.377 14.078 0.993 728 HE ARG 99 HE ARG 99 4.450 12.565 -1.217 729 HH11 ARG 99 1HH1 ARG 99 1.876 14.773 -0.270 730 HH12 ARG 99 2HH1 ARG 99 1.582 15.312 -1.893 731 HH21 ARG 99 1HH2 ARG 99 4.021 13.222 -3.328 732 HH22 ARG 99 2HH2 ARG 99 2.796 14.438 -3.629 733 H GLN 100 H GLN 100 7.862 9.413 1.480 734 HA GLN 100 HA GLN 100 9.032 9.342 3.920 735 HB2 GLN 100 2HB GLN 100 10.377 9.979 1.284 736 HB3 GLN 100 1HB GLN 100 11.247 9.532 2.749 737 HG2 GLN 100 2HG GLN 100 9.973 7.370 2.776 738 HG3 GLN 100 1HG GLN 100 9.268 7.815 1.226 739 HE21 GLN 100 1HE2 GLN 100 12.647 8.405 2.158 740 HE22 GLN 100 2HE2 GLN 100 13.329 7.286 1.036 741 H ALA 101 H ALA 101 10.105 12.071 1.811 742 HA ALA 101 HA ALA 101 9.924 13.830 4.202 743 HB1 ALA 101 3HB ALA 101 12.253 13.426 3.545 744 HB2 ALA 101 1HB ALA 101 11.814 15.116 3.298 745 HB3 ALA 101 2HB ALA 101 11.921 14.020 1.919 746 H ALA 102 H ALA 102 10.363 14.481 0.713 747 HA ALA 102 HA ALA 102 7.911 16.138 0.704 748 HB1 ALA 102 3HB ALA 102 9.870 17.603 1.103 749 HB2 ALA 102 1HB ALA 102 9.124 17.925 -0.466 750 HB3 ALA 102 2HB ALA 102 10.621 16.999 -0.372 751 H ASP 103 H ASP 103 7.969 13.562 -0.269 752 HA ASP 103 HA ASP 103 8.710 13.037 -2.898 753 HB2 ASP 103 2HB ASP 103 7.883 11.180 -1.675 754 HB3 ASP 103 1HB ASP 103 6.457 12.046 -1.131 755 H GLU 104 H GLU 104 7.927 13.570 -4.882 756 HA GLU 104 HA GLU 104 5.166 14.584 -5.177 757 HB2 GLU 104 2HB GLU 104 5.978 16.187 -6.921 758 HB3 GLU 104 1HB GLU 104 6.573 16.552 -5.307 759 HG2 GLU 104 2HG GLU 104 8.758 15.566 -5.868 760 HG3 GLU 104 1HG GLU 104 8.166 15.160 -7.480 761 H SER 105 H SER 105 7.042 12.077 -5.708 762 HA SER 105 HA SER 105 6.455 11.447 -8.487 763 HB2 SER 105 2HB SER 105 8.574 10.736 -7.316 764 HB3 SER 105 1HB SER 105 7.614 9.713 -6.250 765 HG SER 105 HG SER 105 6.917 8.589 -8.170 766 H ARG 106 H ARG 106 4.412 11.820 -6.156 767 HA ARG 106 HA ARG 106 2.243 11.271 -5.808 768 HB2 ARG 106 2HB ARG 106 2.582 9.176 -8.002 769 HB3 ARG 106 1HB ARG 106 1.055 9.702 -7.322 770 HG2 ARG 106 2HG ARG 106 2.925 11.360 -9.034 771 HG3 ARG 106 1HG ARG 106 1.390 10.649 -9.525 772 HD2 ARG 106 2HD ARG 106 0.677 12.790 -9.109 773 HD3 ARG 106 1HD ARG 106 0.466 12.126 -7.490 774 HE ARG 106 HE ARG 106 2.820 13.718 -8.353 775 HH11 ARG 106 1HH1 ARG 106 0.512 12.830 -5.861 776 HH12 ARG 106 2HH1 ARG 106 1.139 13.966 -4.707 777 HH21 ARG 106 1HH2 ARG 106 3.557 15.282 -6.889 778 HH22 ARG 106 2HH2 ARG 106 2.871 15.364 -5.291 779 H THR 107 H THR 107 4.708 9.623 -4.705 780 HA THR 107 HA THR 107 3.636 6.929 -4.491 781 HB THR 107 HB THR 107 6.256 8.001 -3.355 782 HG1 THR 107 HG1 THR 107 5.567 7.946 -5.868 783 HG21 THR 107 3HG2 THR 107 6.987 5.642 -3.517 784 HG22 THR 107 1HG2 THR 107 5.390 5.176 -4.125 785 HG23 THR 107 2HG2 THR 107 5.574 5.775 -2.477 786 H LEU 108 H LEU 108 1.859 7.269 -3.181 787 HA LEU 108 HA LEU 108 2.182 8.103 -0.386 788 HB2 LEU 108 2HB LEU 108 -0.298 7.163 -1.886 789 HB3 LEU 108 1HB LEU 108 -0.268 7.861 -0.272 790 HG LEU 108 HG LEU 108 0.483 9.341 -2.824 791 HD11 LEU 108 1HD1 LEU 108 -1.905 8.849 -2.736 792 HD12 LEU 108 2HD1 LEU 108 -1.617 10.570 -2.501 793 HD13 LEU 108 3HD1 LEU 108 -2.014 9.548 -1.117 794 HD21 LEU 108 3HD2 LEU 108 1.740 10.213 -0.910 795 HD22 LEU 108 1HD2 LEU 108 0.253 10.371 0.030 796 HD23 LEU 108 2HD2 LEU 108 0.508 11.370 -1.403 797 H PHE 109 H PHE 109 2.528 6.645 1.152 798 HA PHE 109 HA PHE 109 2.197 3.764 0.550 799 HB2 PHE 109 2HB PHE 109 4.544 4.694 0.975 800 HB3 PHE 109 1HB PHE 109 4.039 5.046 2.623 801 HD1 PHE 109 HD1 PHE 109 4.672 2.307 0.181 802 HD2 PHE 109 HD2 PHE 109 3.929 3.277 4.275 803 HE1 PHE 109 HE1 PHE 109 5.329 0.027 0.847 804 HE2 PHE 109 HE2 PHE 109 4.584 1.007 4.940 805 HZ PHE 109 HZ PHE 109 5.289 -0.626 3.225 806 H VAL 110 H VAL 110 0.489 2.906 1.554 807 HA VAL 110 HA VAL 110 -0.384 3.936 4.188 808 HB VAL 110 HB VAL 110 -2.720 3.229 3.666 809 HG11 VAL 110 1HG1 VAL 110 -3.301 5.089 2.145 810 HG12 VAL 110 2HG1 VAL 110 -1.602 5.254 1.695 811 HG13 VAL 110 3HG1 VAL 110 -2.112 5.574 3.353 812 HG21 VAL 110 3HG2 VAL 110 -2.295 1.521 1.946 813 HG22 VAL 110 1HG2 VAL 110 -1.726 2.761 0.825 814 HG23 VAL 110 2HG2 VAL 110 -3.415 2.738 1.340 815 HA PRO 111 HA PRO 111 0.069 -0.473 5.274 816 HB2 PRO 111 2HB PRO 111 0.305 -0.099 7.973 817 HB3 PRO 111 1HB PRO 111 1.663 0.139 6.861 818 HG2 PRO 111 2HG PRO 111 0.021 2.172 8.264 819 HG3 PRO 111 1HG PRO 111 1.717 2.249 7.746 820 HD2 PRO 111 2HD PRO 111 -0.509 3.392 6.401 821 HD3 PRO 111 1HD PRO 111 1.145 3.243 5.774 822 H PHE 112 H PHE 112 -1.582 -1.868 5.884 823 HA PHE 112 HA PHE 112 -3.640 -0.958 7.697 824 HB2 PHE 112 2HB PHE 112 -5.533 -1.708 6.391 825 HB3 PHE 112 1HB PHE 112 -4.648 -0.483 5.513 826 HD1 PHE 112 HD1 PHE 112 -3.017 -1.323 3.633 827 HD2 PHE 112 HD2 PHE 112 -6.163 -3.693 5.306 828 HE1 PHE 112 HE1 PHE 112 -3.055 -2.727 1.614 829 HE2 PHE 112 HE2 PHE 112 -6.178 -5.089 3.288 830 HZ PHE 112 HZ PHE 112 -4.633 -4.605 1.439 831 H ARG 113 H ARG 113 -3.818 -2.406 9.261 832 HA ARG 113 HA ARG 113 -2.853 -5.168 8.772 833 HB2 ARG 113 2HB ARG 113 -1.681 -3.847 10.558 834 HB3 ARG 113 1HB ARG 113 -3.204 -3.724 11.441 835 HG2 ARG 113 2HG ARG 113 -3.291 -6.164 11.691 836 HG3 ARG 113 1HG ARG 113 -1.823 -6.335 10.726 837 HD2 ARG 113 2HD ARG 113 -0.628 -4.966 12.498 838 HD3 ARG 113 1HD ARG 113 -2.092 -5.101 13.477 839 HE ARG 113 HE ARG 113 -1.789 -7.545 13.395 840 HH11 ARG 113 1HH1 ARG 113 1.028 -5.526 12.807 841 HH12 ARG 113 2HH1 ARG 113 2.156 -6.753 13.285 842 HH21 ARG 113 1HH2 ARG 113 -0.302 -9.161 13.956 843 HH22 ARG 113 2HH2 ARG 113 1.401 -8.817 13.934 844 H ASP 114 H ASP 114 -4.396 -6.773 8.744 845 HA ASP 114 HA ASP 114 -7.158 -6.000 9.449 846 HB2 ASP 114 2HB ASP 114 -7.936 -6.792 7.337 847 HB3 ASP 114 1HB ASP 114 -6.526 -5.818 6.943 848 H LYS 115 H LYS 115 -8.243 -8.575 8.649 849 HA LYS 115 HA LYS 115 -7.436 -10.119 10.975 850 HB2 LYS 115 2HB LYS 115 -9.654 -10.603 8.962 851 HB3 LYS 115 1HB LYS 115 -9.364 -11.616 10.364 852 HG2 LYS 115 2HG LYS 115 -10.158 -8.686 10.447 853 HG3 LYS 115 1HG LYS 115 -11.240 -10.053 10.683 854 HD2 LYS 115 2HD LYS 115 -10.829 -9.465 12.890 855 HD3 LYS 115 1HD LYS 115 -9.559 -10.663 12.654 856 HE2 LYS 115 2HE LYS 115 -7.930 -8.844 12.257 857 HE3 LYS 115 1HE LYS 115 -9.209 -7.647 12.469 858 HZ1 LYS 115 3HZ LYS 115 -9.496 -8.396 14.732 859 HZ2 LYS 115 1HZ LYS 115 -7.887 -7.940 14.470 860 HZ3 LYS 115 2HZ LYS 115 -8.301 -9.579 14.533 861 H THR 116 H THR 116 -6.627 -10.221 7.577 862 HA THR 116 HA THR 116 -6.046 -13.083 7.586 863 HB THR 116 HB THR 116 -5.340 -12.886 5.290 864 HG1 THR 116 HG1 THR 116 -5.545 -10.050 5.491 865 HG21 THR 116 3HG2 THR 116 -7.327 -11.907 4.197 866 HG22 THR 116 1HG2 THR 116 -7.758 -11.080 5.694 867 HG23 THR 116 2HG2 THR 116 -7.789 -12.846 5.618 868 H THR 117 H THR 117 -4.410 -10.160 8.373 869 HA THR 117 HA THR 117 -1.726 -10.699 7.981 870 HB THR 117 HB THR 117 -3.100 -9.267 10.296 871 HG1 THR 117 HG1 THR 117 -3.160 -8.579 7.878 872 HG21 THR 117 3HG2 THR 117 -0.938 -8.099 10.665 873 HG22 THR 117 1HG2 THR 117 -0.175 -9.141 9.462 874 HG23 THR 117 2HG2 THR 117 -0.792 -9.830 10.964 875 H GLY 118 H GLY 118 -0.779 -12.643 8.460 876 HA2 GLY 118 2HA GLY 118 0.332 -14.163 9.804 877 HA3 GLY 118 1HA GLY 118 -0.431 -13.463 11.224 878 H GLN 119 H GLN 119 -2.548 -14.323 8.667 879 HA GLN 119 HA GLN 119 -3.391 -16.834 9.999 880 HB2 GLN 119 2HB GLN 119 -5.268 -14.633 8.988 881 HB3 GLN 119 1HB GLN 119 -5.764 -16.148 9.733 882 HG2 GLN 119 2HG GLN 119 -4.188 -13.968 11.131 883 HG3 GLN 119 1HG GLN 119 -5.931 -14.178 11.253 884 HE21 GLN 119 1HE2 GLN 119 -3.891 -14.245 13.350 885 HE22 GLN 119 2HE2 GLN 119 -4.055 -15.777 14.127 886 H GLN 120 H GLN 120 -4.593 -14.918 7.231 887 HA GLN 120 HA GLN 120 -4.364 -17.260 5.452 888 HB2 GLN 120 2HB GLN 120 -5.676 -14.653 4.637 889 HB3 GLN 120 1HB GLN 120 -6.005 -16.279 4.065 890 HG2 GLN 120 2HG GLN 120 -6.813 -15.090 6.725 891 HG3 GLN 120 1HG GLN 120 -7.874 -15.462 5.374 892 HE21 GLN 120 1HE2 GLN 120 -8.020 -16.344 8.133 893 HE22 GLN 120 2HE2 GLN 120 -8.000 -18.068 8.101 894 H SER 121 H SER 121 -2.709 -14.557 6.332 895 HA SER 121 HA SER 121 -0.980 -14.485 3.966 896 HB2 SER 121 2HB SER 121 -2.663 -12.609 3.739 897 HB3 SER 121 1HB SER 121 -2.136 -11.977 5.298 898 HG SER 121 HG SER 121 -1.016 -11.687 2.836 899 H TYR 122 H TYR 122 1.034 -13.029 4.638 900 HA TYR 122 HA TYR 122 2.099 -14.196 7.057 901 HB2 TYR 122 2HB TYR 122 3.344 -13.615 4.781 902 HB3 TYR 122 1HB TYR 122 3.540 -12.019 5.491 903 HD1 TYR 122 HD1 TYR 122 4.688 -11.947 7.882 904 HD2 TYR 122 HD2 TYR 122 4.928 -15.312 5.265 905 HE1 TYR 122 HE1 TYR 122 6.669 -12.740 9.087 906 HE2 TYR 122 HE2 TYR 122 6.915 -16.107 6.471 907 HH TYR 122 HH TYR 122 8.704 -15.166 7.894 908 H ASP 123 H ASP 123 2.933 -12.979 8.877 909 HA ASP 123 HA ASP 123 1.090 -10.938 9.780 910 HB2 ASP 123 2HB ASP 123 2.009 -12.845 11.211 911 HB3 ASP 123 1HB ASP 123 3.539 -11.983 11.267 912 H GLY 124 H GLY 124 1.916 -8.953 10.922 913 HA2 GLY 124 2HA GLY 124 3.621 -7.195 10.992 914 HA3 GLY 124 1HA GLY 124 4.057 -7.607 9.334 915 H GLY 125 H GLY 125 1.237 -8.053 8.611 916 HA2 GLY 125 2HA GLY 125 -0.771 -6.553 8.628 917 HA3 GLY 125 1HA GLY 125 0.355 -5.233 8.314 918 H ARG 126 H ARG 126 -1.387 -5.214 6.545 919 HA ARG 126 HA ARG 126 -0.197 -6.446 4.127 920 HB2 ARG 126 2HB ARG 126 -3.034 -5.413 4.632 921 HB3 ARG 126 1HB ARG 126 -2.428 -5.859 3.044 922 HG2 ARG 126 2HG ARG 126 -2.452 -7.845 5.323 923 HG3 ARG 126 1HG ARG 126 -3.880 -7.564 4.331 924 HD2 ARG 126 2HD ARG 126 -2.636 -9.509 3.544 925 HD3 ARG 126 1HD ARG 126 -2.645 -8.238 2.326 926 HE ARG 126 HE ARG 126 -0.332 -8.923 4.054 927 HH11 ARG 126 1HH1 ARG 126 -1.564 -7.718 0.976 928 HH12 ARG 126 2HH1 ARG 126 0.010 -7.568 0.265 929 HH21 ARG 126 1HH2 ARG 126 1.717 -8.694 3.094 930 HH22 ARG 126 2HH2 ARG 126 1.859 -8.116 1.461 931 H TYR 127 H TYR 127 0.653 -4.982 2.675 932 HA TYR 127 HA TYR 127 0.538 -2.117 3.455 933 HB2 TYR 127 2HB TYR 127 2.939 -3.788 2.579 934 HB3 TYR 127 1HB TYR 127 2.954 -2.022 2.603 935 HD1 TYR 127 HD2 TYR 127 2.584 -5.040 4.793 936 HD2 TYR 127 HD1 TYR 127 3.224 -0.821 4.682 937 HE1 TYR 127 HE2 TYR 127 3.121 -5.059 7.193 938 HE2 TYR 127 HE1 TYR 127 3.748 -0.841 7.075 939 HH TYR 127 HH TYR 127 4.350 -3.694 8.822 940 H MET 128 H MET 128 0.336 -0.648 1.873 941 HA MET 128 HA MET 128 -0.198 -1.602 -0.859 942 HB2 MET 128 2HB MET 128 -2.250 -1.335 1.035 943 HB3 MET 128 1HB MET 128 -2.258 0.256 0.283 944 HG2 MET 128 2HG MET 128 -2.371 -2.263 -1.375 945 HG3 MET 128 1HG MET 128 -3.816 -1.500 -0.716 946 HE1 MET 128 3HE MET 128 -4.212 1.728 -2.662 947 HE2 MET 128 1HE MET 128 -3.646 1.498 -1.006 948 HE3 MET 128 2HE MET 128 -4.957 0.496 -1.638 949 H GLU 129 H GLU 129 0.066 0.007 -2.440 950 HA GLU 129 HA GLU 129 1.068 2.650 -1.560 951 HB2 GLU 129 2HB GLU 129 2.994 1.160 -1.996 952 HB3 GLU 129 1HB GLU 129 2.363 0.771 -3.590 953 HG2 GLU 129 2HG GLU 129 2.648 3.154 -4.261 954 HG3 GLU 129 1HG GLU 129 3.344 3.497 -2.677 955 H LEU 130 H LEU 130 0.050 4.242 -2.593 956 HA LEU 130 HA LEU 130 -1.379 3.730 -5.133 957 HB2 LEU 130 2HB LEU 130 -1.858 6.149 -3.345 958 HB3 LEU 130 1HB LEU 130 -2.890 5.484 -4.597 959 HG LEU 130 HG LEU 130 -3.015 3.386 -2.927 960 HD11 LEU 130 1HD1 LEU 130 -3.005 4.055 -0.571 961 HD12 LEU 130 2HD1 LEU 130 -2.432 5.664 -1.015 962 HD13 LEU 130 3HD1 LEU 130 -1.410 4.252 -1.297 963 HD21 LEU 130 3HD2 LEU 130 -4.925 4.755 -3.699 964 HD22 LEU 130 1HD2 LEU 130 -4.609 5.901 -2.397 965 HD23 LEU 130 2HD2 LEU 130 -5.083 4.243 -2.024 966 H GLU 131 H GLU 131 -0.931 5.013 -6.875 967 HA GLU 131 HA GLU 131 0.680 7.456 -6.522 968 HB2 GLU 131 2HB GLU 131 1.049 5.342 -8.688 969 HB3 GLU 131 1HB GLU 131 1.724 6.969 -8.792 970 HG2 GLU 131 2HG GLU 131 3.092 6.600 -6.814 971 HG3 GLU 131 1HG GLU 131 2.328 5.038 -6.531 972 HA PRO 132 HA PRO 132 -3.537 8.425 -8.192 973 HB2 PRO 132 2HB PRO 132 -3.526 11.041 -7.222 974 HB3 PRO 132 1HB PRO 132 -4.018 9.630 -6.271 975 HG2 PRO 132 2HG PRO 132 -1.367 11.028 -6.310 976 HG3 PRO 132 1HG PRO 132 -2.319 10.457 -4.918 977 HD2 PRO 132 2HD PRO 132 -0.243 9.034 -5.815 978 HD3 PRO 132 1HD PRO 132 -1.719 8.221 -5.247 979 H ASP 133 H ASP 133 -4.365 10.246 -9.489 980 HA ASP 133 HA ASP 133 -2.901 10.673 -11.871 981 HB2 ASP 133 2HB ASP 133 -5.339 10.526 -11.849 982 HB3 ASP 133 1HB ASP 133 -5.469 11.890 -10.749 983 H ARG 134 H ARG 134 -3.056 12.434 -8.902 984 HA ARG 134 HA ARG 134 -1.386 14.588 -9.770 985 HB2 ARG 134 2HB ARG 134 -3.091 16.396 -9.054 986 HB3 ARG 134 1HB ARG 134 -3.334 15.646 -10.620 987 HG2 ARG 134 2HG ARG 134 -5.482 15.932 -9.560 988 HG3 ARG 134 1HG ARG 134 -5.123 14.210 -9.638 989 HD2 ARG 134 2HD ARG 134 -4.553 14.185 -7.264 990 HD3 ARG 134 1HD ARG 134 -4.736 15.934 -7.169 991 HE ARG 134 HE ARG 134 -7.005 15.688 -7.020 992 HH11 ARG 134 1HH1 ARG 134 -5.686 12.587 -8.014 993 HH12 ARG 134 2HH1 ARG 134 -7.175 11.740 -7.768 994 HH21 ARG 134 1HH2 ARG 134 -8.921 14.568 -6.645 995 HH22 ARG 134 2HH2 ARG 134 -9.017 12.865 -6.991 996 H ASP 135 H ASP 135 -1.423 16.317 -7.730 997 HA ASP 135 HA ASP 135 -0.833 14.687 -5.377 998 HB2 ASP 135 2HB ASP 135 0.610 16.693 -6.126 999 HB3 ASP 135 1HB ASP 135 -0.672 17.731 -5.502 1000 H LEU 136 H LEU 136 -1.945 14.785 -3.438 1001 HA LEU 136 HA LEU 136 -4.782 15.436 -3.757 1002 HB2 LEU 136 2HB LEU 136 -3.336 13.764 -1.664 1003 HB3 LEU 136 1HB LEU 136 -5.077 13.973 -1.759 1004 HG LEU 136 HG LEU 136 -3.340 12.567 -3.829 1005 HD11 LEU 136 1HD1 LEU 136 -3.633 11.275 -1.760 1006 HD12 LEU 136 2HD1 LEU 136 -4.467 10.519 -3.113 1007 HD13 LEU 136 3HD1 LEU 136 -5.385 11.420 -1.906 1008 HD21 LEU 136 3HD2 LEU 136 -5.451 11.938 -4.947 1009 HD22 LEU 136 1HD2 LEU 136 -5.210 13.684 -4.948 1010 HD23 LEU 136 2HD2 LEU 136 -6.354 12.953 -3.821 1011 H SER 137 H SER 137 -5.810 16.899 -2.565 1012 HA SER 137 HA SER 137 -4.530 18.161 -0.218 1013 HB2 SER 137 2HB SER 137 -5.694 20.317 -0.868 1014 HB3 SER 137 1HB SER 137 -4.413 19.836 -1.981 1015 HG SER 137 HG SER 137 -6.067 18.926 -3.313 1016 H ASP 138 H ASP 138 -6.243 19.153 1.219 1017 HA ASP 138 HA ASP 138 -8.072 17.189 2.033 1018 HB2 ASP 138 2HB ASP 138 -8.911 18.859 3.648 1019 HB3 ASP 138 1HB ASP 138 -7.155 18.858 3.600 1020 H GLY 139 H GLY 139 -9.807 16.557 0.948 1021 HA2 GLY 139 2HA GLY 139 -12.183 17.226 0.482 1022 HA3 GLY 139 1HA GLY 139 -11.523 18.545 -0.478 1023 H ASP 140 H ASP 140 -9.327 16.661 -1.463 1024 HA ASP 140 HA ASP 140 -10.551 15.683 -3.833 1025 HB2 ASP 140 2HB ASP 140 -7.805 15.281 -2.604 1026 HB3 ASP 140 1HB ASP 140 -8.270 14.308 -3.995 1027 H GLU 141 H GLU 141 -10.604 13.410 -4.565 1028 HA GLU 141 HA GLU 141 -10.935 11.429 -2.380 1029 HB2 GLU 141 2HB GLU 141 -12.211 11.411 -5.157 1030 HB3 GLU 141 1HB GLU 141 -12.490 10.238 -3.869 1031 HG2 GLU 141 2HG GLU 141 -13.411 12.106 -2.455 1032 HG3 GLU 141 1HG GLU 141 -13.250 13.168 -3.850 1033 H ILE 142 H ILE 142 -10.346 9.209 -2.948 1034 HA ILE 142 HA ILE 142 -8.307 8.798 -4.979 1035 HB ILE 142 HB ILE 142 -7.013 9.825 -3.135 1036 HG12 ILE 142 2HG1 ILE 142 -5.308 8.020 -2.777 1037 HG13 ILE 142 1HG1 ILE 142 -6.455 6.832 -3.382 1038 HG21 ILE 142 1HG2 ILE 142 -8.465 9.274 -1.245 1039 HG22 ILE 142 2HG2 ILE 142 -6.810 8.759 -0.920 1040 HG23 ILE 142 3HG2 ILE 142 -8.030 7.568 -1.374 1041 HD11 ILE 142 3HD1 ILE 142 -6.391 7.872 -5.588 1042 HD12 ILE 142 1HD1 ILE 142 -4.773 7.429 -5.041 1043 HD13 ILE 142 2HD1 ILE 142 -5.290 9.114 -4.982 1044 H THR 143 H THR 143 -8.046 6.623 -5.466 1045 HA THR 143 HA THR 143 -10.103 4.800 -4.453 1046 HB THR 143 HB THR 143 -8.228 4.534 -6.856 1047 HG1 THR 143 HG1 THR 143 -10.169 5.214 -8.019 1048 HG21 THR 143 3HG2 THR 143 -9.923 2.935 -7.689 1049 HG22 THR 143 1HG2 THR 143 -10.822 3.103 -6.179 1050 HG23 THR 143 2HG2 THR 143 -9.208 2.387 -6.173 1051 H LEU 144 H LEU 144 -9.554 3.239 -2.965 1052 HA LEU 144 HA LEU 144 -6.721 2.630 -2.398 1053 HB2 LEU 144 2HB LEU 144 -9.254 2.559 -0.734 1054 HB3 LEU 144 1HB LEU 144 -7.915 1.532 -0.281 1055 HG LEU 144 HG LEU 144 -8.078 3.654 1.035 1056 HD11 LEU 144 1HD1 LEU 144 -5.509 3.329 -0.544 1057 HD12 LEU 144 2HD1 LEU 144 -5.956 2.465 0.926 1058 HD13 LEU 144 3HD1 LEU 144 -5.679 4.203 0.981 1059 HD21 LEU 144 3HD2 LEU 144 -8.859 5.160 -0.747 1060 HD22 LEU 144 1HD2 LEU 144 -7.288 5.049 -1.544 1061 HD23 LEU 144 2HD2 LEU 144 -7.423 5.792 0.052 1062 H ASP 145 H ASP 145 -6.288 1.011 -3.873 1063 HA ASP 145 HA ASP 145 -8.026 -1.307 -4.173 1064 HB2 ASP 145 2HB ASP 145 -5.436 -0.405 -5.460 1065 HB3 ASP 145 1HB ASP 145 -6.027 -2.048 -5.690 1066 H PHE 146 H PHE 146 -7.988 -2.352 -2.177 1067 HA PHE 146 HA PHE 146 -5.551 -3.192 -0.865 1068 HB2 PHE 146 2HB PHE 146 -8.319 -4.390 -0.451 1069 HB3 PHE 146 1HB PHE 146 -6.972 -4.334 0.684 1070 HD1 PHE 146 HD2 PHE 146 -6.093 -1.694 0.940 1071 HD2 PHE 146 HD1 PHE 146 -10.088 -3.044 0.216 1072 HE1 PHE 146 HE2 PHE 146 -6.979 0.375 1.900 1073 HE2 PHE 146 HE1 PHE 146 -10.959 -0.965 1.182 1074 HZ PHE 146 HZ PHE 146 -9.403 0.743 2.020 1075 H ASN 147 H ASN 147 -7.486 -4.277 -3.425 1076 HA ASN 147 HA ASN 147 -6.745 -7.051 -3.484 1077 HB2 ASN 147 2HB ASN 147 -7.866 -7.051 -5.666 1078 HB3 ASN 147 1HB ASN 147 -8.854 -6.205 -4.481 1079 HD21 ASN 147 1HD2 ASN 147 -8.993 -3.896 -4.629 1080 HD22 ASN 147 2HD2 ASN 147 -8.643 -3.077 -6.108 1081 H LEU 148 H LEU 148 -5.034 -4.211 -4.152 1082 HA LEU 148 HA LEU 148 -3.061 -5.670 -5.819 1083 HB2 LEU 148 2HB LEU 148 -3.426 -2.651 -5.554 1084 HB3 LEU 148 1HB LEU 148 -2.294 -3.471 -6.616 1085 HG LEU 148 HG LEU 148 -5.324 -3.409 -6.885 1086 HD11 LEU 148 1HD1 LEU 148 -3.168 -2.253 -8.680 1087 HD12 LEU 148 2HD1 LEU 148 -4.233 -1.342 -7.607 1088 HD13 LEU 148 3HD1 LEU 148 -4.908 -2.206 -8.985 1089 HD21 LEU 148 3HD2 LEU 148 -3.345 -4.938 -8.601 1090 HD22 LEU 148 1HD2 LEU 148 -5.060 -4.716 -8.964 1091 HD23 LEU 148 2HD2 LEU 148 -4.574 -5.629 -7.539 1092 H ALA 149 H ALA 149 -3.515 -5.529 -2.771 1093 HA ALA 149 HA ALA 149 -1.401 -3.947 -1.682 1094 HB1 ALA 149 3HB ALA 149 -3.345 -4.580 -0.318 1095 HB2 ALA 149 1HB ALA 149 -1.841 -5.097 0.446 1096 HB3 ALA 149 2HB ALA 149 -2.861 -6.272 -0.390 1097 H TYR 150 H TYR 150 0.669 -4.401 -1.352 1098 HA TYR 150 HA TYR 150 1.760 -6.628 -2.905 1099 HB2 TYR 150 2HB TYR 150 3.243 -4.236 -1.731 1100 HB3 TYR 150 1HB TYR 150 3.758 -5.269 -3.066 1101 HD1 TYR 150 HD1 TYR 150 2.282 -5.225 -5.230 1102 HD2 TYR 150 HD2 TYR 150 2.036 -2.227 -2.189 1103 HE1 TYR 150 HE1 TYR 150 1.216 -3.683 -6.818 1104 HE2 TYR 150 HE2 TYR 150 0.984 -0.691 -3.792 1105 HH TYR 150 HH TYR 150 0.790 -0.335 -6.156 1106 H SER 151 H SER 151 3.360 -8.064 -2.124 1107 HA SER 151 HA SER 151 3.673 -8.719 0.551 1108 HB2 SER 151 2HB SER 151 5.792 -9.881 -0.268 1109 HB3 SER 151 1HB SER 151 4.331 -10.280 -1.163 1110 HG SER 151 HG SER 151 6.021 -8.203 -2.039 1111 HA PRO 152 HA PRO 152 6.339 -5.182 1.683 1112 HB2 PRO 152 2HB PRO 152 6.213 -5.432 4.378 1113 HB3 PRO 152 1HB PRO 152 4.826 -4.853 3.434 1114 HG2 PRO 152 2HG PRO 152 5.302 -7.551 4.606 1115 HG3 PRO 152 1HG PRO 152 3.796 -6.617 4.509 1116 HD2 PRO 152 2HD PRO 152 4.493 -8.673 2.763 1117 HD3 PRO 152 1HD PRO 152 3.309 -7.399 2.408 1118 H PHE 153 H PHE 153 8.488 -5.065 1.910 1119 HA PHE 153 HA PHE 153 10.243 -7.130 1.736 1120 HB2 PHE 153 2HB PHE 153 10.878 -4.429 2.988 1121 HB3 PHE 153 1HB PHE 153 11.986 -5.482 2.117 1122 HD1 PHE 153 HD2 PHE 153 11.749 -5.726 -0.381 1123 HD2 PHE 153 HD1 PHE 153 9.452 -2.871 1.821 1124 HE1 PHE 153 HE2 PHE 153 11.209 -4.546 -2.466 1125 HE2 PHE 153 HE1 PHE 153 8.920 -1.692 -0.272 1126 HZ PHE 153 HZ PHE 153 9.798 -2.530 -2.412 1127 H CYS 154 H CYS 154 9.022 -5.611 4.686 1128 HA CYS 154 HA CYS 154 10.923 -6.639 6.524 1129 HB2 CYS 154 2HB CYS 154 9.239 -5.942 8.248 1130 HB3 CYS 154 1HB CYS 154 9.588 -4.684 7.070 1131 HG CYS 154 HG CYS 154 7.230 -4.634 5.867 1132 H ALA 155 H ALA 155 7.608 -7.724 5.689 1133 HA ALA 155 HA ALA 155 7.465 -9.884 7.520 1134 HB1 ALA 155 3HB ALA 155 5.929 -9.484 4.934 1135 HB2 ALA 155 1HB ALA 155 5.475 -8.855 6.518 1136 HB3 ALA 155 2HB ALA 155 5.489 -10.594 6.235 1137 H TYR 156 H TYR 156 8.994 -9.629 4.433 1138 HA TYR 156 HA TYR 156 9.317 -12.558 4.235 1139 HB2 TYR 156 2HB TYR 156 9.623 -10.324 2.201 1140 HB3 TYR 156 1HB TYR 156 10.259 -11.943 1.897 1141 HD1 TYR 156 HD1 TYR 156 7.092 -10.090 2.687 1142 HD2 TYR 156 HD2 TYR 156 8.781 -13.747 1.235 1143 HE1 TYR 156 HE1 TYR 156 4.852 -10.899 2.101 1144 HE2 TYR 156 HE2 TYR 156 6.529 -14.541 0.640 1145 HH TYR 156 HH TYR 156 4.204 -14.143 1.304 1146 H SER 157 H SER 157 11.246 -9.635 4.720 1147 HA SER 157 HA SER 157 13.602 -11.375 5.232 1148 HB2 SER 157 2HB SER 157 13.616 -8.583 4.017 1149 HB3 SER 157 1HB SER 157 15.052 -9.502 4.474 1150 HG SER 157 HG SER 157 13.123 -10.476 2.647 1151 H ASP 158 H ASP 158 13.986 -11.399 7.310 1152 HA ASP 158 HA ASP 158 12.884 -9.628 9.244 1153 HB2 ASP 158 2HB ASP 158 15.039 -11.777 9.495 1154 HB3 ASP 158 1HB ASP 158 14.304 -10.951 10.870 1155 H THR 159 H THR 159 15.732 -9.406 7.376 1156 HA THR 159 HA THR 159 17.293 -7.732 9.094 1157 HB THR 159 HB THR 159 18.316 -9.090 7.282 1158 HG1 THR 159 HG1 THR 159 18.722 -6.267 7.066 1159 HG21 THR 159 3HG2 THR 159 16.585 -8.818 5.536 1160 HG22 THR 159 1HG2 THR 159 18.182 -8.369 4.929 1161 HG23 THR 159 2HG2 THR 159 17.022 -7.116 5.367 1162 H PHE 160 H PHE 160 14.387 -7.061 7.554 1163 HA PHE 160 HA PHE 160 14.944 -4.152 7.347 1164 HB2 PHE 160 2HB PHE 160 12.560 -5.820 6.412 1165 HB3 PHE 160 1HB PHE 160 12.566 -4.063 6.410 1166 HD1 PHE 160 HD2 PHE 160 14.503 -6.978 5.040 1167 HD2 PHE 160 HD1 PHE 160 13.195 -2.953 4.433 1168 HE1 PHE 160 HE2 PHE 160 15.373 -7.038 2.740 1169 HE2 PHE 160 HE1 PHE 160 14.067 -3.023 2.132 1170 HZ PHE 160 HZ PHE 160 15.154 -5.068 1.280 1171 H SER 161 H SER 161 14.487 -3.054 9.218 1172 HA SER 161 HA SER 161 12.932 -4.097 11.371 1173 HB2 SER 161 2HB SER 161 14.648 -2.378 11.796 1174 HB3 SER 161 1HB SER 161 13.786 -1.225 10.775 1175 HG SER 161 HG SER 161 13.330 -1.936 13.393 1176 H CYS 162 H CYS 162 10.709 -4.124 11.566 1177 HA CYS 162 HA CYS 162 9.204 -3.618 9.206 1178 HB2 CYS 162 2HB CYS 162 7.295 -4.517 10.576 1179 HB3 CYS 162 1HB CYS 162 8.709 -5.568 10.585 1180 HG CYS 162 HG CYS 162 7.253 -3.904 13.115 1181 HA PRO 163 HA PRO 163 7.806 0.603 9.824 1182 HB2 PRO 163 2HB PRO 163 5.136 -0.533 8.927 1183 HB3 PRO 163 1HB PRO 163 6.007 0.908 8.350 1184 HG2 PRO 163 2HG PRO 163 6.034 -1.266 6.886 1185 HG3 PRO 163 1HG PRO 163 7.542 -0.347 7.110 1186 HD2 PRO 163 2HD PRO 163 6.671 -2.906 8.440 1187 HD3 PRO 163 1HD PRO 163 8.273 -2.447 7.811 1188 H LEU 164 H LEU 164 6.334 1.882 11.112 1189 HA LEU 164 HA LEU 164 5.114 0.432 13.379 1190 HB2 LEU 164 2HB LEU 164 7.109 1.794 14.004 1191 HB3 LEU 164 1HB LEU 164 6.346 3.224 13.326 1192 HG LEU 164 HG LEU 164 4.562 3.098 15.051 1193 HD11 LEU 164 1HD1 LEU 164 4.494 0.687 15.436 1194 HD12 LEU 164 2HD1 LEU 164 4.723 1.550 16.952 1195 HD13 LEU 164 3HD1 LEU 164 6.092 0.737 16.189 1196 HD21 LEU 164 3HD2 LEU 164 5.919 3.772 16.993 1197 HD22 LEU 164 1HD2 LEU 164 6.546 4.470 15.502 1198 HD23 LEU 164 2HD2 LEU 164 7.360 3.088 16.237 1199 HA PRO 165 HA PRO 165 1.701 2.527 11.097 1200 HB2 PRO 165 2HB PRO 165 -0.132 0.538 11.203 1201 HB3 PRO 165 1HB PRO 165 1.255 0.447 10.099 1202 HG2 PRO 165 2HG PRO 165 0.844 -0.921 12.721 1203 HG3 PRO 165 1HG PRO 165 1.572 -1.550 11.225 1204 HD2 PRO 165 2HD PRO 165 3.011 -0.572 13.416 1205 HD3 PRO 165 1HD PRO 165 3.652 -0.734 11.767 1206 HA PRO 166 HA PRO 166 -0.258 4.122 14.920 1207 HB2 PRO 166 2HB PRO 166 -2.384 5.381 13.540 1208 HB3 PRO 166 1HB PRO 166 -0.814 6.118 13.910 1209 HG2 PRO 166 2HG PRO 166 -1.725 4.816 11.373 1210 HG3 PRO 166 1HG PRO 166 -0.744 6.284 11.602 1211 HD2 PRO 166 2HD PRO 166 0.417 3.980 10.899 1212 HD3 PRO 166 1HD PRO 166 1.210 5.064 12.068 1213 H GLU 167 H GLU 167 -2.077 3.629 16.127 1214 HA GLU 167 HA GLU 167 -3.300 1.125 15.843 1215 HB2 GLU 167 2HB GLU 167 -4.246 3.497 17.510 1216 HB3 GLU 167 1HB GLU 167 -4.740 1.821 17.746 1217 HG2 GLU 167 2HG GLU 167 -2.437 1.196 18.319 1218 HG3 GLU 167 1HG GLU 167 -1.898 2.847 18.023 1219 H SER 168 H SER 168 -4.156 4.143 14.456 1220 HA SER 168 HA SER 168 -6.977 3.759 14.171 1221 HB2 SER 168 2HB SER 168 -5.161 5.768 12.786 1222 HB3 SER 168 1HB SER 168 -6.908 5.897 13.004 1223 HG SER 168 HG SER 168 -5.702 5.486 15.382 1224 H ASN 169 H ASN 169 -4.263 2.646 12.246 1225 HA ASN 169 HA ASN 169 -5.974 2.415 9.824 1226 HB2 ASN 169 2HB ASN 169 -3.991 2.095 8.486 1227 HB3 ASN 169 1HB ASN 169 -3.686 3.469 9.532 1228 HD21 ASN 169 1HD2 ASN 169 -2.919 0.088 8.968 1229 HD22 ASN 169 2HD2 ASN 169 -1.459 0.079 9.892 1230 H TRP 170 H TRP 170 -5.632 0.690 12.455 1231 HA TRP 170 HA TRP 170 -5.119 -1.962 11.322 1232 HB2 TRP 170 2HB TRP 170 -6.004 -1.171 14.136 1233 HB3 TRP 170 1HB TRP 170 -5.534 -2.790 13.627 1234 HD1 TRP 170 HD1 TRP 170 -2.940 -0.944 11.975 1235 HE1 TRP 170 HE1 TRP 170 -0.863 -0.611 13.457 1236 HE3 TRP 170 HE3 TRP 170 -4.988 -2.059 16.540 1237 HZ2 TRP 170 HZ2 TRP 170 -0.170 -0.811 16.186 1238 HZ3 TRP 170 HZ3 TRP 170 -3.548 -1.970 18.535 1239 HH2 TRP 170 HH2 TRP 170 -1.188 -1.359 18.362 1240 H LEU 171 H LEU 171 -6.739 -2.882 10.176 1241 HA LEU 171 HA LEU 171 -9.487 -1.906 10.444 1242 HB2 LEU 171 2HB LEU 171 -8.259 -3.721 8.329 1243 HB3 LEU 171 1HB LEU 171 -9.874 -3.031 8.287 1244 HG LEU 171 HG LEU 171 -7.245 -1.526 8.023 1245 HD11 LEU 171 1HD1 LEU 171 -9.511 -1.914 6.039 1246 HD12 LEU 171 2HD1 LEU 171 -7.926 -2.686 5.978 1247 HD13 LEU 171 3HD1 LEU 171 -8.059 -0.942 5.775 1248 HD21 LEU 171 3HD2 LEU 171 -8.754 -0.147 9.353 1249 HD22 LEU 171 1HD2 LEU 171 -10.045 -0.361 8.167 1250 HD23 LEU 171 2HD2 LEU 171 -8.586 0.535 7.739 1251 H GLU 172 H GLU 172 -11.020 -3.094 11.430 1252 HA GLU 172 HA GLU 172 -10.389 -5.805 12.358 1253 HB2 GLU 172 2HB GLU 172 -11.277 -3.985 13.904 1254 HB3 GLU 172 1HB GLU 172 -12.806 -4.071 13.037 1255 HG2 GLU 172 2HG GLU 172 -12.882 -5.324 15.148 1256 HG3 GLU 172 1HG GLU 172 -13.119 -6.388 13.762 1257 H THR 173 H THR 173 -10.540 -6.044 9.825 1258 HA THR 173 HA THR 173 -12.834 -7.709 9.294 1259 HB THR 173 HB THR 173 -13.764 -5.574 8.513 1260 HG1 THR 173 HG1 THR 173 -14.456 -7.069 7.134 1261 HG21 THR 173 3HG2 THR 173 -11.324 -5.305 6.709 1262 HG22 THR 173 1HG2 THR 173 -11.667 -4.312 8.130 1263 HG23 THR 173 2HG2 THR 173 -12.729 -4.236 6.725 1264 H ALA 174 H ALA 174 -12.453 -9.064 7.393 1265 HA ALA 174 HA ALA 174 -9.594 -9.551 6.924 1266 HB1 ALA 174 3HB ALA 174 -12.024 -11.211 6.149 1267 HB2 ALA 174 1HB ALA 174 -10.992 -11.470 7.556 1268 HB3 ALA 174 2HB ALA 174 -10.336 -11.687 5.933 1269 H VAL 175 H VAL 175 -8.622 -9.078 5.065 1270 HA VAL 175 HA VAL 175 -10.166 -8.176 2.716 1271 HB VAL 175 HB VAL 175 -7.231 -7.670 3.450 1272 HG11 VAL 175 1HG1 VAL 175 -7.174 -6.158 1.489 1273 HG12 VAL 175 2HG1 VAL 175 -8.822 -6.634 1.071 1274 HG13 VAL 175 3HG1 VAL 175 -7.520 -7.821 1.009 1275 HG21 VAL 175 3HG2 VAL 175 -7.941 -5.299 3.755 1276 HG22 VAL 175 1HG2 VAL 175 -8.759 -6.386 4.881 1277 HG23 VAL 175 2HG2 VAL 175 -9.617 -5.771 3.467 1278 H THR 176 H THR 176 -10.659 -10.228 2.005 1279 HA THR 176 HA THR 176 -8.462 -11.997 1.113 1280 HB THR 176 HB THR 176 -10.313 -13.736 0.909 1281 HG1 THR 176 HG1 THR 176 -12.140 -12.434 0.790 1282 HG21 THR 176 3HG2 THR 176 -10.012 -12.541 3.696 1283 HG22 THR 176 1HG2 THR 176 -8.885 -13.670 2.944 1284 HG23 THR 176 2HG2 THR 176 -10.528 -14.187 3.322 1285 H ALA 177 H ALA 177 -7.928 -11.514 -0.909 1286 HA ALA 177 HA ALA 177 -9.939 -11.311 -3.037 1287 HB1 ALA 177 3HB ALA 177 -7.815 -9.167 -2.595 1288 HB2 ALA 177 1HB ALA 177 -9.552 -8.955 -2.367 1289 HB3 ALA 177 2HB ALA 177 -8.906 -9.264 -3.979 1290 H GLY 178 H GLY 178 -9.146 -12.122 -4.989 1291 HA2 GLY 178 2HA GLY 178 -7.937 -13.628 -6.232 1292 HA3 GLY 178 1HA GLY 178 -6.575 -12.606 -5.806 1293 H GLU 179 H GLU 179 -5.115 -14.315 -5.733 1294 HA GLU 179 HA GLU 179 -5.394 -16.618 -4.048 1295 HB2 GLU 179 2HB GLU 179 -2.900 -15.345 -5.267 1296 HB3 GLU 179 1HB GLU 179 -2.937 -16.914 -4.474 1297 HG2 GLU 179 2HG GLU 179 -4.399 -16.160 -7.012 1298 HG3 GLU 179 1HG GLU 179 -2.946 -17.152 -6.901 1299 H ARG 180 H ARG 180 -4.290 -17.068 -2.120 1300 HA ARG 180 HA ARG 180 -3.721 -14.772 -0.349 1301 HB2 ARG 180 2HB ARG 180 -3.809 -16.485 1.475 1302 HB3 ARG 180 1HB ARG 180 -5.298 -16.431 0.540 1303 HG2 ARG 180 2HG ARG 180 -4.711 -18.471 -0.636 1304 HG3 ARG 180 1HG ARG 180 -3.108 -18.484 0.100 1305 HD2 ARG 180 2HD ARG 180 -5.683 -18.712 1.688 1306 HD3 ARG 180 1HD ARG 180 -4.757 -20.099 1.110 1307 HE ARG 180 HE ARG 180 -2.922 -18.635 2.496 1308 HH11 ARG 180 1HH1 ARG 180 -6.064 -19.971 3.363 1309 HH12 ARG 180 2HH1 ARG 180 -5.645 -20.171 5.035 1310 HH21 ARG 180 1HH2 ARG 180 -2.390 -18.936 4.699 1311 HH22 ARG 180 2HH2 ARG 180 -3.571 -19.588 5.790 1312 H THR 181 H THR 181 -1.971 -16.137 1.442 1313 HA THR 181 HA THR 181 0.267 -17.200 -0.033 1314 HB THR 181 HB THR 181 0.905 -14.877 -0.243 1315 HG1 THR 181 HG1 THR 181 2.430 -16.072 1.857 1316 HG21 THR 181 3HG2 THR 181 0.631 -14.589 2.762 1317 HG22 THR 181 1HG2 THR 181 -0.411 -13.840 1.548 1318 HG23 THR 181 2HG2 THR 181 1.286 -13.372 1.666 1319 H ASP 182 H ASP 182 0.869 -18.892 1.057 1320 HA ASP 182 HA ASP 182 -0.192 -19.340 3.745 1321 HB2 ASP 182 2HB ASP 182 0.421 -21.731 3.378 1322 HB3 ASP 182 1HB ASP 182 -0.661 -21.109 2.146 1323 H LEU 183 H LEU 183 1.148 -18.068 4.975 1324 HA LEU 183 HA LEU 183 3.947 -18.135 5.156 1325 HB2 LEU 183 2HB LEU 183 3.718 -17.154 7.360 1326 HB3 LEU 183 1HB LEU 183 2.543 -16.425 6.286 1327 HG LEU 183 HG LEU 183 1.828 -18.615 8.276 1328 HD11 LEU 183 1HD1 LEU 183 1.566 -15.627 8.674 1329 HD12 LEU 183 2HD1 LEU 183 2.685 -16.705 9.513 1330 HD13 LEU 183 3HD1 LEU 183 0.951 -16.885 9.753 1331 HD21 LEU 183 3HD2 LEU 183 -0.493 -17.824 8.000 1332 HD22 LEU 183 1HD2 LEU 183 0.185 -18.402 6.481 1333 HD23 LEU 183 2HD2 LEU 183 0.040 -16.669 6.776 1334 H GLU 184 H GLU 184 1.493 -20.290 6.471 1335 HA GLU 184 HA GLU 184 3.462 -21.992 7.845 1336 HB2 GLU 184 2HB GLU 184 0.426 -22.271 7.669 1337 HB3 GLU 184 1HB GLU 184 1.490 -23.176 8.738 1338 HG2 GLU 184 2HG GLU 184 0.911 -20.210 8.856 1339 HG3 GLU 184 1HG GLU 184 0.282 -21.439 9.948 1340 H HIS 185 H HIS 185 4.451 -22.447 5.737 1341 HA HIS 185 HA HIS 185 3.158 -23.611 3.523 1342 HB2 HIS 185 2HB HIS 185 6.096 -23.907 4.311 1343 HB3 HIS 185 1HB HIS 185 5.422 -24.169 2.704 1344 HD1 HIS 185 HD1 HIS 185 6.203 -21.419 5.160 1345 HD2 HIS 185 HD2 HIS 185 5.093 -21.856 1.181 1346 HE1 HIS 185 HE1 HIS 185 6.456 -19.150 4.140 1347 HE2 HIS 185 HE2 HIS 185 5.782 -19.431 1.743 Start of MODEL 2 1 H1 MET 1 1H MET 1 -19.524 1.986 -17.674 2 H2 MET 1 2H MET 1 -18.707 3.227 -16.880 3 H3 MET 1 3H MET 1 -20.193 2.686 -16.292 4 HA MET 1 HA MET 1 -18.373 1.874 -14.952 5 HB2 MET 1 2HB MET 1 -20.434 0.489 -15.153 6 HB3 MET 1 1HB MET 1 -19.755 -0.314 -16.561 7 HG2 MET 1 2HG MET 1 -17.917 -1.200 -15.110 8 HG3 MET 1 1HG MET 1 -18.729 -0.486 -13.717 9 HE1 MET 1 3HE MET 1 -20.358 -2.311 -16.881 10 HE2 MET 1 1HE MET 1 -20.441 -3.955 -16.250 11 HE3 MET 1 2HE MET 1 -18.873 -3.204 -16.539 12 H ASP 2 H ASP 2 -18.253 0.679 -18.320 13 HA ASP 2 HA ASP 2 -15.903 -0.867 -18.046 14 HB2 ASP 2 2HB ASP 2 -17.131 0.350 -20.558 15 HB3 ASP 2 1HB ASP 2 -15.830 -0.844 -20.559 16 H GLU 3 H GLU 3 -16.407 2.391 -19.335 17 HA GLU 3 HA GLU 3 -14.014 3.299 -20.180 18 HB2 GLU 3 2HB GLU 3 -15.609 5.050 -18.259 19 HB3 GLU 3 1HB GLU 3 -14.680 5.544 -19.665 20 HG2 GLU 3 2HG GLU 3 -16.834 5.810 -20.456 21 HG3 GLU 3 1HG GLU 3 -16.493 4.171 -21.005 22 H ASP 4 H ASP 4 -15.025 3.137 -16.812 23 HA ASP 4 HA ASP 4 -12.584 4.037 -15.627 24 HB2 ASP 4 2HB ASP 4 -14.499 4.462 -14.312 25 HB3 ASP 4 1HB ASP 4 -15.195 2.880 -14.611 26 H THR 5 H THR 5 -14.148 0.781 -15.853 27 HA THR 5 HA THR 5 -12.164 -0.409 -14.169 28 HB THR 5 HB THR 5 -14.381 -1.756 -15.765 29 HG1 THR 5 HG1 THR 5 -14.560 0.021 -13.810 30 HG21 THR 5 3HG2 THR 5 -12.910 -2.663 -13.257 31 HG22 THR 5 1HG2 THR 5 -12.745 -3.378 -14.861 32 HG23 THR 5 2HG2 THR 5 -14.282 -3.495 -13.998 33 H GLU 6 H GLU 6 -12.898 -0.723 -17.677 34 HA GLU 6 HA GLU 6 -10.953 -2.558 -18.412 35 HB2 GLU 6 2HB GLU 6 -11.178 -1.807 -20.671 36 HB3 GLU 6 1HB GLU 6 -12.755 -1.557 -19.931 37 HG2 GLU 6 2HG GLU 6 -12.239 0.854 -19.655 38 HG3 GLU 6 1HG GLU 6 -10.669 0.600 -20.409 39 H ASP 7 H ASP 7 -10.657 0.842 -17.668 40 HA ASP 7 HA ASP 7 -7.916 1.145 -18.560 41 HB2 ASP 7 2HB ASP 7 -9.550 3.011 -18.682 42 HB3 ASP 7 1HB ASP 7 -9.732 2.983 -16.936 43 H TRP 8 H TRP 8 -9.665 0.737 -15.522 44 HA TRP 8 HA TRP 8 -7.571 0.896 -13.687 45 HB2 TRP 8 2HB TRP 8 -9.959 0.862 -13.036 46 HB3 TRP 8 1HB TRP 8 -10.096 -0.816 -13.542 47 HD1 TRP 8 HD1 TRP 8 -7.943 1.192 -10.945 48 HE1 TRP 8 HE1 TRP 8 -7.748 -0.233 -8.814 49 HE3 TRP 8 HE3 TRP 8 -10.510 -2.972 -12.497 50 HZ2 TRP 8 HZ2 TRP 8 -8.573 -2.766 -7.900 51 HZ3 TRP 8 HZ3 TRP 8 -10.769 -4.851 -10.917 52 HH2 TRP 8 HH2 TRP 8 -9.815 -4.745 -8.666 53 H GLU 9 H GLU 9 -8.583 -1.815 -15.749 54 HA GLU 9 HA GLU 9 -6.588 -3.610 -14.595 55 HB2 GLU 9 2HB GLU 9 -7.484 -5.334 -16.023 56 HB3 GLU 9 1HB GLU 9 -8.827 -4.470 -15.286 57 HG2 GLU 9 2HG GLU 9 -9.058 -3.162 -17.424 58 HG3 GLU 9 1HG GLU 9 -7.845 -4.219 -18.140 59 H THR 10 H THR 10 -6.833 -1.404 -17.311 60 HA THR 10 HA THR 10 -4.634 -2.355 -18.847 61 HB THR 10 HB THR 10 -5.689 0.513 -18.637 62 HG1 THR 10 HG1 THR 10 -6.828 -1.609 -19.657 63 HG21 THR 10 3HG2 THR 10 -3.931 -0.754 -20.791 64 HG22 THR 10 1HG2 THR 10 -3.402 0.453 -19.613 65 HG23 THR 10 2HG2 THR 10 -4.600 0.880 -20.832 66 H GLN 11 H GLN 11 -4.801 0.337 -16.454 67 HA GLN 11 HA GLN 11 -2.014 0.735 -16.248 68 HB2 GLN 11 2HB GLN 11 -2.492 2.099 -14.287 69 HB3 GLN 11 1HB GLN 11 -3.696 2.420 -15.529 70 HG2 GLN 11 2HG GLN 11 -5.312 0.977 -14.339 71 HG3 GLN 11 1HG GLN 11 -4.111 0.664 -13.087 72 HE21 GLN 11 1HE2 GLN 11 -6.754 1.888 -12.839 73 HE22 GLN 11 2HE2 GLN 11 -6.497 3.440 -12.139 74 H LEU 12 H LEU 12 -4.136 -1.626 -14.815 75 HA LEU 12 HA LEU 12 -2.708 -2.262 -12.479 76 HB2 LEU 12 2HB LEU 12 -5.013 -2.923 -12.786 77 HB3 LEU 12 1HB LEU 12 -4.594 -3.906 -14.177 78 HG LEU 12 HG LEU 12 -3.353 -5.477 -12.703 79 HD11 LEU 12 1HD1 LEU 12 -2.652 -3.940 -10.942 80 HD12 LEU 12 2HD1 LEU 12 -3.517 -5.316 -10.262 81 HD13 LEU 12 3HD1 LEU 12 -4.325 -3.752 -10.409 82 HD21 LEU 12 3HD2 LEU 12 -6.196 -4.981 -11.793 83 HD22 LEU 12 1HD2 LEU 12 -5.287 -6.487 -11.644 84 HD23 LEU 12 2HD2 LEU 12 -5.713 -5.875 -13.239 85 H GLN 13 H GLN 13 -2.378 -3.497 -15.836 86 HA GLN 13 HA GLN 13 -0.560 -5.562 -15.168 87 HB2 GLN 13 2HB GLN 13 0.041 -5.733 -17.474 88 HB3 GLN 13 1HB GLN 13 -1.684 -5.404 -17.406 89 HG2 GLN 13 2HG GLN 13 -1.334 -3.122 -18.106 90 HG3 GLN 13 1HG GLN 13 0.412 -3.298 -17.996 91 HE21 GLN 13 1HE2 GLN 13 0.403 -5.990 -19.270 92 HE22 GLN 13 2HE2 GLN 13 0.087 -5.703 -20.939 93 H ALA 14 H ALA 14 -0.145 -2.098 -15.850 94 HA ALA 14 HA ALA 14 2.690 -2.006 -15.692 95 HB1 ALA 14 3HB ALA 14 1.393 -0.166 -16.677 96 HB2 ALA 14 1HB ALA 14 2.424 0.422 -15.373 97 HB3 ALA 14 2HB ALA 14 0.690 0.212 -15.103 98 H ASN 15 H ASN 15 0.126 -1.668 -13.214 99 HA ASN 15 HA ASN 15 1.614 -1.018 -10.963 100 HB2 ASN 15 2HB ASN 15 -0.884 -2.745 -11.197 101 HB3 ASN 15 1HB ASN 15 -0.173 -2.348 -9.639 102 HD21 ASN 15 1HD2 ASN 15 -0.360 -0.048 -12.349 103 HD22 ASN 15 2HD2 ASN 15 -1.512 0.982 -11.588 104 H ARG 16 H ARG 16 0.927 -4.297 -12.239 105 HA ARG 16 HA ARG 16 2.524 -5.575 -10.188 106 HB2 ARG 16 2HB ARG 16 2.001 -7.700 -11.325 107 HB3 ARG 16 1HB ARG 16 0.555 -6.759 -10.991 108 HG2 ARG 16 2HG ARG 16 0.315 -6.151 -13.312 109 HG3 ARG 16 1HG ARG 16 1.896 -6.824 -13.714 110 HD2 ARG 16 2HD ARG 16 0.065 -8.292 -14.455 111 HD3 ARG 16 1HD ARG 16 1.084 -9.086 -13.256 112 HE ARG 16 HE ARG 16 -0.857 -8.221 -11.676 113 HH11 ARG 16 1HH1 ARG 16 -1.176 -9.740 -14.832 114 HH12 ARG 16 2HH1 ARG 16 -2.713 -10.455 -14.463 115 HH21 ARG 16 1HH2 ARG 16 -2.847 -9.240 -11.185 116 HH22 ARG 16 2HH2 ARG 16 -3.656 -10.172 -12.412 117 H ASP 17 H ASP 17 3.038 -4.506 -13.503 118 HA ASP 17 HA ASP 17 5.394 -6.014 -14.050 119 HB2 ASP 17 2HB ASP 17 4.042 -3.662 -15.360 120 HB3 ASP 17 1HB ASP 17 5.747 -3.872 -15.726 121 H GLU 18 H GLU 18 4.957 -2.602 -12.973 122 HA GLU 18 HA GLU 18 7.667 -1.961 -12.717 123 HB2 GLU 18 2HB GLU 18 6.987 -0.095 -11.283 124 HB3 GLU 18 1HB GLU 18 5.931 -0.212 -12.682 125 HG2 GLU 18 2HG GLU 18 4.070 -0.722 -11.429 126 HG3 GLU 18 1HG GLU 18 4.981 -1.612 -10.217 127 H LYS 19 H LYS 19 5.440 -3.529 -10.422 128 HA LYS 19 HA LYS 19 7.254 -3.527 -8.206 129 HB2 LYS 19 2HB LYS 19 4.736 -5.144 -8.769 130 HB3 LYS 19 1HB LYS 19 5.658 -5.293 -7.276 131 HG2 LYS 19 2HG LYS 19 4.238 -2.813 -8.275 132 HG3 LYS 19 1HG LYS 19 3.753 -3.850 -6.930 133 HD2 LYS 19 2HD LYS 19 5.940 -3.234 -5.790 134 HD3 LYS 19 1HD LYS 19 6.205 -2.053 -7.080 135 HE2 LYS 19 2HE LYS 19 3.952 -2.090 -5.051 136 HE3 LYS 19 1HE LYS 19 5.253 -0.907 -5.181 137 HZ1 LYS 19 3HZ LYS 19 2.988 -1.303 -7.053 138 HZ2 LYS 19 1HZ LYS 19 4.326 -0.334 -7.401 139 HZ3 LYS 19 2HZ LYS 19 3.329 0.060 -6.106 140 H ASP 20 H ASP 20 6.532 -5.827 -10.802 141 HA ASP 20 HA ASP 20 7.998 -8.048 -9.880 142 HB2 ASP 20 2HB ASP 20 6.406 -8.230 -11.755 143 HB3 ASP 20 1HB ASP 20 7.397 -7.166 -12.742 144 H ARG 21 H ARG 21 8.940 -5.293 -11.944 145 HA ARG 21 HA ARG 21 11.708 -6.187 -12.123 146 HB2 ARG 21 2HB ARG 21 12.087 -4.262 -13.556 147 HB3 ARG 21 1HB ARG 21 10.647 -5.126 -14.075 148 HG2 ARG 21 2HG ARG 21 9.255 -3.394 -12.913 149 HG3 ARG 21 1HG ARG 21 10.738 -2.492 -12.566 150 HD2 ARG 21 2HD ARG 21 9.573 -1.628 -14.572 151 HD3 ARG 21 1HD ARG 21 11.176 -2.257 -14.968 152 HE ARG 21 HE ARG 21 10.118 -4.246 -15.870 153 HH11 ARG 21 1HH1 ARG 21 7.948 -1.517 -15.371 154 HH12 ARG 21 2HH1 ARG 21 6.765 -2.104 -16.500 155 HH21 ARG 21 1HH2 ARG 21 8.535 -5.025 -17.283 156 HH22 ARG 21 2HH2 ARG 21 7.103 -4.096 -17.579 157 H PHE 22 H PHE 22 9.846 -4.084 -10.044 158 HA PHE 22 HA PHE 22 11.986 -2.701 -8.840 159 HB2 PHE 22 2HB PHE 22 9.475 -2.335 -8.425 160 HB3 PHE 22 1HB PHE 22 9.522 -3.726 -7.354 161 HD1 PHE 22 HD2 PHE 22 10.854 -3.602 -5.207 162 HD2 PHE 22 HD1 PHE 22 10.346 -0.189 -7.741 163 HE1 PHE 22 HE2 PHE 22 11.551 -2.126 -3.366 164 HE2 PHE 22 HE1 PHE 22 11.048 1.274 -5.893 165 HZ PHE 22 HZ PHE 22 11.646 0.308 -3.710 166 H PHE 23 H PHE 23 10.620 -5.909 -8.281 167 HA PHE 23 HA PHE 23 12.470 -6.587 -6.144 168 HB2 PHE 23 2HB PHE 23 10.233 -8.107 -7.547 169 HB3 PHE 23 1HB PHE 23 11.294 -8.888 -6.381 170 HD1 PHE 23 HD2 PHE 23 9.734 -5.445 -6.231 171 HD2 PHE 23 HD1 PHE 23 9.889 -9.384 -4.555 172 HE1 PHE 23 HE2 PHE 23 8.244 -4.735 -4.411 173 HE2 PHE 23 HE1 PHE 23 8.396 -8.659 -2.738 174 HZ PHE 23 HZ PHE 23 7.575 -6.338 -2.661 175 H SER 24 H SER 24 12.452 -6.885 -9.631 176 HA SER 24 HA SER 24 14.456 -9.050 -9.566 177 HB2 SER 24 2HB SER 24 12.853 -7.906 -11.887 178 HB3 SER 24 1HB SER 24 14.022 -9.222 -12.016 179 HG SER 24 HG SER 24 11.446 -9.263 -11.122 180 H GLU 25 H GLU 25 14.205 -5.593 -10.568 181 HA GLU 25 HA GLU 25 16.893 -5.788 -11.813 182 HB2 GLU 25 2HB GLU 25 14.529 -4.026 -12.643 183 HB3 GLU 25 1HB GLU 25 16.111 -4.056 -13.416 184 HG2 GLU 25 2HG GLU 25 14.242 -6.438 -13.298 185 HG3 GLU 25 1HG GLU 25 14.311 -5.308 -14.647 186 H HIS 26 H HIS 26 14.569 -3.580 -10.243 187 HA HIS 26 HA HIS 26 16.327 -1.374 -9.895 188 HB2 HIS 26 2HB HIS 26 13.877 -1.098 -9.939 189 HB3 HIS 26 1HB HIS 26 13.705 -2.100 -8.498 190 HD2 HIS 26 HD2 HIS 26 14.766 1.520 -9.496 191 HE1 HIS 26 HE1 HIS 26 14.544 1.270 -5.282 192 HE2 HIS 26 HE2 HIS 26 15.103 2.752 -7.250 193 H ARG 27 H ARG 27 14.987 -3.723 -7.652 194 HA ARG 27 HA ARG 27 17.401 -3.658 -5.971 195 HB2 ARG 27 2HB ARG 27 14.504 -3.415 -5.064 196 HB3 ARG 27 1HB ARG 27 15.722 -4.093 -3.990 197 HG2 ARG 27 2HG ARG 27 15.765 -1.299 -5.183 198 HG3 ARG 27 1HG ARG 27 15.367 -1.721 -3.514 199 HD2 ARG 27 2HD ARG 27 17.646 -2.601 -3.191 200 HD3 ARG 27 1HD ARG 27 18.045 -2.204 -4.860 201 HE ARG 27 HE ARG 27 17.645 -0.318 -2.640 202 HH11 ARG 27 1HH1 ARG 27 18.610 -0.854 -5.976 203 HH12 ARG 27 2HH1 ARG 27 19.354 0.705 -6.132 204 HH21 ARG 27 1HH2 ARG 27 18.696 1.666 -2.823 205 HH22 ARG 27 2HH2 ARG 27 19.403 2.138 -4.339 206 H GLN 28 H GLN 28 17.902 -5.597 -5.009 207 HA GLN 28 HA GLN 28 17.162 -8.067 -6.077 208 HB2 GLN 28 2HB GLN 28 18.161 -8.988 -3.879 209 HB3 GLN 28 1HB GLN 28 19.202 -7.956 -4.849 210 HG2 GLN 28 2HG GLN 28 19.590 -7.228 -2.647 211 HG3 GLN 28 1HG GLN 28 18.485 -6.024 -3.305 212 HE21 GLN 28 1HE2 GLN 28 17.649 -5.365 -1.342 213 HE22 GLN 28 2HE2 GLN 28 16.683 -6.369 -0.322 214 H SER 29 H SER 29 15.497 -9.468 -5.670 215 HA SER 29 HA SER 29 13.139 -8.674 -4.401 216 HB2 SER 29 2HB SER 29 12.459 -11.133 -4.653 217 HB3 SER 29 1HB SER 29 12.982 -10.323 -6.131 218 HG SER 29 HG SER 29 15.022 -11.508 -4.732 219 HA PRO 30 HA PRO 30 14.199 -9.494 -0.050 220 HB2 PRO 30 2HB PRO 30 11.240 -9.172 0.339 221 HB3 PRO 30 1HB PRO 30 12.578 -8.261 1.068 222 HG2 PRO 30 2HG PRO 30 11.040 -7.146 -0.791 223 HG3 PRO 30 1HG PRO 30 12.789 -6.821 -0.735 224 HD2 PRO 30 2HD PRO 30 11.269 -8.682 -2.549 225 HD3 PRO 30 1HD PRO 30 12.582 -7.544 -2.937 226 H ILE 31 H ILE 31 11.989 -11.223 -2.051 227 HA ILE 31 HA ILE 31 11.174 -13.306 -0.352 228 HB ILE 31 HB ILE 31 11.743 -13.647 -3.332 229 HG12 ILE 31 2HG1 ILE 31 10.419 -11.584 -3.117 230 HG13 ILE 31 1HG1 ILE 31 9.411 -12.856 -3.789 231 HG21 ILE 31 1HG2 ILE 31 11.176 -15.718 -2.142 232 HG22 ILE 31 2HG2 ILE 31 9.869 -15.273 -3.240 233 HG23 ILE 31 3HG2 ILE 31 9.701 -14.982 -1.505 234 HD11 ILE 31 3HD1 ILE 31 8.156 -11.544 -2.222 235 HD12 ILE 31 1HD1 ILE 31 9.359 -11.804 -0.961 236 HD13 ILE 31 2HD1 ILE 31 8.385 -13.157 -1.545 237 HA PRO 32 HA PRO 32 15.352 -14.735 0.636 238 HB2 PRO 32 2HB PRO 32 13.863 -17.180 1.611 239 HB3 PRO 32 1HB PRO 32 15.005 -16.135 2.482 240 HG2 PRO 32 2HG PRO 32 12.438 -15.956 3.024 241 HG3 PRO 32 1HG PRO 32 13.400 -14.463 2.852 242 HD2 PRO 32 2HD PRO 32 11.563 -15.762 0.834 243 HD3 PRO 32 1HD PRO 32 11.675 -14.052 1.320 244 HA PRO 33 HA PRO 33 17.061 -16.934 -2.655 245 HB2 PRO 33 2HB PRO 33 18.722 -18.919 -1.544 246 HB3 PRO 33 1HB PRO 33 19.131 -17.197 -1.666 247 HG2 PRO 33 2HG PRO 33 17.960 -18.688 0.675 248 HG3 PRO 33 1HG PRO 33 19.289 -17.496 0.647 249 HD2 PRO 33 2HD PRO 33 16.877 -16.725 1.421 250 HD3 PRO 33 1HD PRO 33 17.818 -15.673 0.335 251 H GLU 34 H GLU 34 16.111 -19.484 -0.326 252 HA GLU 34 HA GLU 34 15.726 -21.475 -2.358 253 HB2 GLU 34 2HB GLU 34 14.883 -22.950 -0.609 254 HB3 GLU 34 1HB GLU 34 16.353 -22.160 -0.069 255 HG2 GLU 34 2HG GLU 34 13.575 -21.257 0.748 256 HG3 GLU 34 1HG GLU 34 14.528 -22.416 1.666 257 H GLU 35 H GLU 35 13.582 -19.207 -0.652 258 HA GLU 35 HA GLU 35 11.134 -20.282 -1.628 259 HB2 GLU 35 2HB GLU 35 11.802 -17.492 -0.599 260 HB3 GLU 35 1HB GLU 35 10.181 -17.973 -1.096 261 HG2 GLU 35 2HG GLU 35 10.367 -19.855 0.627 262 HG3 GLU 35 1HG GLU 35 11.801 -19.020 1.229 263 H ARG 36 H ARG 36 13.316 -17.695 -2.908 264 HA ARG 36 HA ARG 36 11.463 -16.872 -4.927 265 HB2 ARG 36 2HB ARG 36 13.188 -15.289 -5.578 266 HB3 ARG 36 1HB ARG 36 13.054 -15.305 -3.821 267 HG2 ARG 36 2HG ARG 36 15.075 -16.622 -3.611 268 HG3 ARG 36 1HG ARG 36 15.179 -16.829 -5.362 269 HD2 ARG 36 2HD ARG 36 15.525 -14.259 -3.793 270 HD3 ARG 36 1HD ARG 36 16.763 -15.140 -4.701 271 HE ARG 36 HE ARG 36 14.608 -13.493 -5.781 272 HH11 ARG 36 1HH1 ARG 36 17.338 -15.571 -6.522 273 HH12 ARG 36 2HH1 ARG 36 17.449 -15.015 -8.166 274 HH21 ARG 36 1HH2 ARG 36 14.763 -12.765 -7.890 275 HH22 ARG 36 2HH2 ARG 36 15.983 -13.419 -8.939 276 H ASP 37 H ASP 37 13.914 -19.297 -4.717 277 HA ASP 37 HA ASP 37 14.669 -19.492 -7.437 278 HB2 ASP 37 2HB ASP 37 15.876 -20.581 -5.521 279 HB3 ASP 37 1HB ASP 37 14.547 -21.725 -5.356 280 H ASP 38 H ASP 38 11.898 -20.715 -5.648 281 HA ASP 38 HA ASP 38 10.767 -21.923 -8.114 282 HB2 ASP 38 2HB ASP 38 11.437 -23.529 -6.258 283 HB3 ASP 38 1HB ASP 38 10.237 -22.766 -5.225 284 H PHE 39 H PHE 39 10.449 -19.135 -6.432 285 HA PHE 39 HA PHE 39 7.770 -19.222 -5.491 286 HB2 PHE 39 2HB PHE 39 7.982 -17.012 -4.805 287 HB3 PHE 39 1HB PHE 39 9.643 -17.556 -4.781 288 HD1 PHE 39 HD1 PHE 39 10.469 -17.180 -7.649 289 HD2 PHE 39 HD2 PHE 39 8.083 -14.702 -5.108 290 HE1 PHE 39 HE1 PHE 39 11.144 -15.198 -8.939 291 HE2 PHE 39 HE2 PHE 39 8.758 -12.728 -6.409 292 HZ PHE 39 HZ PHE 39 10.285 -12.973 -8.327 293 H ASP 40 H ASP 40 5.924 -18.224 -6.253 294 HA ASP 40 HA ASP 40 5.503 -18.192 -9.126 295 HB2 ASP 40 2HB ASP 40 3.816 -19.063 -7.398 296 HB3 ASP 40 1HB ASP 40 3.571 -17.400 -6.881 297 H GLY 41 H GLY 41 4.358 -16.157 -10.066 298 HA2 GLY 41 2HA GLY 41 5.990 -13.915 -10.129 299 HA3 GLY 41 1HA GLY 41 4.300 -13.915 -10.593 300 H LEU 42 H LEU 42 5.023 -11.579 -9.727 301 HA LEU 42 HA LEU 42 5.587 -10.980 -7.100 302 HB2 LEU 42 2HB LEU 42 5.514 -9.450 -9.218 303 HB3 LEU 42 1HB LEU 42 3.838 -9.164 -8.804 304 HG LEU 42 HG LEU 42 5.373 -7.336 -8.064 305 HD11 LEU 42 1HD1 LEU 42 4.547 -7.007 -5.790 306 HD12 LEU 42 2HD1 LEU 42 4.049 -8.699 -5.702 307 HD13 LEU 42 3HD1 LEU 42 3.263 -7.605 -6.842 308 HD21 LEU 42 3HD2 LEU 42 6.572 -9.389 -6.185 309 HD22 LEU 42 1HD2 LEU 42 6.938 -7.661 -6.214 310 HD23 LEU 42 2HD2 LEU 42 7.366 -8.672 -7.591 311 H SER 43 H SER 43 4.511 -11.805 -5.423 312 HA SER 43 HA SER 43 1.837 -12.615 -5.394 313 HB2 SER 43 2HB SER 43 3.757 -12.130 -3.086 314 HB3 SER 43 1HB SER 43 2.235 -13.023 -2.969 315 HG SER 43 HG SER 43 4.544 -14.015 -3.585 316 H TYR 44 H TYR 44 0.166 -11.322 -5.455 317 HA TYR 44 HA TYR 44 -0.319 -9.636 -3.147 318 HB2 TYR 44 2HB TYR 44 -0.932 -7.639 -4.293 319 HB3 TYR 44 1HB TYR 44 0.626 -8.095 -4.934 320 HD1 TYR 44 HD2 TYR 44 0.463 -9.543 -7.246 321 HD2 TYR 44 HD1 TYR 44 -2.539 -6.869 -5.785 322 HE1 TYR 44 HE2 TYR 44 -0.394 -9.240 -9.534 323 HE2 TYR 44 HE1 TYR 44 -3.383 -6.563 -8.069 324 HH TYR 44 HH TYR 44 -2.619 -6.768 -10.340 325 H PHE 45 H PHE 45 -2.768 -8.671 -3.681 326 HA PHE 45 HA PHE 45 -4.371 -11.104 -3.507 327 HB2 PHE 45 2HB PHE 45 -5.101 -8.161 -3.211 328 HB3 PHE 45 1HB PHE 45 -6.243 -9.477 -3.004 329 HD1 PHE 45 HD2 PHE 45 -3.325 -7.763 -1.529 330 HD2 PHE 45 HD1 PHE 45 -6.208 -10.884 -1.001 331 HE1 PHE 45 HE2 PHE 45 -2.709 -7.936 0.845 332 HE2 PHE 45 HE1 PHE 45 -5.586 -11.047 1.373 333 HZ PHE 45 HZ PHE 45 -3.838 -9.575 2.299 334 H ASP 46 H ASP 46 -6.511 -11.266 -4.754 335 HA ASP 46 HA ASP 46 -6.070 -10.813 -7.574 336 HB2 ASP 46 2HB ASP 46 -7.158 -12.889 -6.825 337 HB3 ASP 46 1HB ASP 46 -8.465 -11.970 -6.095 338 HA PRO 47 HA PRO 47 -7.914 -6.693 -7.439 339 HB2 PRO 47 2HB PRO 47 -8.125 -6.291 -10.167 340 HB3 PRO 47 1HB PRO 47 -6.588 -6.195 -9.280 341 HG2 PRO 47 2HG PRO 47 -7.701 -8.504 -10.854 342 HG3 PRO 47 1HG PRO 47 -6.058 -7.820 -10.875 343 HD2 PRO 47 2HD PRO 47 -6.606 -10.040 -9.475 344 HD3 PRO 47 1HD PRO 47 -5.463 -8.824 -8.857 345 H ASP 48 H ASP 48 -9.996 -6.712 -6.652 346 HA ASP 48 HA ASP 48 -12.196 -7.561 -8.449 347 HB2 ASP 48 2HB ASP 48 -11.973 -8.852 -6.289 348 HB3 ASP 48 1HB ASP 48 -12.258 -7.363 -5.404 349 HA PRO 49 HA PRO 49 -12.857 -3.117 -8.674 350 HB2 PRO 49 2HB PRO 49 -15.152 -3.100 -10.176 351 HB3 PRO 49 1HB PRO 49 -13.578 -3.573 -10.854 352 HG2 PRO 49 2HG PRO 49 -15.777 -5.357 -9.820 353 HG3 PRO 49 1HG PRO 49 -14.872 -5.469 -11.349 354 HD2 PRO 49 2HD PRO 49 -14.206 -6.990 -9.219 355 HD3 PRO 49 1HD PRO 49 -12.964 -6.345 -10.319 356 H ASP 50 H ASP 50 -15.368 -5.261 -7.389 357 HA ASP 50 HA ASP 50 -17.032 -3.119 -6.341 358 HB2 ASP 50 2HB ASP 50 -17.177 -6.122 -5.794 359 HB3 ASP 50 1HB ASP 50 -18.412 -4.931 -5.373 360 H TYR 51 H TYR 51 -14.352 -4.985 -5.269 361 HA TYR 51 HA TYR 51 -14.837 -4.709 -2.407 362 HB2 TYR 51 2HB TYR 51 -13.466 -6.583 -3.860 363 HB3 TYR 51 1HB TYR 51 -12.125 -5.518 -3.476 364 HD1 TYR 51 HD2 TYR 51 -11.951 -4.840 -0.872 365 HD2 TYR 51 HD1 TYR 51 -13.987 -8.295 -2.362 366 HE1 TYR 51 HE2 TYR 51 -11.778 -5.898 1.340 367 HE2 TYR 51 HE1 TYR 51 -13.810 -9.349 -0.161 368 HH TYR 51 HH TYR 51 -12.890 -7.649 2.630 369 H ARG 52 H ARG 52 -13.209 -3.136 -4.979 370 HA ARG 52 HA ARG 52 -11.585 -1.226 -3.693 371 HB2 ARG 52 2HB ARG 52 -11.454 -1.756 -6.084 372 HB3 ARG 52 1HB ARG 52 -13.122 -1.255 -6.324 373 HG2 ARG 52 2HG ARG 52 -12.417 1.091 -5.720 374 HG3 ARG 52 1HG ARG 52 -10.745 0.514 -5.718 375 HD2 ARG 52 2HD ARG 52 -11.233 1.525 -7.872 376 HD3 ARG 52 1HD ARG 52 -11.032 -0.214 -8.096 377 HE ARG 52 HE ARG 52 -13.729 0.119 -7.732 378 HH11 ARG 52 1HH1 ARG 52 -11.407 1.444 -10.029 379 HH12 ARG 52 2HH1 ARG 52 -12.592 1.638 -11.282 380 HH21 ARG 52 1HH2 ARG 52 -15.262 0.442 -9.370 381 HH22 ARG 52 2HH2 ARG 52 -14.769 1.072 -10.913 382 H VAL 53 H VAL 53 -12.152 0.631 -2.596 383 HA VAL 53 HA VAL 53 -14.986 1.548 -2.572 384 HB VAL 53 HB VAL 53 -14.727 2.209 -0.229 385 HG11 VAL 53 1HG1 VAL 53 -13.862 -0.687 -0.605 386 HG12 VAL 53 2HG1 VAL 53 -15.521 -0.079 -0.611 387 HG13 VAL 53 3HG1 VAL 53 -14.563 -0.007 0.869 388 HG21 VAL 53 3HG2 VAL 53 -12.344 2.803 -0.194 389 HG22 VAL 53 1HG2 VAL 53 -11.892 1.102 -0.349 390 HG23 VAL 53 2HG2 VAL 53 -12.706 1.674 1.111 391 H GLU 54 H GLU 54 -15.205 3.907 -2.041 392 HA GLU 54 HA GLU 54 -12.968 5.540 -3.085 393 HB2 GLU 54 2HB GLU 54 -14.654 7.347 -3.303 394 HB3 GLU 54 1HB GLU 54 -15.111 5.912 -4.212 395 HG2 GLU 54 2HG GLU 54 -16.754 5.307 -2.506 396 HG3 GLU 54 1HG GLU 54 -16.234 6.647 -1.487 397 H ALA 55 H ALA 55 -12.307 7.460 -1.895 398 HA ALA 55 HA ALA 55 -13.011 7.613 0.956 399 HB1 ALA 55 3HB ALA 55 -11.135 6.011 0.840 400 HB2 ALA 55 1HB ALA 55 -10.652 7.496 1.662 401 HB3 ALA 55 2HB ALA 55 -10.152 7.204 -0.009 402 H THR 56 H THR 56 -12.689 9.610 1.854 403 HA THR 56 HA THR 56 -12.010 11.866 0.119 404 HB THR 56 HB THR 56 -13.199 11.863 2.937 405 HG1 THR 56 HG1 THR 56 -14.323 11.369 0.477 406 HG21 THR 56 3HG2 THR 56 -13.894 14.170 2.414 407 HG22 THR 56 1HG2 THR 56 -13.123 14.064 0.830 408 HG23 THR 56 2HG2 THR 56 -12.140 14.023 2.297 409 H VAL 57 H VAL 57 -10.045 12.738 0.268 410 HA VAL 57 HA VAL 57 -8.010 11.843 2.055 411 HB VAL 57 HB VAL 57 -7.870 14.232 0.147 412 HG11 VAL 57 1HG1 VAL 57 -5.682 12.407 1.212 413 HG12 VAL 57 2HG1 VAL 57 -5.982 14.070 1.720 414 HG13 VAL 57 3HG1 VAL 57 -5.453 13.735 0.070 415 HG21 VAL 57 3HG2 VAL 57 -8.697 12.271 -1.094 416 HG22 VAL 57 1HG2 VAL 57 -7.316 11.325 -0.528 417 HG23 VAL 57 2HG2 VAL 57 -7.062 12.708 -1.596 418 H THR 58 H THR 58 -7.160 12.874 3.810 419 HA THR 58 HA THR 58 -8.043 15.611 4.531 420 HB THR 58 HB THR 58 -7.534 13.287 6.465 421 HG1 THR 58 HG1 THR 58 -9.571 12.845 6.168 422 HG21 THR 58 3HG2 THR 58 -8.557 16.104 7.005 423 HG22 THR 58 1HG2 THR 58 -6.970 15.475 7.464 424 HG23 THR 58 2HG2 THR 58 -8.431 14.809 8.197 425 H VAL 59 H VAL 59 -6.200 16.728 3.931 426 HA VAL 59 HA VAL 59 -3.553 15.491 4.262 427 HB VAL 59 HB VAL 59 -4.451 17.955 2.702 428 HG11 VAL 59 1HG1 VAL 59 -2.112 18.221 1.915 429 HG12 VAL 59 2HG1 VAL 59 -1.587 16.960 3.034 430 HG13 VAL 59 3HG1 VAL 59 -2.229 18.481 3.657 431 HG21 VAL 59 3HG2 VAL 59 -4.925 15.798 1.643 432 HG22 VAL 59 1HG2 VAL 59 -3.241 15.302 1.842 433 HG23 VAL 59 2HG2 VAL 59 -3.649 16.636 0.760 434 H HIS 60 H HIS 60 -2.048 16.213 5.666 435 HA HIS 60 HA HIS 60 -2.954 18.086 7.750 436 HB2 HIS 60 2HB HIS 60 -0.788 15.930 7.824 437 HB3 HIS 60 1HB HIS 60 -1.271 16.949 9.188 438 HD1 HIS 60 HD1 HIS 60 -2.323 13.978 7.211 439 HD2 HIS 60 HD2 HIS 60 -3.866 16.364 10.236 440 HE1 HIS 60 HE1 HIS 60 -4.398 12.823 8.005 441 HE2 HIS 60 HE2 HIS 60 -5.177 14.171 9.961 442 H GLU 61 H GLU 61 -2.016 19.939 7.997 443 HA GLU 61 HA GLU 61 0.243 20.800 6.365 444 HB2 GLU 61 2HB GLU 61 -0.141 23.039 7.339 445 HB3 GLU 61 1HB GLU 61 -1.618 22.365 6.656 446 HG2 GLU 61 2HG GLU 61 -2.462 21.830 8.881 447 HG3 GLU 61 1HG GLU 61 -0.943 22.344 9.618 448 H THR 62 H THR 62 -0.195 19.386 9.453 449 HA THR 62 HA THR 62 2.625 19.916 10.164 450 HB THR 62 HB THR 62 1.878 19.523 12.577 451 HG1 THR 62 HG1 THR 62 -0.138 18.563 12.143 452 HG21 THR 62 3HG2 THR 62 2.307 21.827 11.779 453 HG22 THR 62 1HG2 THR 62 0.974 21.796 12.938 454 HG23 THR 62 2HG2 THR 62 0.640 21.944 11.211 455 HA PRO 63 HA PRO 63 2.035 15.360 9.393 456 HB2 PRO 63 2HB PRO 63 4.269 14.927 7.912 457 HB3 PRO 63 1HB PRO 63 2.833 15.705 7.215 458 HG2 PRO 63 2HG PRO 63 5.378 16.960 8.170 459 HG3 PRO 63 1HG PRO 63 4.414 17.332 6.725 460 HD2 PRO 63 2HD PRO 63 4.294 18.786 9.087 461 HD3 PRO 63 1HD PRO 63 2.990 18.731 7.880 462 H GLU 64 H GLU 64 2.668 13.817 10.849 463 HA GLU 64 HA GLU 64 4.861 14.305 12.696 464 HB2 GLU 64 2HB GLU 64 4.012 12.364 13.918 465 HB3 GLU 64 1HB GLU 64 2.672 13.420 13.486 466 HG2 GLU 64 2HG GLU 64 2.186 11.890 11.540 467 HG3 GLU 64 1HG GLU 64 3.418 10.794 12.161 468 H SER 65 H SER 65 6.415 12.570 13.212 469 HA SER 65 HA SER 65 7.668 11.542 10.778 470 HB2 SER 65 2HB SER 65 9.616 11.145 12.392 471 HB3 SER 65 1HB SER 65 9.126 12.825 12.205 472 HG SER 65 HG SER 65 8.142 11.192 14.304 473 H VAL 66 H VAL 66 7.015 9.578 10.182 474 HA VAL 66 HA VAL 66 6.350 7.466 12.136 475 HB VAL 66 HB VAL 66 5.553 7.601 9.185 476 HG11 VAL 66 1HG1 VAL 66 4.497 5.833 11.424 477 HG12 VAL 66 2HG1 VAL 66 5.527 5.318 10.088 478 HG13 VAL 66 3HG1 VAL 66 3.883 5.871 9.767 479 HG21 VAL 66 3HG2 VAL 66 3.296 8.315 9.931 480 HG22 VAL 66 1HG2 VAL 66 4.531 9.508 10.351 481 HG23 VAL 66 2HG2 VAL 66 3.883 8.432 11.594 482 H ASP 67 H ASP 67 7.963 6.008 12.381 483 HA ASP 67 HA ASP 67 10.146 5.744 10.486 484 HB2 ASP 67 2HB ASP 67 9.595 4.288 13.115 485 HB3 ASP 67 1HB ASP 67 11.062 4.097 12.158 486 H LEU 68 H LEU 68 9.909 4.497 8.730 487 HA LEU 68 HA LEU 68 8.611 1.831 8.953 488 HB2 LEU 68 2HB LEU 68 8.484 3.600 6.476 489 HB3 LEU 68 1HB LEU 68 7.669 2.064 6.723 490 HG LEU 68 HG LEU 68 7.013 4.652 8.196 491 HD11 LEU 68 1HD1 LEU 68 4.996 4.732 6.864 492 HD12 LEU 68 2HD1 LEU 68 5.467 3.270 5.993 493 HD13 LEU 68 3HD1 LEU 68 6.415 4.748 5.822 494 HD21 LEU 68 3HD2 LEU 68 5.546 1.999 8.240 495 HD22 LEU 68 1HD2 LEU 68 5.032 3.492 9.032 496 HD23 LEU 68 2HD2 LEU 68 6.500 2.677 9.560 497 H GLU 69 H GLU 69 9.311 0.469 6.942 498 HA GLU 69 HA GLU 69 12.181 0.408 6.736 499 HB2 GLU 69 2HB GLU 69 11.871 -1.581 5.358 500 HB3 GLU 69 1HB GLU 69 10.799 -1.678 6.746 501 HG2 GLU 69 2HG GLU 69 8.891 -1.005 5.345 502 HG3 GLU 69 1HG GLU 69 9.951 -0.876 3.941 503 H THR 70 H THR 70 13.438 0.890 4.935 504 HA THR 70 HA THR 70 12.057 1.672 2.428 505 HB THR 70 HB THR 70 13.580 3.445 3.452 506 HG1 THR 70 HG1 THR 70 13.102 3.454 1.221 507 HG21 THR 70 3HG2 THR 70 15.400 1.960 4.279 508 HG22 THR 70 1HG2 THR 70 16.020 3.200 3.183 509 HG23 THR 70 2HG2 THR 70 15.810 1.544 2.613 510 H SER 71 H SER 71 13.658 1.102 0.488 511 HA SER 71 HA SER 71 13.455 -1.675 0.206 512 HB2 SER 71 2HB SER 71 15.103 0.217 -1.514 513 HB3 SER 71 1HB SER 71 14.449 -1.349 -1.998 514 HG SER 71 HG SER 71 12.405 0.036 -1.118 515 H ASP 72 H ASP 72 16.414 0.344 0.657 516 HA ASP 72 HA ASP 72 18.163 -1.897 0.943 517 HB2 ASP 72 2HB ASP 72 18.578 1.048 1.643 518 HB3 ASP 72 1HB ASP 72 19.855 -0.164 1.521 519 H ASP 73 H ASP 73 16.077 -2.296 2.791 520 HA ASP 73 HA ASP 73 15.619 -2.940 4.878 521 HB2 ASP 73 2HB ASP 73 17.192 -4.494 5.853 522 HB3 ASP 73 1HB ASP 73 17.205 -4.653 4.110 523 H ARG 74 H ARG 74 16.408 -0.150 4.829 524 HA ARG 74 HA ARG 74 17.700 0.288 7.450 525 HB2 ARG 74 2HB ARG 74 18.573 1.393 5.299 526 HB3 ARG 74 1HB ARG 74 17.079 2.313 5.248 527 HG2 ARG 74 2HG ARG 74 17.679 3.337 7.442 528 HG3 ARG 74 1HG ARG 74 19.212 2.465 7.402 529 HD2 ARG 74 2HD ARG 74 19.758 3.648 5.265 530 HD3 ARG 74 1HD ARG 74 18.260 4.572 5.432 531 HE ARG 74 HE ARG 74 20.201 4.668 7.619 532 HH11 ARG 74 1HH1 ARG 74 18.775 6.345 4.878 533 HH12 ARG 74 2HH1 ARG 74 19.375 7.896 5.373 534 HH21 ARG 74 1HH2 ARG 74 20.989 6.696 8.251 535 HH22 ARG 74 2HH2 ARG 74 20.628 8.092 7.283 536 H THR 75 H THR 75 16.698 2.409 8.496 537 HA THR 75 HA THR 75 13.749 2.281 8.495 538 HB THR 75 HB THR 75 15.472 2.965 10.936 539 HG1 THR 75 HG1 THR 75 14.110 0.738 11.365 540 HG21 THR 75 3HG2 THR 75 13.348 2.755 12.180 541 HG22 THR 75 1HG2 THR 75 12.490 2.401 10.678 542 HG23 THR 75 2HG2 THR 75 13.217 3.992 10.929 543 H VAL 76 H VAL 76 12.844 4.291 8.207 544 HA VAL 76 HA VAL 76 14.484 6.712 8.350 545 HB VAL 76 HB VAL 76 13.717 7.460 6.013 546 HG11 VAL 76 1HG1 VAL 76 15.596 6.389 4.843 547 HG12 VAL 76 2HG1 VAL 76 15.727 5.181 6.124 548 HG13 VAL 76 3HG1 VAL 76 16.059 6.879 6.475 549 HG21 VAL 76 3HG2 VAL 76 13.216 5.707 4.341 550 HG22 VAL 76 1HG2 VAL 76 12.000 5.741 5.619 551 HG23 VAL 76 2HG2 VAL 76 13.232 4.479 5.612 552 H ARG 77 H ARG 77 13.345 8.589 8.422 553 HA ARG 77 HA ARG 77 10.762 8.547 9.602 554 HB2 ARG 77 2HB ARG 77 12.360 10.215 10.297 555 HB3 ARG 77 1HB ARG 77 12.638 10.754 8.652 556 HG2 ARG 77 2HG ARG 77 9.881 11.101 9.812 557 HG3 ARG 77 1HG ARG 77 11.162 12.170 10.379 558 HD2 ARG 77 2HD ARG 77 10.323 11.825 7.472 559 HD3 ARG 77 1HD ARG 77 9.847 13.157 8.522 560 HE ARG 77 HE ARG 77 12.120 13.912 8.568 561 HH11 ARG 77 1HH1 ARG 77 11.536 11.412 6.162 562 HH12 ARG 77 2HH1 ARG 77 12.940 11.819 5.229 563 HH21 ARG 77 1HH2 ARG 77 13.969 14.419 7.342 564 HH22 ARG 77 2HH2 ARG 77 14.319 13.524 5.896 565 H TYR 78 H TYR 78 8.826 8.656 8.624 566 HA TYR 78 HA TYR 78 8.546 9.715 5.871 567 HB2 TYR 78 2HB TYR 78 6.899 7.668 7.420 568 HB3 TYR 78 1HB TYR 78 6.224 8.520 6.036 569 HD1 TYR 78 HD2 TYR 78 9.442 6.669 6.807 570 HD2 TYR 78 HD1 TYR 78 6.222 7.287 4.059 571 HE1 TYR 78 HE2 TYR 78 10.388 4.972 5.304 572 HE2 TYR 78 HE1 TYR 78 7.175 5.591 2.559 573 HH TYR 78 HH TYR 78 9.628 3.451 3.517 574 H LEU 79 H LEU 79 7.190 11.419 5.581 575 HA LEU 79 HA LEU 79 6.082 12.764 7.947 576 HB2 LEU 79 2HB LEU 79 6.577 13.726 5.102 577 HB3 LEU 79 1HB LEU 79 5.711 14.683 6.299 578 HG LEU 79 HG LEU 79 8.614 13.777 6.533 579 HD11 LEU 79 1HD1 LEU 79 9.199 16.136 6.264 580 HD12 LEU 79 2HD1 LEU 79 7.499 16.553 6.031 581 HD13 LEU 79 3HD1 LEU 79 8.331 15.538 4.852 582 HD21 LEU 79 3HD2 LEU 79 7.555 13.877 8.738 583 HD22 LEU 79 1HD2 LEU 79 6.968 15.512 8.413 584 HD23 LEU 79 2HD2 LEU 79 8.702 15.201 8.549 585 H HIS 80 H HIS 80 4.054 12.351 8.442 586 HA HIS 80 HA HIS 80 2.264 10.946 6.705 587 HB2 HIS 80 2HB HIS 80 2.179 10.499 9.088 588 HB3 HIS 80 1HB HIS 80 1.913 12.200 9.461 589 HD2 HIS 80 HD2 HIS 80 -0.194 9.913 6.991 590 HE1 HIS 80 HE1 HIS 80 -2.692 11.572 9.965 591 HE2 HIS 80 HE2 HIS 80 -2.615 10.218 7.834 592 H VAL 81 H VAL 81 1.661 12.069 4.951 593 HA VAL 81 HA VAL 81 1.109 14.939 5.088 594 HB VAL 81 HB VAL 81 1.071 14.881 2.607 595 HG11 VAL 81 1HG1 VAL 81 3.524 13.549 3.819 596 HG12 VAL 81 2HG1 VAL 81 3.197 15.283 3.769 597 HG13 VAL 81 3HG1 VAL 81 3.468 14.395 2.270 598 HG21 VAL 81 3HG2 VAL 81 1.687 12.819 1.373 599 HG22 VAL 81 1HG2 VAL 81 0.168 12.613 2.251 600 HG23 VAL 81 2HG2 VAL 81 1.654 11.900 2.883 601 H ALA 82 H ALA 82 -0.728 11.960 4.776 602 HA ALA 82 HA ALA 82 -3.223 13.489 4.705 603 HB1 ALA 82 3HB ALA 82 -2.546 11.545 2.463 604 HB2 ALA 82 1HB ALA 82 -2.648 13.303 2.315 605 HB3 ALA 82 2HB ALA 82 -4.093 12.365 2.695 606 H THR 83 H THR 83 -5.098 12.248 5.105 607 HA THR 83 HA THR 83 -4.781 9.402 5.831 608 HB THR 83 HB THR 83 -6.408 11.481 7.394 609 HG1 THR 83 HG1 THR 83 -4.515 9.929 8.685 610 HG21 THR 83 3HG2 THR 83 -6.948 9.639 8.945 611 HG22 THR 83 1HG2 THR 83 -6.111 8.493 7.899 612 HG23 THR 83 2HG2 THR 83 -7.580 9.296 7.335 613 H LEU 84 H LEU 84 -6.245 8.197 4.753 614 HA LEU 84 HA LEU 84 -8.121 9.577 2.939 615 HB2 LEU 84 2HB LEU 84 -7.165 6.690 2.716 616 HB3 LEU 84 1HB LEU 84 -7.881 7.695 1.465 617 HG LEU 84 HG LEU 84 -5.071 7.961 2.615 618 HD11 LEU 84 1HD1 LEU 84 -5.965 7.144 -0.162 619 HD12 LEU 84 2HD1 LEU 84 -5.303 6.080 1.083 620 HD13 LEU 84 3HD1 LEU 84 -4.293 7.341 0.381 621 HD21 LEU 84 3HD2 LEU 84 -4.670 9.751 0.973 622 HD22 LEU 84 1HD2 LEU 84 -5.927 10.199 2.125 623 HD23 LEU 84 2HD2 LEU 84 -6.369 9.701 0.492 624 H SER 85 H SER 85 -9.997 9.722 4.064 625 HA SER 85 HA SER 85 -10.830 7.661 5.952 626 HB2 SER 85 2HB SER 85 -11.946 10.447 5.400 627 HB3 SER 85 1HB SER 85 -12.427 9.390 6.731 628 HG SER 85 HG SER 85 -10.489 9.665 7.680 629 H PHE 86 H PHE 86 -12.484 6.282 5.588 630 HA PHE 86 HA PHE 86 -14.466 6.683 3.504 631 HB2 PHE 86 2HB PHE 86 -13.922 4.515 2.353 632 HB3 PHE 86 1HB PHE 86 -12.698 5.747 2.137 633 HD1 PHE 86 HD1 PHE 86 -10.465 5.499 3.129 634 HD2 PHE 86 HD2 PHE 86 -13.425 2.451 3.639 635 HE1 PHE 86 HE1 PHE 86 -8.724 3.929 3.862 636 HE2 PHE 86 HE2 PHE 86 -11.668 0.888 4.378 637 HZ PHE 86 HZ PHE 86 -9.325 1.628 4.490 638 H ASP 87 H ASP 87 -15.877 4.658 3.348 639 HA ASP 87 HA ASP 87 -16.225 3.388 6.005 640 HB2 ASP 87 2HB ASP 87 -18.546 2.950 5.444 641 HB3 ASP 87 1HB ASP 87 -18.219 4.661 5.197 642 H LEU 88 H LEU 88 -16.231 1.221 6.159 643 HA LEU 88 HA LEU 88 -16.156 -0.596 3.919 644 HB2 LEU 88 2HB LEU 88 -13.777 0.148 3.981 645 HB3 LEU 88 1HB LEU 88 -13.683 -0.261 5.688 646 HG LEU 88 HG LEU 88 -14.093 -2.685 5.072 647 HD11 LEU 88 1HD1 LEU 88 -15.230 -2.385 2.938 648 HD12 LEU 88 2HD1 LEU 88 -13.813 -3.413 2.742 649 HD13 LEU 88 3HD1 LEU 88 -13.758 -1.728 2.215 650 HD21 LEU 88 3HD2 LEU 88 -11.823 -1.919 5.517 651 HD22 LEU 88 1HD2 LEU 88 -11.632 -1.411 3.835 652 HD23 LEU 88 2HD2 LEU 88 -11.815 -3.123 4.228 653 H ASP 89 H ASP 89 -17.234 -2.347 4.613 654 HA ASP 89 HA ASP 89 -18.141 -4.003 5.880 655 HB2 ASP 89 2HB ASP 89 -15.724 -4.253 6.690 656 HB3 ASP 89 1HB ASP 89 -16.143 -3.243 8.064 657 H GLY 90 H GLY 90 -18.966 -1.105 6.020 658 HA2 GLY 90 2HA GLY 90 -20.659 0.090 7.013 659 HA3 GLY 90 1HA GLY 90 -20.960 -1.272 8.072 660 H GLU 91 H GLU 91 -17.722 -0.042 8.128 661 HA GLU 91 HA GLU 91 -18.280 1.707 10.455 662 HB2 GLU 91 2HB GLU 91 -16.311 0.848 11.624 663 HB3 GLU 91 1HB GLU 91 -17.419 -0.475 11.292 664 HG2 GLU 91 2HG GLU 91 -16.035 -1.312 9.525 665 HG3 GLU 91 1HG GLU 91 -15.013 0.124 9.547 666 H SER 92 H SER 92 -16.600 3.338 10.816 667 HA SER 92 HA SER 92 -15.770 4.490 8.285 668 HB2 SER 92 2HB SER 92 -16.922 5.820 10.089 669 HB3 SER 92 1HB SER 92 -15.500 5.609 11.109 670 HG SER 92 HG SER 92 -15.495 6.826 8.540 671 H ARG 93 H ARG 93 -14.021 3.305 7.581 672 HA ARG 93 HA ARG 93 -11.612 3.068 9.278 673 HB2 ARG 93 2HB ARG 93 -12.308 1.737 6.626 674 HB3 ARG 93 1HB ARG 93 -10.784 1.516 7.472 675 HG2 ARG 93 2HG ARG 93 -13.517 0.696 8.499 676 HG3 ARG 93 1HG ARG 93 -12.299 -0.384 7.817 677 HD2 ARG 93 2HD ARG 93 -12.145 -0.624 10.186 678 HD3 ARG 93 1HD ARG 93 -10.754 0.363 9.720 679 HE ARG 93 HE ARG 93 -13.099 1.867 10.493 680 HH11 ARG 93 1HH1 ARG 93 -10.227 0.315 11.761 681 HH12 ARG 93 2HH1 ARG 93 -10.185 1.310 13.171 682 HH21 ARG 93 1HH2 ARG 93 -12.940 3.239 12.266 683 HH22 ARG 93 2HH2 ARG 93 -11.715 2.966 13.462 684 H ASP 94 H ASP 94 -9.676 3.956 8.727 685 HA ASP 94 HA ASP 94 -9.433 5.509 6.225 686 HB2 ASP 94 2HB ASP 94 -8.357 7.386 7.546 687 HB3 ASP 94 1HB ASP 94 -10.084 7.196 7.802 688 H LEU 95 H LEU 95 -7.535 5.275 5.227 689 HA LEU 95 HA LEU 95 -5.298 3.926 6.637 690 HB2 LEU 95 2HB LEU 95 -5.757 4.188 3.634 691 HB3 LEU 95 1HB LEU 95 -4.420 3.341 4.402 692 HG LEU 95 HG LEU 95 -7.343 2.529 4.322 693 HD11 LEU 95 1HD1 LEU 95 -6.010 1.900 2.384 694 HD12 LEU 95 2HD1 LEU 95 -6.469 0.476 3.310 695 HD13 LEU 95 3HD1 LEU 95 -4.822 1.105 3.423 696 HD21 LEU 95 3HD2 LEU 95 -5.195 1.272 6.061 697 HD22 LEU 95 1HD2 LEU 95 -6.816 0.625 5.791 698 HD23 LEU 95 2HD2 LEU 95 -6.612 2.162 6.627 699 H HIS 96 H HIS 96 -3.354 4.955 6.827 700 HA HIS 96 HA HIS 96 -3.405 7.837 6.305 701 HB2 HIS 96 2HB HIS 96 -1.609 6.109 8.066 702 HB3 HIS 96 1HB HIS 96 -1.427 7.854 7.883 703 HD2 HIS 96 HD2 HIS 96 -4.482 5.521 8.927 704 HE1 HIS 96 HE1 HIS 96 -4.379 8.980 11.343 705 HE2 HIS 96 HE2 HIS 96 -5.735 6.965 10.658 706 H ALA 97 H ALA 97 -2.242 8.754 4.776 707 HA ALA 97 HA ALA 97 -0.435 7.161 3.084 708 HB1 ALA 97 3HB ALA 97 -2.412 8.122 1.964 709 HB2 ALA 97 1HB ALA 97 -0.930 8.849 1.342 710 HB3 ALA 97 2HB ALA 97 -1.944 9.742 2.483 711 H PHE 98 H PHE 98 1.675 7.611 3.150 712 HA PHE 98 HA PHE 98 2.667 10.283 3.759 713 HB2 PHE 98 2HB PHE 98 4.468 8.806 5.278 714 HB3 PHE 98 1HB PHE 98 3.133 9.731 5.928 715 HD1 PHE 98 HD2 PHE 98 3.662 6.281 4.476 716 HD2 PHE 98 HD1 PHE 98 1.871 8.658 7.555 717 HE1 PHE 98 HE2 PHE 98 2.767 4.255 5.541 718 HE2 PHE 98 HE1 PHE 98 0.984 6.620 8.608 719 HZ PHE 98 HZ PHE 98 1.436 4.417 7.605 720 H ARG 99 H ARG 99 5.089 10.290 3.580 721 HA ARG 99 HA ARG 99 6.338 8.441 1.713 722 HB2 ARG 99 2HB ARG 99 6.987 10.238 0.131 723 HB3 ARG 99 1HB ARG 99 5.251 10.001 0.161 724 HG2 ARG 99 2HG ARG 99 6.009 12.107 2.058 725 HG3 ARG 99 1HG ARG 99 6.656 12.458 0.454 726 HD2 ARG 99 2HD ARG 99 3.751 11.885 1.114 727 HD3 ARG 99 1HD ARG 99 4.450 13.472 0.776 728 HE ARG 99 HE ARG 99 4.840 11.553 -1.356 729 HH11 ARG 99 1HH1 ARG 99 2.606 13.966 -0.074 730 HH12 ARG 99 2HH1 ARG 99 1.826 14.220 -1.598 731 HH21 ARG 99 1HH2 ARG 99 3.806 11.890 -3.332 732 HH22 ARG 99 2HH2 ARG 99 2.508 13.039 -3.454 733 H GLN 100 H GLN 100 8.747 8.993 1.585 734 HA GLN 100 HA GLN 100 9.754 9.026 4.149 735 HB2 GLN 100 2HB GLN 100 11.229 9.622 1.561 736 HB3 GLN 100 1HB GLN 100 12.036 9.390 3.109 737 HG2 GLN 100 2HG GLN 100 10.982 7.100 3.225 738 HG3 GLN 100 1HG GLN 100 10.401 7.350 1.580 739 HE21 GLN 100 1HE2 GLN 100 13.572 8.396 2.800 740 HE22 GLN 100 2HE2 GLN 100 14.495 7.302 1.833 741 H ALA 101 H ALA 101 10.704 11.755 1.939 742 HA ALA 101 HA ALA 101 10.301 13.563 4.269 743 HB1 ALA 101 3HB ALA 101 12.333 13.883 2.031 744 HB2 ALA 101 1HB ALA 101 12.678 13.338 3.674 745 HB3 ALA 101 2HB ALA 101 12.097 14.981 3.394 746 H ALA 102 H ALA 102 10.722 14.160 0.745 747 HA ALA 102 HA ALA 102 8.366 15.961 0.854 748 HB1 ALA 102 3HB ALA 102 10.455 17.221 1.243 749 HB2 ALA 102 1HB ALA 102 9.706 17.677 -0.289 750 HB3 ALA 102 2HB ALA 102 11.114 16.612 -0.276 751 H ASP 103 H ASP 103 8.208 13.388 -0.312 752 HA ASP 103 HA ASP 103 8.747 13.392 -3.111 753 HB2 ASP 103 2HB ASP 103 8.358 11.242 -2.033 754 HB3 ASP 103 1HB ASP 103 6.769 11.750 -1.491 755 H GLU 104 H GLU 104 7.590 14.061 -4.768 756 HA GLU 104 HA GLU 104 4.881 15.204 -4.456 757 HB2 GLU 104 2HB GLU 104 7.178 16.493 -6.005 758 HB3 GLU 104 1HB GLU 104 5.534 17.118 -5.890 759 HG2 GLU 104 2HG GLU 104 5.808 17.570 -3.517 760 HG3 GLU 104 1HG GLU 104 7.377 16.773 -3.504 761 H SER 105 H SER 105 6.635 12.839 -5.739 762 HA SER 105 HA SER 105 5.683 12.869 -8.496 763 HB2 SER 105 2HB SER 105 8.036 12.156 -7.829 764 HB3 SER 105 1HB SER 105 7.321 10.728 -7.081 765 HG SER 105 HG SER 105 6.549 10.106 -9.097 766 H ARG 106 H ARG 106 4.107 12.410 -5.837 767 HA ARG 106 HA ARG 106 1.941 11.831 -5.553 768 HB2 ARG 106 2HB ARG 106 2.091 10.267 -8.171 769 HB3 ARG 106 1HB ARG 106 0.619 10.660 -7.290 770 HG2 ARG 106 2HG ARG 106 2.464 12.615 -8.703 771 HG3 ARG 106 1HG ARG 106 0.848 12.127 -9.213 772 HD2 ARG 106 2HD ARG 106 -0.130 13.217 -7.261 773 HD3 ARG 106 1HD ARG 106 1.480 13.632 -6.654 774 HE ARG 106 HE ARG 106 0.463 14.660 -9.238 775 HH11 ARG 106 1HH1 ARG 106 1.907 15.293 -6.090 776 HH12 ARG 106 2HH1 ARG 106 2.151 16.978 -6.414 777 HH21 ARG 106 1HH2 ARG 106 0.764 16.885 -9.616 778 HH22 ARG 106 2HH2 ARG 106 1.505 17.875 -8.401 779 H THR 107 H THR 107 4.464 9.960 -5.075 780 HA THR 107 HA THR 107 3.256 7.321 -5.034 781 HB THR 107 HB THR 107 6.003 8.187 -4.038 782 HG1 THR 107 HG1 THR 107 4.963 7.749 -6.581 783 HG21 THR 107 3HG2 THR 107 5.322 5.962 -3.185 784 HG22 THR 107 1HG2 THR 107 6.604 5.801 -4.389 785 HG23 THR 107 2HG2 THR 107 4.931 5.442 -4.827 786 H LEU 108 H LEU 108 1.605 7.490 -3.537 787 HA LEU 108 HA LEU 108 2.192 8.210 -0.749 788 HB2 LEU 108 2HB LEU 108 -0.432 7.321 -1.989 789 HB3 LEU 108 1HB LEU 108 -0.217 7.972 -0.371 790 HG LEU 108 HG LEU 108 -0.001 9.455 -3.017 791 HD11 LEU 108 1HD1 LEU 108 -2.282 9.077 -2.216 792 HD12 LEU 108 2HD1 LEU 108 -1.860 10.786 -2.150 793 HD13 LEU 108 3HD1 LEU 108 -1.885 9.828 -0.666 794 HD21 LEU 108 3HD2 LEU 108 0.640 10.518 -0.238 795 HD22 LEU 108 1HD2 LEU 108 0.520 11.489 -1.709 796 HD23 LEU 108 2HD2 LEU 108 1.787 10.278 -1.559 797 H PHE 109 H PHE 109 2.510 6.734 0.767 798 HA PHE 109 HA PHE 109 2.339 3.859 0.113 799 HB2 PHE 109 2HB PHE 109 4.567 4.889 0.777 800 HB3 PHE 109 1HB PHE 109 3.873 5.286 2.342 801 HD1 PHE 109 HD1 PHE 109 4.466 2.340 0.077 802 HD2 PHE 109 HD2 PHE 109 4.154 3.745 4.111 803 HE1 PHE 109 HE1 PHE 109 5.206 0.146 0.915 804 HE2 PHE 109 HE2 PHE 109 4.888 1.545 4.932 805 HZ PHE 109 HZ PHE 109 5.418 -0.253 3.337 806 H VAL 110 H VAL 110 0.437 3.018 0.845 807 HA VAL 110 HA VAL 110 -0.611 3.854 3.494 808 HB VAL 110 HB VAL 110 -2.954 3.272 2.617 809 HG11 VAL 110 1HG1 VAL 110 -1.586 5.676 1.369 810 HG12 VAL 110 2HG1 VAL 110 -2.266 5.589 2.995 811 HG13 VAL 110 3HG1 VAL 110 -3.327 5.474 1.590 812 HG21 VAL 110 3HG2 VAL 110 -2.314 2.054 0.568 813 HG22 VAL 110 1HG2 VAL 110 -1.631 3.530 -0.113 814 HG23 VAL 110 2HG2 VAL 110 -3.370 3.414 0.184 815 HA PRO 111 HA PRO 111 -0.070 -0.730 3.916 816 HB2 PRO 111 2HB PRO 111 0.881 -0.646 6.491 817 HB3 PRO 111 1HB PRO 111 1.952 -0.443 5.088 818 HG2 PRO 111 2HG PRO 111 0.779 1.670 6.874 819 HG3 PRO 111 1HG PRO 111 2.432 1.533 6.229 820 HD2 PRO 111 2HD PRO 111 0.542 3.171 5.111 821 HD3 PRO 111 1HD PRO 111 1.846 2.421 4.165 822 H PHE 112 H PHE 112 -1.514 -2.050 5.144 823 HA PHE 112 HA PHE 112 -3.186 -0.787 7.181 824 HB2 PHE 112 2HB PHE 112 -5.277 -1.760 6.280 825 HB3 PHE 112 1HB PHE 112 -4.581 -0.564 5.203 826 HD1 PHE 112 HD2 PHE 112 -5.241 -4.196 5.660 827 HD2 PHE 112 HD1 PHE 112 -3.868 -1.164 2.959 828 HE1 PHE 112 HE2 PHE 112 -5.429 -5.766 3.783 829 HE2 PHE 112 HE1 PHE 112 -4.070 -2.757 1.098 830 HZ PHE 112 HZ PHE 112 -4.852 -5.052 1.509 831 H ARG 113 H ARG 113 -4.232 -2.274 8.573 832 HA ARG 113 HA ARG 113 -3.095 -5.015 8.613 833 HB2 ARG 113 2HB ARG 113 -2.027 -3.576 10.332 834 HB3 ARG 113 1HB ARG 113 -3.610 -3.149 10.982 835 HG2 ARG 113 2HG ARG 113 -3.989 -5.505 11.630 836 HG3 ARG 113 1HG ARG 113 -2.425 -5.948 10.943 837 HD2 ARG 113 2HD ARG 113 -1.315 -4.442 12.605 838 HD3 ARG 113 1HD ARG 113 -2.902 -4.125 13.326 839 HE ARG 113 HE ARG 113 -2.578 -6.885 13.251 840 HH11 ARG 113 1HH1 ARG 113 -1.046 -4.165 14.865 841 HH12 ARG 113 2HH1 ARG 113 -0.556 -5.105 16.240 842 HH21 ARG 113 1HH2 ARG 113 -1.913 -8.118 15.045 843 HH22 ARG 113 2HH2 ARG 113 -1.050 -7.348 16.337 844 H ASP 114 H ASP 114 -4.725 -6.483 8.394 845 HA ASP 114 HA ASP 114 -7.496 -5.673 9.083 846 HB2 ASP 114 2HB ASP 114 -8.171 -7.255 7.198 847 HB3 ASP 114 1HB ASP 114 -7.369 -5.773 6.692 848 H LYS 115 H LYS 115 -8.673 -8.218 8.782 849 HA LYS 115 HA LYS 115 -7.727 -9.481 11.246 850 HB2 LYS 115 2HB LYS 115 -10.252 -10.037 9.646 851 HB3 LYS 115 1HB LYS 115 -9.875 -10.687 11.242 852 HG2 LYS 115 2HG LYS 115 -10.333 -7.770 10.551 853 HG3 LYS 115 1HG LYS 115 -11.464 -8.826 11.389 854 HD2 LYS 115 2HD LYS 115 -8.738 -7.959 12.448 855 HD3 LYS 115 1HD LYS 115 -10.297 -7.282 12.931 856 HE2 LYS 115 2HE LYS 115 -10.985 -9.522 13.743 857 HE3 LYS 115 1HE LYS 115 -9.385 -10.135 13.346 858 HZ1 LYS 115 3HZ LYS 115 -9.496 -9.618 15.662 859 HZ2 LYS 115 1HZ LYS 115 -10.041 -8.047 15.339 860 HZ3 LYS 115 2HZ LYS 115 -8.472 -8.499 14.915 861 H THR 116 H THR 116 -7.535 -10.046 7.843 862 HA THR 116 HA THR 116 -6.924 -12.851 8.031 863 HB THR 116 HB THR 116 -5.716 -12.079 5.659 864 HG1 THR 116 HG1 THR 116 -6.215 -9.966 5.576 865 HG21 THR 116 3HG2 THR 116 -7.482 -13.799 5.821 866 HG22 THR 116 1HG2 THR 116 -7.797 -12.677 4.493 867 HG23 THR 116 2HG2 THR 116 -8.694 -12.529 6.005 868 H THR 117 H THR 117 -5.205 -9.861 8.462 869 HA THR 117 HA THR 117 -2.514 -10.792 8.367 870 HB THR 117 HB THR 117 -3.842 -8.321 9.560 871 HG1 THR 117 HG1 THR 117 -3.544 -8.550 7.244 872 HG21 THR 117 3HG2 THR 117 -0.849 -8.865 9.535 873 HG22 THR 117 1HG2 THR 117 -1.858 -8.775 10.978 874 HG23 THR 117 2HG2 THR 117 -1.615 -7.341 9.980 875 H GLY 118 H GLY 118 -1.263 -11.676 9.956 876 HA2 GLY 118 2HA GLY 118 -0.577 -12.500 11.985 877 HA3 GLY 118 1HA GLY 118 -1.947 -11.717 12.754 878 H GLN 119 H GLN 119 -3.246 -13.529 10.281 879 HA GLN 119 HA GLN 119 -3.748 -15.868 12.054 880 HB2 GLN 119 2HB GLN 119 -5.754 -14.297 10.362 881 HB3 GLN 119 1HB GLN 119 -6.116 -15.849 11.102 882 HG2 GLN 119 2HG GLN 119 -5.433 -13.284 12.566 883 HG3 GLN 119 1HG GLN 119 -7.029 -14.015 12.431 884 HE21 GLN 119 1HE2 GLN 119 -3.975 -14.118 14.068 885 HE22 GLN 119 2HE2 GLN 119 -4.398 -15.323 15.230 886 H GLN 120 H GLN 120 -4.559 -14.882 8.724 887 HA GLN 120 HA GLN 120 -3.199 -17.268 7.624 888 HB2 GLN 120 2HB GLN 120 -5.124 -17.045 5.790 889 HB3 GLN 120 1HB GLN 120 -5.384 -17.949 7.275 890 HG2 GLN 120 2HG GLN 120 -6.504 -15.917 8.256 891 HG3 GLN 120 1HG GLN 120 -6.340 -15.131 6.684 892 HE21 GLN 120 1HE2 GLN 120 -8.653 -14.938 6.716 893 HE22 GLN 120 2HE2 GLN 120 -9.654 -16.272 6.268 894 H SER 121 H SER 121 -2.401 -14.587 8.125 895 HA SER 121 HA SER 121 -0.803 -14.162 5.787 896 HB2 SER 121 2HB SER 121 -2.740 -12.779 5.110 897 HB3 SER 121 1HB SER 121 -2.751 -11.965 6.672 898 HG SER 121 HG SER 121 -0.947 -10.872 6.128 899 H TYR 122 H TYR 122 0.981 -12.578 6.401 900 HA TYR 122 HA TYR 122 1.883 -13.167 9.050 901 HB2 TYR 122 2HB TYR 122 3.436 -12.940 7.100 902 HB3 TYR 122 1HB TYR 122 3.083 -11.220 7.027 903 HD1 TYR 122 HD2 TYR 122 4.241 -13.749 9.580 904 HD2 TYR 122 HD1 TYR 122 4.720 -9.804 8.009 905 HE1 TYR 122 HE2 TYR 122 6.089 -13.356 11.139 906 HE2 TYR 122 HE1 TYR 122 6.575 -9.417 9.582 907 HH TYR 122 HH TYR 122 8.093 -11.885 11.283 908 H ASP 123 H ASP 123 2.450 -11.670 10.698 909 HA ASP 123 HA ASP 123 0.388 -9.733 11.230 910 HB2 ASP 123 2HB ASP 123 1.480 -9.409 13.414 911 HB3 ASP 123 1HB ASP 123 1.248 -11.114 13.064 912 H GLY 124 H GLY 124 1.344 -7.566 12.374 913 HA2 GLY 124 2HA GLY 124 2.229 -5.466 11.896 914 HA3 GLY 124 1HA GLY 124 3.103 -6.147 10.523 915 H GLY 125 H GLY 125 1.957 -6.545 8.548 916 HA2 GLY 125 2HA GLY 125 -0.780 -6.503 8.131 917 HA3 GLY 125 1HA GLY 125 -0.259 -4.831 7.940 918 H ARG 126 H ARG 126 -1.117 -5.174 5.776 919 HA ARG 126 HA ARG 126 0.892 -6.285 3.890 920 HB2 ARG 126 2HB ARG 126 -2.104 -5.835 3.401 921 HB3 ARG 126 1HB ARG 126 -0.957 -6.471 2.230 922 HG2 ARG 126 2HG ARG 126 -1.710 -7.877 4.812 923 HG3 ARG 126 1HG ARG 126 -2.482 -8.181 3.257 924 HD2 ARG 126 2HD ARG 126 -0.904 -9.920 3.513 925 HD3 ARG 126 1HD ARG 126 -0.145 -8.799 2.381 926 HE ARG 126 HE ARG 126 0.970 -7.952 4.597 927 HH11 ARG 126 1HH1 ARG 126 0.483 -11.296 3.655 928 HH12 ARG 126 2HH1 ARG 126 1.842 -11.868 4.569 929 HH21 ARG 126 1HH2 ARG 126 2.660 -8.719 5.861 930 HH22 ARG 126 2HH2 ARG 126 3.075 -10.404 5.822 931 H TYR 127 H TYR 127 1.799 -4.689 2.526 932 HA TYR 127 HA TYR 127 0.900 -1.944 3.012 933 HB2 TYR 127 2HB TYR 127 2.952 -1.148 2.159 934 HB3 TYR 127 1HB TYR 127 3.389 -2.577 3.077 935 HD1 TYR 127 HD2 TYR 127 3.784 -4.761 1.728 936 HD2 TYR 127 HD1 TYR 127 3.680 -0.915 -0.101 937 HE1 TYR 127 HE2 TYR 127 5.006 -5.640 -0.192 938 HE2 TYR 127 HE1 TYR 127 4.911 -1.797 -2.038 939 HH TYR 127 HH TYR 127 5.423 -5.164 -2.504 940 H MET 128 H MET 128 -0.061 -0.721 1.578 941 HA MET 128 HA MET 128 -0.687 -1.747 -1.134 942 HB2 MET 128 2HB MET 128 -2.599 -1.709 0.603 943 HB3 MET 128 1HB MET 128 -2.433 0.034 0.637 944 HG2 MET 128 2HG MET 128 -3.066 -1.481 -1.891 945 HG3 MET 128 1HG MET 128 -4.304 -0.895 -0.779 946 HE1 MET 128 3HE MET 128 -5.023 1.892 -3.189 947 HE2 MET 128 1HE MET 128 -5.623 0.876 -1.872 948 HE3 MET 128 2HE MET 128 -5.019 0.136 -3.363 949 H GLU 129 H GLU 129 -0.290 -0.228 -2.791 950 HA GLU 129 HA GLU 129 0.676 2.454 -1.964 951 HB2 GLU 129 2HB GLU 129 2.585 0.925 -2.514 952 HB3 GLU 129 1HB GLU 129 1.920 0.697 -4.131 953 HG2 GLU 129 2HG GLU 129 2.177 3.150 -4.549 954 HG3 GLU 129 1HG GLU 129 2.899 3.326 -2.953 955 H LEU 130 H LEU 130 -0.358 4.034 -2.951 956 HA LEU 130 HA LEU 130 -1.486 3.642 -5.646 957 HB2 LEU 130 2HB LEU 130 -3.257 5.484 -4.760 958 HB3 LEU 130 1HB LEU 130 -3.556 3.756 -4.690 959 HG LEU 130 HG LEU 130 -2.867 3.783 -2.265 960 HD11 LEU 130 1HD1 LEU 130 -2.752 5.901 -1.049 961 HD12 LEU 130 2HD1 LEU 130 -2.848 6.794 -2.571 962 HD13 LEU 130 3HD1 LEU 130 -1.452 5.769 -2.234 963 HD21 LEU 130 3HD2 LEU 130 -5.223 3.857 -2.904 964 HD22 LEU 130 1HD2 LEU 130 -5.162 5.620 -3.002 965 HD23 LEU 130 2HD2 LEU 130 -4.940 4.808 -1.448 966 H GLU 131 H GLU 131 -1.479 5.395 -6.959 967 HA GLU 131 HA GLU 131 0.073 7.765 -6.160 968 HB2 GLU 131 2HB GLU 131 0.441 6.215 -8.766 969 HB3 GLU 131 1HB GLU 131 1.198 7.760 -8.380 970 HG2 GLU 131 2HG GLU 131 2.357 6.658 -6.451 971 HG3 GLU 131 1HG GLU 131 1.674 5.118 -6.967 972 HA PRO 132 HA PRO 132 -4.001 9.238 -7.742 973 HB2 PRO 132 2HB PRO 132 -3.577 11.859 -6.850 974 HB3 PRO 132 1HB PRO 132 -4.255 10.563 -5.841 975 HG2 PRO 132 2HG PRO 132 -1.407 11.521 -6.006 976 HG3 PRO 132 1HG PRO 132 -2.392 11.168 -4.563 977 HD2 PRO 132 2HD PRO 132 -0.623 9.377 -5.418 978 HD3 PRO 132 1HD PRO 132 -2.220 8.831 -4.857 979 H ASP 133 H ASP 133 -4.589 10.721 -9.368 980 HA ASP 133 HA ASP 133 -2.752 10.947 -11.536 981 HB2 ASP 133 2HB ASP 133 -5.180 10.526 -11.838 982 HB3 ASP 133 1HB ASP 133 -5.557 12.102 -11.160 983 H ARG 134 H ARG 134 -3.351 12.932 -8.861 984 HA ARG 134 HA ARG 134 -1.904 15.223 -9.806 985 HB2 ARG 134 2HB ARG 134 -3.967 16.761 -9.126 986 HB3 ARG 134 1HB ARG 134 -3.872 16.080 -10.744 987 HG2 ARG 134 2HG ARG 134 -6.129 15.847 -9.991 988 HG3 ARG 134 1HG ARG 134 -5.403 14.243 -10.026 989 HD2 ARG 134 2HD ARG 134 -6.548 14.192 -7.997 990 HD3 ARG 134 1HD ARG 134 -4.962 14.689 -7.458 991 HE ARG 134 HE ARG 134 -5.902 16.594 -6.680 992 HH11 ARG 134 1HH1 ARG 134 -8.062 15.395 -9.202 993 HH12 ARG 134 2HH1 ARG 134 -9.237 16.639 -8.937 994 HH21 ARG 134 1HH2 ARG 134 -7.474 18.166 -6.334 995 HH22 ARG 134 2HH2 ARG 134 -8.904 18.206 -7.312 996 H ASP 135 H ASP 135 -2.269 17.017 -7.944 997 HA ASP 135 HA ASP 135 -1.285 15.797 -5.517 998 HB2 ASP 135 2HB ASP 135 -0.296 17.903 -6.308 999 HB3 ASP 135 1HB ASP 135 -1.857 18.712 -6.230 1000 H LEU 136 H LEU 136 -2.411 15.406 -3.686 1001 HA LEU 136 HA LEU 136 -5.317 15.844 -3.669 1002 HB2 LEU 136 2HB LEU 136 -3.553 14.171 -1.834 1003 HB3 LEU 136 1HB LEU 136 -5.310 14.243 -1.762 1004 HG LEU 136 HG LEU 136 -3.658 13.103 -4.052 1005 HD11 LEU 136 1HD1 LEU 136 -4.582 10.946 -3.389 1006 HD12 LEU 136 2HD1 LEU 136 -5.451 11.700 -2.051 1007 HD13 LEU 136 3HD1 LEU 136 -3.687 11.678 -2.059 1008 HD21 LEU 136 3HD2 LEU 136 -6.683 13.271 -3.789 1009 HD22 LEU 136 1HD2 LEU 136 -5.801 12.404 -5.052 1010 HD23 LEU 136 2HD2 LEU 136 -5.681 14.158 -4.942 1011 H SER 137 H SER 137 -6.345 17.050 -2.191 1012 HA SER 137 HA SER 137 -4.842 18.455 -0.049 1013 HB2 SER 137 2HB SER 137 -7.142 19.545 -1.737 1014 HB3 SER 137 1HB SER 137 -6.319 20.402 -0.431 1015 HG SER 137 HG SER 137 -4.896 19.371 -2.640 1016 H ASP 138 H ASP 138 -6.614 19.387 1.612 1017 HA ASP 138 HA ASP 138 -8.062 17.128 2.654 1018 HB2 ASP 138 2HB ASP 138 -8.705 18.604 4.520 1019 HB3 ASP 138 1HB ASP 138 -6.978 18.707 4.211 1020 H GLY 139 H GLY 139 -9.992 16.533 1.966 1021 HA2 GLY 139 2HA GLY 139 -12.331 16.837 1.571 1022 HA3 GLY 139 1HA GLY 139 -12.018 18.479 1.018 1023 H ASP 140 H ASP 140 -9.627 16.591 -0.249 1024 HA ASP 140 HA ASP 140 -10.772 16.438 -2.920 1025 HB2 ASP 140 2HB ASP 140 -8.281 16.990 -2.101 1026 HB3 ASP 140 1HB ASP 140 -8.084 15.250 -2.136 1027 H GLU 141 H GLU 141 -10.731 14.288 -4.126 1028 HA GLU 141 HA GLU 141 -11.429 12.019 -2.365 1029 HB2 GLU 141 2HB GLU 141 -11.921 12.493 -5.338 1030 HB3 GLU 141 1HB GLU 141 -12.487 11.092 -4.426 1031 HG2 GLU 141 2HG GLU 141 -13.935 12.474 -3.060 1032 HG3 GLU 141 1HG GLU 141 -13.261 13.948 -3.751 1033 H ILE 142 H ILE 142 -10.795 9.844 -2.987 1034 HA ILE 142 HA ILE 142 -8.587 9.340 -4.782 1035 HB ILE 142 HB ILE 142 -7.364 10.146 -2.759 1036 HG12 ILE 142 2HG1 ILE 142 -5.859 8.149 -2.393 1037 HG13 ILE 142 1HG1 ILE 142 -7.027 7.145 -3.243 1038 HG21 ILE 142 1HG2 ILE 142 -7.429 8.890 -0.630 1039 HG22 ILE 142 2HG2 ILE 142 -8.721 7.875 -1.267 1040 HG23 ILE 142 3HG2 ILE 142 -8.996 9.600 -1.026 1041 HD11 ILE 142 3HD1 ILE 142 -6.631 8.422 -5.297 1042 HD12 ILE 142 1HD1 ILE 142 -5.134 7.743 -4.655 1043 HD13 ILE 142 2HD1 ILE 142 -5.487 9.457 -4.436 1044 H THR 143 H THR 143 -8.387 7.066 -5.200 1045 HA THR 143 HA THR 143 -10.725 5.449 -4.388 1046 HB THR 143 HB THR 143 -8.866 5.086 -6.789 1047 HG1 THR 143 HG1 THR 143 -11.197 6.612 -6.376 1048 HG21 THR 143 3HG2 THR 143 -10.028 3.007 -6.158 1049 HG22 THR 143 1HG2 THR 143 -10.690 3.653 -7.663 1050 HG23 THR 143 2HG2 THR 143 -11.574 3.861 -6.149 1051 H LEU 144 H LEU 144 -10.414 3.417 -3.405 1052 HA LEU 144 HA LEU 144 -7.679 2.721 -2.533 1053 HB2 LEU 144 2HB LEU 144 -10.162 3.289 -0.922 1054 HB3 LEU 144 1HB LEU 144 -9.185 1.943 -0.383 1055 HG LEU 144 HG LEU 144 -8.669 3.999 0.863 1056 HD11 LEU 144 1HD1 LEU 144 -6.913 2.313 0.615 1057 HD12 LEU 144 2HD1 LEU 144 -6.224 3.932 0.680 1058 HD13 LEU 144 3HD1 LEU 144 -6.345 3.088 -0.867 1059 HD21 LEU 144 3HD2 LEU 144 -9.153 5.653 -0.903 1060 HD22 LEU 144 1HD2 LEU 144 -7.694 5.166 -1.765 1061 HD23 LEU 144 2HD2 LEU 144 -7.575 5.918 -0.173 1062 H ASP 145 H ASP 145 -7.517 1.044 -3.999 1063 HA ASP 145 HA ASP 145 -9.382 -1.236 -3.746 1064 HB2 ASP 145 2HB ASP 145 -7.600 -1.933 -5.805 1065 HB3 ASP 145 1HB ASP 145 -9.217 -1.281 -6.015 1066 H PHE 146 H PHE 146 -8.745 -2.151 -1.879 1067 HA PHE 146 HA PHE 146 -6.090 -2.528 -0.941 1068 HB2 PHE 146 2HB PHE 146 -8.472 -4.220 -0.086 1069 HB3 PHE 146 1HB PHE 146 -7.068 -3.757 0.877 1070 HD1 PHE 146 HD2 PHE 146 -6.778 -0.957 0.723 1071 HD2 PHE 146 HD1 PHE 146 -10.426 -3.203 0.688 1072 HE1 PHE 146 HE2 PHE 146 -8.001 1.005 1.514 1073 HE2 PHE 146 HE1 PHE 146 -11.642 -1.221 1.488 1074 HZ PHE 146 HZ PHE 146 -10.429 0.876 1.901 1075 H ASN 147 H ASN 147 -7.931 -4.203 -3.210 1076 HA ASN 147 HA ASN 147 -6.820 -6.807 -3.049 1077 HB2 ASN 147 2HB ASN 147 -8.147 -5.425 -5.416 1078 HB3 ASN 147 1HB ASN 147 -7.896 -7.160 -5.227 1079 HD21 ASN 147 1HD2 ASN 147 -9.865 -7.992 -4.994 1080 HD22 ASN 147 2HD2 ASN 147 -11.077 -7.444 -3.891 1081 H LEU 148 H LEU 148 -5.513 -3.853 -4.141 1082 HA LEU 148 HA LEU 148 -3.486 -5.193 -5.813 1083 HB2 LEU 148 2HB LEU 148 -3.879 -2.196 -5.443 1084 HB3 LEU 148 1HB LEU 148 -2.880 -3.000 -6.642 1085 HG LEU 148 HG LEU 148 -5.896 -2.701 -6.586 1086 HD11 LEU 148 1HD1 LEU 148 -5.609 -1.845 -8.855 1087 HD12 LEU 148 2HD1 LEU 148 -3.870 -2.143 -8.772 1088 HD13 LEU 148 3HD1 LEU 148 -4.615 -0.946 -7.709 1089 HD21 LEU 148 3HD2 LEU 148 -5.617 -5.062 -7.023 1090 HD22 LEU 148 1HD2 LEU 148 -4.404 -4.742 -8.262 1091 HD23 LEU 148 2HD2 LEU 148 -6.082 -4.255 -8.516 1092 H ALA 149 H ALA 149 -3.800 -5.072 -2.715 1093 HA ALA 149 HA ALA 149 -1.353 -3.790 -1.838 1094 HB1 ALA 149 3HB ALA 149 -1.822 -4.818 0.350 1095 HB2 ALA 149 1HB ALA 149 -3.129 -5.769 -0.365 1096 HB3 ALA 149 2HB ALA 149 -3.255 -4.010 -0.287 1097 H TYR 150 H TYR 150 0.539 -4.822 -1.241 1098 HA TYR 150 HA TYR 150 1.072 -7.304 -2.788 1099 HB2 TYR 150 2HB TYR 150 3.198 -5.230 -2.192 1100 HB3 TYR 150 1HB TYR 150 3.160 -6.422 -3.482 1101 HD1 TYR 150 HD1 TYR 150 1.718 -6.001 -5.520 1102 HD2 TYR 150 HD2 TYR 150 2.176 -3.050 -2.448 1103 HE1 TYR 150 HE1 TYR 150 0.889 -4.261 -7.048 1104 HE2 TYR 150 HE2 TYR 150 1.349 -1.315 -3.979 1105 HH TYR 150 HH TYR 150 -0.243 -1.934 -6.788 1106 H SER 151 H SER 151 2.827 -8.661 -2.031 1107 HA SER 151 HA SER 151 2.888 -9.202 0.732 1108 HB2 SER 151 2HB SER 151 4.679 -10.855 0.030 1109 HB3 SER 151 1HB SER 151 3.186 -10.972 -0.895 1110 HG SER 151 HG SER 151 5.434 -9.474 -1.770 1111 HA PRO 152 HA PRO 152 5.741 -5.834 1.798 1112 HB2 PRO 152 2HB PRO 152 5.874 -7.186 4.476 1113 HB3 PRO 152 1HB PRO 152 5.374 -5.529 4.070 1114 HG2 PRO 152 2HG PRO 152 3.557 -7.338 4.762 1115 HG3 PRO 152 1HG PRO 152 3.214 -6.187 3.445 1116 HD2 PRO 152 2HD PRO 152 4.107 -9.075 3.238 1117 HD3 PRO 152 1HD PRO 152 2.803 -8.233 2.364 1118 H PHE 153 H PHE 153 7.854 -5.593 1.448 1119 HA PHE 153 HA PHE 153 9.827 -7.320 1.074 1120 HB2 PHE 153 2HB PHE 153 10.363 -4.732 2.581 1121 HB3 PHE 153 1HB PHE 153 11.397 -5.524 1.410 1122 HD1 PHE 153 HD2 PHE 153 10.955 -5.270 -1.012 1123 HD2 PHE 153 HD1 PHE 153 8.527 -3.272 1.883 1124 HE1 PHE 153 HE2 PHE 153 10.084 -3.802 -2.758 1125 HE2 PHE 153 HE1 PHE 153 7.656 -1.790 0.120 1126 HZ PHE 153 HZ PHE 153 8.435 -2.051 -2.204 1127 H CYS 154 H CYS 154 9.197 -5.785 4.260 1128 HA CYS 154 HA CYS 154 11.300 -7.025 5.640 1129 HB2 CYS 154 2HB CYS 154 10.185 -4.957 6.414 1130 HB3 CYS 154 1HB CYS 154 8.745 -5.890 6.824 1131 HG CYS 154 HG CYS 154 11.691 -6.864 8.189 1132 H ALA 155 H ALA 155 7.928 -8.037 5.197 1133 HA ALA 155 HA ALA 155 7.613 -9.944 7.150 1134 HB1 ALA 155 3HB ALA 155 5.827 -9.275 5.583 1135 HB2 ALA 155 1HB ALA 155 5.964 -11.031 5.678 1136 HB3 ALA 155 2HB ALA 155 6.624 -10.166 4.285 1137 H TYR 156 H TYR 156 9.067 -10.415 3.949 1138 HA TYR 156 HA TYR 156 9.825 -13.167 4.494 1139 HB2 TYR 156 2HB TYR 156 10.368 -11.383 2.086 1140 HB3 TYR 156 1HB TYR 156 10.726 -13.102 2.171 1141 HD1 TYR 156 HD1 TYR 156 8.044 -10.599 1.885 1142 HD2 TYR 156 HD2 TYR 156 8.906 -14.786 2.071 1143 HE1 TYR 156 HE1 TYR 156 5.779 -11.103 1.122 1144 HE2 TYR 156 HE2 TYR 156 6.621 -15.285 1.292 1145 HH TYR 156 HH TYR 156 4.334 -14.025 1.383 1146 H SER 157 H SER 157 11.314 -10.069 4.908 1147 HA SER 157 HA SER 157 14.003 -11.304 5.095 1148 HB2 SER 157 2HB SER 157 13.260 -8.571 4.009 1149 HB3 SER 157 1HB SER 157 14.913 -9.104 4.324 1150 HG SER 157 HG SER 157 13.287 -10.724 2.744 1151 H ASP 158 H ASP 158 14.617 -11.373 7.129 1152 HA ASP 158 HA ASP 158 13.400 -9.933 9.251 1153 HB2 ASP 158 2HB ASP 158 14.958 -11.114 10.729 1154 HB3 ASP 158 1HB ASP 158 14.315 -12.222 9.526 1155 H THR 159 H THR 159 16.221 -9.247 7.303 1156 HA THR 159 HA THR 159 17.545 -7.513 9.177 1157 HB THR 159 HB THR 159 18.807 -8.699 7.403 1158 HG1 THR 159 HG1 THR 159 19.035 -5.880 7.005 1159 HG21 THR 159 3HG2 THR 159 17.177 -8.514 5.554 1160 HG22 THR 159 1HG2 THR 159 18.769 -7.916 5.076 1161 HG23 THR 159 2HG2 THR 159 17.478 -6.777 5.467 1162 H PHE 160 H PHE 160 14.702 -7.040 7.455 1163 HA PHE 160 HA PHE 160 15.039 -4.127 7.086 1164 HB2 PHE 160 2HB PHE 160 12.766 -6.028 6.342 1165 HB3 PHE 160 1HB PHE 160 12.654 -4.284 6.180 1166 HD1 PHE 160 HD2 PHE 160 15.161 -6.917 5.150 1167 HD2 PHE 160 HD1 PHE 160 12.770 -3.583 3.968 1168 HE1 PHE 160 HE2 PHE 160 16.006 -7.118 2.847 1169 HE2 PHE 160 HE1 PHE 160 13.615 -3.794 1.674 1170 HZ PHE 160 HZ PHE 160 15.230 -5.562 1.106 1171 H SER 161 H SER 161 13.610 -2.695 8.214 1172 HA SER 161 HA SER 161 12.571 -3.693 10.799 1173 HB2 SER 161 2HB SER 161 14.190 -1.799 10.855 1174 HB3 SER 161 1HB SER 161 13.119 -0.844 9.832 1175 HG SER 161 HG SER 161 12.672 -1.741 12.485 1176 H CYS 162 H CYS 162 10.355 -4.092 10.855 1177 HA CYS 162 HA CYS 162 8.876 -3.864 8.467 1178 HB2 CYS 162 2HB CYS 162 7.006 -4.843 9.869 1179 HB3 CYS 162 1HB CYS 162 8.513 -5.750 9.931 1180 HG CYS 162 HG CYS 162 8.830 -5.686 12.462 1181 HA PRO 163 HA PRO 163 6.920 0.170 8.885 1182 HB2 PRO 163 2HB PRO 163 4.545 -1.068 7.501 1183 HB3 PRO 163 1HB PRO 163 5.520 0.339 7.023 1184 HG2 PRO 163 2HG PRO 163 5.730 -1.974 5.713 1185 HG3 PRO 163 1HG PRO 163 7.162 -0.960 6.014 1186 HD2 PRO 163 2HD PRO 163 6.280 -3.455 7.467 1187 HD3 PRO 163 1HD PRO 163 7.913 -2.962 6.957 1188 H LEU 164 H LEU 164 5.534 1.093 10.404 1189 HA LEU 164 HA LEU 164 4.025 -0.708 12.163 1190 HB2 LEU 164 2HB LEU 164 5.771 0.725 13.202 1191 HB3 LEU 164 1HB LEU 164 4.992 2.157 12.551 1192 HG LEU 164 HG LEU 164 2.986 1.697 13.987 1193 HD11 LEU 164 1HD1 LEU 164 3.131 0.040 15.810 1194 HD12 LEU 164 2HD1 LEU 164 4.644 -0.569 15.135 1195 HD13 LEU 164 3HD1 LEU 164 3.141 -0.715 14.217 1196 HD21 LEU 164 3HD2 LEU 164 5.605 1.923 15.508 1197 HD22 LEU 164 1HD2 LEU 164 4.009 2.363 16.128 1198 HD23 LEU 164 2HD2 LEU 164 4.702 3.250 14.772 1199 HA PRO 165 HA PRO 165 0.552 1.332 9.919 1200 HB2 PRO 165 2HB PRO 165 -1.345 -0.567 10.427 1201 HB3 PRO 165 1HB PRO 165 -0.110 -0.786 9.170 1202 HG2 PRO 165 2HG PRO 165 -0.187 -1.915 11.944 1203 HG3 PRO 165 1HG PRO 165 0.275 -2.704 10.420 1204 HD2 PRO 165 2HD PRO 165 2.112 -1.716 12.217 1205 HD3 PRO 165 1HD PRO 165 2.425 -1.852 10.473 1206 HA PRO 166 HA PRO 166 -0.599 3.353 13.854 1207 HB2 PRO 166 2HB PRO 166 -2.451 5.136 12.746 1208 HB3 PRO 166 1HB PRO 166 -0.698 5.406 12.765 1209 HG2 PRO 166 2HG PRO 166 -2.411 4.337 10.548 1210 HG3 PRO 166 1HG PRO 166 -1.073 5.508 10.470 1211 HD2 PRO 166 2HD PRO 166 -0.709 2.938 9.762 1212 HD3 PRO 166 1HD PRO 166 0.571 3.841 10.606 1213 H GLU 167 H GLU 167 -2.413 3.300 15.284 1214 HA GLU 167 HA GLU 167 -3.968 0.987 15.152 1215 HB2 GLU 167 2HB GLU 167 -4.353 3.461 16.890 1216 HB3 GLU 167 1HB GLU 167 -5.125 1.901 17.178 1217 HG2 GLU 167 2HG GLU 167 -2.950 0.849 17.562 1218 HG3 GLU 167 1HG GLU 167 -2.121 2.356 17.167 1219 H SER 168 H SER 168 -4.675 4.184 14.008 1220 HA SER 168 HA SER 168 -7.499 4.036 13.785 1221 HB2 SER 168 2HB SER 168 -5.581 5.746 12.148 1222 HB3 SER 168 1HB SER 168 -7.286 6.074 12.474 1223 HG SER 168 HG SER 168 -6.783 6.391 14.636 1224 H ASN 169 H ASN 169 -4.981 2.647 11.798 1225 HA ASN 169 HA ASN 169 -6.689 2.537 9.398 1226 HB2 ASN 169 2HB ASN 169 -4.784 2.378 8.075 1227 HB3 ASN 169 1HB ASN 169 -4.197 3.392 9.379 1228 HD21 ASN 169 1HD2 ASN 169 -2.598 1.915 7.602 1229 HD22 ASN 169 2HD2 ASN 169 -1.722 0.746 8.506 1230 H TRP 170 H TRP 170 -6.294 0.731 12.035 1231 HA TRP 170 HA TRP 170 -5.916 -1.916 10.971 1232 HB2 TRP 170 2HB TRP 170 -7.021 -0.962 13.647 1233 HB3 TRP 170 1HB TRP 170 -6.754 -2.653 13.245 1234 HD1 TRP 170 HD1 TRP 170 -3.818 -0.983 11.851 1235 HE1 TRP 170 HE1 TRP 170 -1.845 -1.037 13.502 1236 HE3 TRP 170 HE3 TRP 170 -6.349 -2.291 16.108 1237 HZ2 TRP 170 HZ2 TRP 170 -1.416 -1.569 16.242 1238 HZ3 TRP 170 HZ3 TRP 170 -5.081 -2.555 18.202 1239 HH2 TRP 170 HH2 TRP 170 -2.662 -2.201 18.269 1240 H LEU 171 H LEU 171 -7.403 -2.817 9.665 1241 HA LEU 171 HA LEU 171 -10.188 -1.986 9.612 1242 HB2 LEU 171 2HB LEU 171 -8.869 -4.209 7.987 1243 HB3 LEU 171 1HB LEU 171 -10.354 -3.347 7.615 1244 HG LEU 171 HG LEU 171 -7.538 -2.189 7.486 1245 HD11 LEU 171 1HD1 LEU 171 -7.993 -3.774 5.675 1246 HD12 LEU 171 2HD1 LEU 171 -7.857 -2.127 5.064 1247 HD13 LEU 171 3HD1 LEU 171 -9.449 -2.876 5.231 1248 HD21 LEU 171 3HD2 LEU 171 -9.120 -0.447 8.140 1249 HD22 LEU 171 1HD2 LEU 171 -10.172 -0.853 6.780 1250 HD23 LEU 171 2HD2 LEU 171 -8.562 -0.184 6.490 1251 H GLU 172 H GLU 172 -11.639 -2.995 10.979 1252 HA GLU 172 HA GLU 172 -11.038 -5.581 12.217 1253 HB2 GLU 172 2HB GLU 172 -12.034 -3.519 13.419 1254 HB3 GLU 172 1HB GLU 172 -13.527 -3.835 12.551 1255 HG2 GLU 172 2HG GLU 172 -13.720 -4.733 14.779 1256 HG3 GLU 172 1HG GLU 172 -13.634 -6.081 13.641 1257 H THR 173 H THR 173 -11.120 -5.988 9.675 1258 HA THR 173 HA THR 173 -13.264 -7.818 9.176 1259 HB THR 173 HB THR 173 -14.295 -5.712 8.321 1260 HG1 THR 173 HG1 THR 173 -15.107 -6.873 6.782 1261 HG21 THR 173 3HG2 THR 173 -12.266 -4.427 7.733 1262 HG22 THR 173 1HG2 THR 173 -13.364 -4.536 6.354 1263 HG23 THR 173 2HG2 THR 173 -11.921 -5.552 6.417 1264 H ALA 174 H ALA 174 -12.683 -9.181 7.330 1265 HA ALA 174 HA ALA 174 -9.768 -9.415 6.944 1266 HB1 ALA 174 3HB ALA 174 -10.949 -11.445 7.679 1267 HB2 ALA 174 1HB ALA 174 -10.316 -11.672 6.048 1268 HB3 ALA 174 2HB ALA 174 -12.035 -11.345 6.291 1269 H VAL 175 H VAL 175 -8.849 -8.954 4.956 1270 HA VAL 175 HA VAL 175 -10.631 -8.027 2.799 1271 HB VAL 175 HB VAL 175 -7.588 -7.835 3.029 1272 HG11 VAL 175 1HG1 VAL 175 -8.243 -7.965 0.657 1273 HG12 VAL 175 2HG1 VAL 175 -7.717 -6.326 1.045 1274 HG13 VAL 175 3HG1 VAL 175 -9.438 -6.686 0.893 1275 HG21 VAL 175 3HG2 VAL 175 -8.009 -5.403 3.377 1276 HG22 VAL 175 1HG2 VAL 175 -8.756 -6.389 4.639 1277 HG23 VAL 175 2HG2 VAL 175 -9.749 -5.709 3.348 1278 H THR 176 H THR 176 -11.492 -10.030 2.313 1279 HA THR 176 HA THR 176 -9.892 -12.229 1.379 1280 HB THR 176 HB THR 176 -12.192 -13.231 0.905 1281 HG1 THR 176 HG1 THR 176 -13.447 -11.404 0.596 1282 HG21 THR 176 3HG2 THR 176 -11.072 -13.631 3.072 1283 HG22 THR 176 1HG2 THR 176 -12.822 -13.497 3.278 1284 HG23 THR 176 2HG2 THR 176 -11.775 -12.144 3.717 1285 H ALA 177 H ALA 177 -8.783 -11.362 -0.386 1286 HA ALA 177 HA ALA 177 -10.399 -10.966 -2.852 1287 HB1 ALA 177 3HB ALA 177 -8.610 -9.423 -3.623 1288 HB2 ALA 177 1HB ALA 177 -7.810 -9.587 -2.057 1289 HB3 ALA 177 2HB ALA 177 -9.404 -8.838 -2.160 1290 H GLY 178 H GLY 178 -10.118 -12.661 -4.101 1291 HA2 GLY 178 2HA GLY 178 -9.421 -14.680 -4.911 1292 HA3 GLY 178 1HA GLY 178 -7.867 -13.886 -5.063 1293 H GLU 179 H GLU 179 -7.181 -16.163 -4.792 1294 HA GLU 179 HA GLU 179 -6.674 -16.766 -1.930 1295 HB2 GLU 179 2HB GLU 179 -7.973 -18.570 -3.024 1296 HB3 GLU 179 1HB GLU 179 -6.766 -18.692 -4.299 1297 HG2 GLU 179 2HG GLU 179 -5.076 -19.347 -2.543 1298 HG3 GLU 179 1HG GLU 179 -6.380 -19.361 -1.359 1299 H ARG 180 H ARG 180 -4.687 -16.014 -1.477 1300 HA ARG 180 HA ARG 180 -2.453 -16.769 -3.254 1301 HB2 ARG 180 2HB ARG 180 -2.991 -14.258 -3.357 1302 HB3 ARG 180 1HB ARG 180 -2.528 -14.160 -1.661 1303 HG2 ARG 180 2HG ARG 180 -0.693 -13.460 -3.186 1304 HG3 ARG 180 1HG ARG 180 -0.238 -14.864 -2.208 1305 HD2 ARG 180 2HD ARG 180 -0.732 -16.356 -4.107 1306 HD3 ARG 180 1HD ARG 180 -1.234 -14.970 -5.080 1307 HE ARG 180 HE ARG 180 1.461 -14.748 -4.117 1308 HH11 ARG 180 1HH1 ARG 180 -0.532 -16.224 -6.600 1309 HH12 ARG 180 2HH1 ARG 180 0.768 -16.347 -7.743 1310 HH21 ARG 180 1HH2 ARG 180 3.154 -14.863 -5.665 1311 HH22 ARG 180 2HH2 ARG 180 2.841 -15.577 -7.216 1312 H THR 181 H THR 181 -0.534 -17.370 -2.138 1313 HA THR 181 HA THR 181 -1.064 -18.257 0.639 1314 HB THR 181 HB THR 181 0.688 -20.045 0.114 1315 HG1 THR 181 HG1 THR 181 1.711 -19.314 -1.686 1316 HG21 THR 181 3HG2 THR 181 -1.819 -20.105 -1.614 1317 HG22 THR 181 1HG2 THR 181 -1.733 -20.579 0.085 1318 HG23 THR 181 2HG2 THR 181 -0.855 -21.504 -1.133 1319 H ASP 182 H ASP 182 -0.202 -16.595 1.803 1320 HA ASP 182 HA ASP 182 2.515 -15.661 1.490 1321 HB2 ASP 182 2HB ASP 182 0.653 -14.254 2.410 1322 HB3 ASP 182 1HB ASP 182 0.527 -15.346 3.781 1323 H LEU 183 H LEU 183 3.610 -17.662 1.468 1324 HA LEU 183 HA LEU 183 2.842 -19.797 3.166 1325 HB2 LEU 183 2HB LEU 183 4.460 -21.178 2.044 1326 HB3 LEU 183 1HB LEU 183 3.572 -20.230 0.872 1327 HG LEU 183 HG LEU 183 6.390 -19.478 1.760 1328 HD11 LEU 183 1HD1 LEU 183 5.648 -21.211 -0.616 1329 HD12 LEU 183 2HD1 LEU 183 6.483 -21.744 0.846 1330 HD13 LEU 183 3HD1 LEU 183 7.260 -20.592 -0.237 1331 HD21 LEU 183 3HD2 LEU 183 5.182 -17.660 0.667 1332 HD22 LEU 183 1HD2 LEU 183 4.791 -18.702 -0.705 1333 HD23 LEU 183 2HD2 LEU 183 6.469 -18.245 -0.382 1334 H GLU 184 H GLU 184 5.979 -17.975 3.043 1335 HA GLU 184 HA GLU 184 6.517 -18.833 5.810 1336 HB2 GLU 184 2HB GLU 184 8.494 -19.283 3.528 1337 HB3 GLU 184 1HB GLU 184 8.877 -19.450 5.243 1338 HG2 GLU 184 2HG GLU 184 7.001 -21.213 5.330 1339 HG3 GLU 184 1HG GLU 184 7.033 -21.176 3.570 1340 H HIS 185 H HIS 185 7.681 -17.447 7.001 1341 HA HIS 185 HA HIS 185 8.992 -15.092 6.152 1342 HB2 HIS 185 2HB HIS 185 7.039 -13.546 7.130 1343 HB3 HIS 185 1HB HIS 185 7.006 -14.068 5.448 1344 HD1 HIS 185 HD1 HIS 185 5.544 -15.245 8.788 1345 HD2 HIS 185 HD2 HIS 185 4.684 -15.215 4.737 1346 HE1 HIS 185 HE1 HIS 185 3.254 -16.248 8.574 1347 HE2 HIS 185 HE2 HIS 185 2.676 -15.958 6.144 Start of MODEL 3 1 H1 MET 1 1H MET 1 -19.999 2.507 -18.364 2 H2 MET 1 2H MET 1 -19.851 3.139 -19.929 3 H3 MET 1 3H MET 1 -20.657 4.017 -18.740 4 HA MET 1 HA MET 1 -18.434 4.883 -19.212 5 HB2 MET 1 2HB MET 1 -17.753 5.092 -16.850 6 HB3 MET 1 1HB MET 1 -19.493 5.265 -17.013 7 HG2 MET 1 2HG MET 1 -18.071 2.767 -16.070 8 HG3 MET 1 1HG MET 1 -18.818 3.972 -15.023 9 HE1 MET 1 3HE MET 1 -20.272 2.084 -13.784 10 HE2 MET 1 1HE MET 1 -19.493 0.861 -14.790 11 HE3 MET 1 2HE MET 1 -21.249 0.898 -14.649 12 H ASP 2 H ASP 2 -18.216 2.419 -20.460 13 HA ASP 2 HA ASP 2 -16.443 0.510 -19.388 14 HB2 ASP 2 2HB ASP 2 -16.924 1.271 -22.301 15 HB3 ASP 2 1HB ASP 2 -16.089 -0.188 -21.776 16 H GLU 3 H GLU 3 -15.897 3.313 -21.344 17 HA GLU 3 HA GLU 3 -13.243 3.491 -21.825 18 HB2 GLU 3 2HB GLU 3 -14.722 5.887 -20.672 19 HB3 GLU 3 1HB GLU 3 -13.387 5.892 -21.816 20 HG2 GLU 3 2HG GLU 3 -15.184 6.416 -23.184 21 HG3 GLU 3 1HG GLU 3 -15.070 4.676 -23.417 22 H ASP 4 H ASP 4 -14.816 4.453 -18.778 23 HA ASP 4 HA ASP 4 -12.401 5.077 -17.360 24 HB2 ASP 4 2HB ASP 4 -14.583 6.143 -16.822 25 HB3 ASP 4 1HB ASP 4 -15.222 4.585 -16.307 26 H THR 5 H THR 5 -14.512 2.233 -17.585 27 HA THR 5 HA THR 5 -13.697 0.813 -15.308 28 HB THR 5 HB THR 5 -14.721 -0.288 -17.965 29 HG1 THR 5 HG1 THR 5 -15.935 1.339 -16.318 30 HG21 THR 5 3HG2 THR 5 -13.819 -2.080 -16.506 31 HG22 THR 5 1HG2 THR 5 -15.573 -2.196 -16.661 32 HG23 THR 5 2HG2 THR 5 -14.863 -1.530 -15.191 33 H GLU 6 H GLU 6 -12.618 0.574 -18.700 34 HA GLU 6 HA GLU 6 -10.514 -1.321 -18.164 35 HB2 GLU 6 2HB GLU 6 -9.974 -1.082 -20.536 36 HB3 GLU 6 1HB GLU 6 -11.703 -1.278 -20.316 37 HG2 GLU 6 2HG GLU 6 -11.950 1.228 -20.557 38 HG3 GLU 6 1HG GLU 6 -10.233 1.291 -20.946 39 H ASP 7 H ASP 7 -10.779 2.163 -18.258 40 HA ASP 7 HA ASP 7 -8.123 2.926 -18.770 41 HB2 ASP 7 2HB ASP 7 -10.113 4.467 -18.742 42 HB3 ASP 7 1HB ASP 7 -10.123 4.356 -16.991 43 H TRP 8 H TRP 8 -9.777 2.373 -15.674 44 HA TRP 8 HA TRP 8 -7.792 2.419 -13.808 45 HB2 TRP 8 2HB TRP 8 -10.045 1.773 -13.181 46 HB3 TRP 8 1HB TRP 8 -9.974 0.328 -14.180 47 HD1 TRP 8 HD1 TRP 8 -7.721 1.571 -11.198 48 HE1 TRP 8 HE1 TRP 8 -7.466 -0.375 -9.554 49 HE3 TRP 8 HE3 TRP 8 -10.542 -1.957 -13.626 50 HZ2 TRP 8 HZ2 TRP 8 -8.345 -3.033 -9.277 51 HZ3 TRP 8 HZ3 TRP 8 -10.781 -4.178 -12.593 52 HH2 TRP 8 HH2 TRP 8 -9.706 -4.708 -10.465 53 H GLU 9 H GLU 9 -8.480 -0.418 -15.912 54 HA GLU 9 HA GLU 9 -6.193 -1.864 -14.958 55 HB2 GLU 9 2HB GLU 9 -8.558 -2.621 -16.205 56 HB3 GLU 9 1HB GLU 9 -7.388 -2.860 -17.492 57 HG2 GLU 9 2HG GLU 9 -7.330 -4.125 -14.727 58 HG3 GLU 9 1HG GLU 9 -7.741 -4.925 -16.243 59 H THR 10 H THR 10 -6.635 0.453 -17.493 60 HA THR 10 HA THR 10 -4.566 -0.383 -19.271 61 HB THR 10 HB THR 10 -5.881 2.360 -18.966 62 HG1 THR 10 HG1 THR 10 -6.901 0.106 -19.828 63 HG21 THR 10 3HG2 THR 10 -5.097 2.806 -21.274 64 HG22 THR 10 1HG2 THR 10 -4.238 1.262 -21.293 65 HG23 THR 10 2HG2 THR 10 -3.726 2.544 -20.196 66 H GLN 11 H GLN 11 -4.716 2.243 -16.795 67 HA GLN 11 HA GLN 11 -1.879 2.655 -16.759 68 HB2 GLN 11 2HB GLN 11 -2.291 3.935 -14.652 69 HB3 GLN 11 1HB GLN 11 -3.326 4.436 -15.981 70 HG2 GLN 11 2HG GLN 11 -5.239 3.306 -15.027 71 HG3 GLN 11 1HG GLN 11 -4.236 2.537 -13.801 72 HE21 GLN 11 1HE2 GLN 11 -5.615 3.398 -12.183 73 HE22 GLN 11 2HE2 GLN 11 -5.504 5.054 -11.702 74 H LEU 12 H LEU 12 -4.010 0.392 -15.129 75 HA LEU 12 HA LEU 12 -2.372 -0.183 -12.883 76 HB2 LEU 12 2HB LEU 12 -4.760 -0.600 -12.840 77 HB3 LEU 12 1HB LEU 12 -4.618 -1.756 -14.149 78 HG LEU 12 HG LEU 12 -3.460 -3.337 -12.719 79 HD11 LEU 12 1HD1 LEU 12 -3.087 -2.939 -10.327 80 HD12 LEU 12 2HD1 LEU 12 -3.624 -1.269 -10.514 81 HD13 LEU 12 3HD1 LEU 12 -2.159 -1.824 -11.328 82 HD21 LEU 12 3HD2 LEU 12 -5.901 -3.428 -12.722 83 HD22 LEU 12 1HD2 LEU 12 -5.978 -2.268 -11.390 84 HD23 LEU 12 2HD2 LEU 12 -5.278 -3.868 -11.136 85 H GLN 13 H GLN 13 -2.689 -1.783 -16.053 86 HA GLN 13 HA GLN 13 -1.015 -4.015 -15.508 87 HB2 GLN 13 2HB GLN 13 -0.872 -4.269 -17.996 88 HB3 GLN 13 1HB GLN 13 -2.511 -4.099 -17.393 89 HG2 GLN 13 2HG GLN 13 -2.548 -2.781 -19.295 90 HG3 GLN 13 1HG GLN 13 -2.279 -1.597 -18.031 91 HE21 GLN 13 1HE2 GLN 13 -0.878 -3.244 -20.772 92 HE22 GLN 13 2HE2 GLN 13 0.485 -2.204 -20.966 93 H ALA 14 H ALA 14 -0.218 -0.725 -15.902 94 HA ALA 14 HA ALA 14 2.635 -1.215 -16.339 95 HB1 ALA 14 3HB ALA 14 2.802 1.247 -16.401 96 HB2 ALA 14 1HB ALA 14 1.096 1.382 -15.966 97 HB3 ALA 14 2HB ALA 14 1.558 0.670 -17.513 98 H ASN 15 H ASN 15 0.374 -0.070 -13.831 99 HA ASN 15 HA ASN 15 2.217 0.649 -11.824 100 HB2 ASN 15 2HB ASN 15 -0.661 -0.307 -11.522 101 HB3 ASN 15 1HB ASN 15 0.281 0.426 -10.227 102 HD21 ASN 15 1HD2 ASN 15 -2.229 1.330 -11.417 103 HD22 ASN 15 2HD2 ASN 15 -1.935 2.919 -12.021 104 H ARG 16 H ARG 16 0.139 -2.286 -11.780 105 HA ARG 16 HA ARG 16 1.551 -3.594 -9.711 106 HB2 ARG 16 2HB ARG 16 0.245 -5.624 -10.345 107 HB3 ARG 16 1HB ARG 16 -0.764 -4.188 -10.221 108 HG2 ARG 16 2HG ARG 16 -0.631 -3.978 -12.734 109 HG3 ARG 16 1HG ARG 16 0.186 -5.535 -12.768 110 HD2 ARG 16 2HD ARG 16 -1.781 -6.641 -11.854 111 HD3 ARG 16 1HD ARG 16 -2.578 -5.090 -11.590 112 HE ARG 16 HE ARG 16 -2.901 -4.847 -13.923 113 HH11 ARG 16 1HH1 ARG 16 -1.544 -7.975 -13.106 114 HH12 ARG 16 2HH1 ARG 16 -1.995 -8.698 -14.614 115 HH21 ARG 16 1HH2 ARG 16 -3.500 -5.796 -15.888 116 HH22 ARG 16 2HH2 ARG 16 -3.107 -7.459 -16.199 117 H ASP 17 H ASP 17 2.235 -3.344 -13.075 118 HA ASP 17 HA ASP 17 3.854 -5.654 -13.460 119 HB2 ASP 17 2HB ASP 17 2.862 -4.470 -15.349 120 HB3 ASP 17 1HB ASP 17 3.732 -2.996 -14.935 121 H GLU 18 H GLU 18 4.748 -2.195 -13.025 122 HA GLU 18 HA GLU 18 7.532 -2.614 -12.813 123 HB2 GLU 18 2HB GLU 18 7.681 -0.313 -11.917 124 HB3 GLU 18 1HB GLU 18 6.642 -0.397 -13.334 125 HG2 GLU 18 2HG GLU 18 4.654 -0.179 -12.011 126 HG3 GLU 18 1HG GLU 18 5.545 -0.418 -10.512 127 H LYS 19 H LYS 19 4.995 -2.723 -10.403 128 HA LYS 19 HA LYS 19 6.747 -2.705 -8.106 129 HB2 LYS 19 2HB LYS 19 3.813 -3.492 -8.268 130 HB3 LYS 19 1HB LYS 19 4.705 -3.098 -6.804 131 HG2 LYS 19 2HG LYS 19 4.082 -1.175 -9.067 132 HG3 LYS 19 1HG LYS 19 3.215 -1.266 -7.538 133 HD2 LYS 19 2HD LYS 19 6.144 -0.520 -7.863 134 HD3 LYS 19 1HD LYS 19 4.821 0.619 -7.628 135 HE2 LYS 19 2HE LYS 19 4.360 -0.405 -5.411 136 HE3 LYS 19 1HE LYS 19 5.725 -1.500 -5.649 137 HZ1 LYS 19 3HZ LYS 19 7.145 0.516 -5.859 138 HZ2 LYS 19 1HZ LYS 19 6.457 0.314 -4.327 139 HZ3 LYS 19 2HZ LYS 19 5.817 1.450 -5.400 140 H ASP 20 H ASP 20 5.350 -5.161 -10.183 141 HA ASP 20 HA ASP 20 5.997 -7.385 -8.437 142 HB2 ASP 20 2HB ASP 20 4.063 -7.450 -10.018 143 HB3 ASP 20 1HB ASP 20 5.188 -7.429 -11.373 144 H ARG 21 H ARG 21 7.380 -5.923 -11.343 145 HA ARG 21 HA ARG 21 9.576 -7.807 -11.573 146 HB2 ARG 21 2HB ARG 21 10.380 -6.513 -13.418 147 HB3 ARG 21 1HB ARG 21 8.628 -6.535 -13.561 148 HG2 ARG 21 2HG ARG 21 8.489 -4.251 -12.708 149 HG3 ARG 21 1HG ARG 21 10.229 -4.220 -12.418 150 HD2 ARG 21 2HD ARG 21 9.671 -3.014 -14.477 151 HD3 ARG 21 1HD ARG 21 10.649 -4.440 -14.838 152 HE ARG 21 HE ARG 21 7.710 -4.454 -15.117 153 HH11 ARG 21 1HH1 ARG 21 10.865 -5.033 -16.552 154 HH12 ARG 21 2HH1 ARG 21 10.199 -5.706 -18.007 155 HH21 ARG 21 1HH2 ARG 21 6.868 -5.317 -17.035 156 HH22 ARG 21 2HH2 ARG 21 7.945 -5.869 -18.281 157 H PHE 22 H PHE 22 8.912 -5.115 -9.663 158 HA PHE 22 HA PHE 22 11.299 -3.875 -9.111 159 HB2 PHE 22 2HB PHE 22 8.932 -3.380 -8.223 160 HB3 PHE 22 1HB PHE 22 9.218 -4.612 -7.004 161 HD1 PHE 22 HD2 PHE 22 10.903 -4.223 -5.209 162 HD2 PHE 22 HD1 PHE 22 9.975 -1.211 -8.091 163 HE1 PHE 22 HE2 PHE 22 11.973 -2.529 -3.798 164 HE2 PHE 22 HE1 PHE 22 11.047 0.477 -6.678 165 HZ PHE 22 HZ PHE 22 12.053 -0.177 -4.531 166 H PHE 23 H PHE 23 9.970 -6.815 -7.646 167 HA PHE 23 HA PHE 23 12.213 -7.329 -5.910 168 HB2 PHE 23 2HB PHE 23 9.775 -8.957 -6.721 169 HB3 PHE 23 1HB PHE 23 11.002 -9.584 -5.627 170 HD1 PHE 23 HD2 PHE 23 8.960 -6.398 -5.948 171 HD2 PHE 23 HD1 PHE 23 10.440 -9.475 -3.372 172 HE1 PHE 23 HE2 PHE 23 7.786 -5.381 -4.042 173 HE2 PHE 23 HE1 PHE 23 9.266 -8.450 -1.476 174 HZ PHE 23 HZ PHE 23 7.955 -6.403 -1.799 175 H SER 24 H SER 24 11.477 -8.092 -9.206 176 HA SER 24 HA SER 24 13.251 -10.399 -9.356 177 HB2 SER 24 2HB SER 24 11.079 -10.433 -10.542 178 HB3 SER 24 1HB SER 24 11.569 -9.043 -11.509 179 HG SER 24 HG SER 24 12.514 -10.387 -12.800 180 H GLU 25 H GLU 25 13.321 -6.966 -10.237 181 HA GLU 25 HA GLU 25 15.828 -7.349 -11.765 182 HB2 GLU 25 2HB GLU 25 13.613 -5.354 -12.410 183 HB3 GLU 25 1HB GLU 25 15.118 -5.554 -13.301 184 HG2 GLU 25 2HG GLU 25 14.341 -7.930 -13.836 185 HG3 GLU 25 1HG GLU 25 12.776 -7.477 -13.152 186 H HIS 26 H HIS 26 13.870 -4.894 -10.029 187 HA HIS 26 HA HIS 26 15.950 -2.904 -10.071 188 HB2 HIS 26 2HB HIS 26 13.595 -2.225 -10.120 189 HB3 HIS 26 1HB HIS 26 13.297 -3.002 -8.569 190 HD2 HIS 26 HD2 HIS 26 14.916 0.257 -9.994 191 HE1 HIS 26 HE1 HIS 26 14.816 0.495 -5.771 192 HE2 HIS 26 HE2 HIS 26 15.556 1.651 -7.896 193 H ARG 27 H ARG 27 14.681 -5.118 -7.699 194 HA ARG 27 HA ARG 27 16.848 -4.553 -5.788 195 HB2 ARG 27 2HB ARG 27 13.852 -4.516 -5.309 196 HB3 ARG 27 1HB ARG 27 14.888 -5.104 -4.016 197 HG2 ARG 27 2HG ARG 27 15.149 -2.361 -5.293 198 HG3 ARG 27 1HG ARG 27 14.245 -2.695 -3.812 199 HD2 ARG 27 2HD ARG 27 17.234 -3.095 -4.227 200 HD3 ARG 27 1HD ARG 27 16.464 -1.838 -3.248 201 HE ARG 27 HE ARG 27 15.601 -4.370 -2.366 202 HH11 ARG 27 1HH1 ARG 27 18.494 -2.356 -2.205 203 HH12 ARG 27 2HH1 ARG 27 19.036 -3.097 -0.733 204 HH21 ARG 27 1HH2 ARG 27 16.369 -5.311 -0.509 205 HH22 ARG 27 2HH2 ARG 27 17.839 -4.758 0.222 206 H GLN 28 H GLN 28 17.669 -6.363 -4.817 207 HA GLN 28 HA GLN 28 16.948 -8.983 -5.699 208 HB2 GLN 28 2HB GLN 28 18.535 -9.741 -3.851 209 HB3 GLN 28 1HB GLN 28 19.222 -8.706 -5.084 210 HG2 GLN 28 2HG GLN 28 20.186 -7.858 -3.155 211 HG3 GLN 28 1HG GLN 28 18.821 -6.770 -3.386 212 HE21 GLN 28 1HE2 GLN 28 18.781 -6.186 -1.200 213 HE22 GLN 28 2HE2 GLN 28 18.275 -7.265 0.050 214 H SER 29 H SER 29 15.231 -10.087 -5.102 215 HA SER 29 HA SER 29 13.293 -9.125 -3.375 216 HB2 SER 29 2HB SER 29 12.235 -11.433 -3.733 217 HB3 SER 29 1HB SER 29 12.605 -10.502 -5.180 218 HG SER 29 HG SER 29 13.638 -12.211 -5.764 219 HA PRO 30 HA PRO 30 14.696 -10.339 0.712 220 HB2 PRO 30 2HB PRO 30 12.333 -9.996 2.074 221 HB3 PRO 30 1HB PRO 30 13.268 -8.625 1.443 222 HG2 PRO 30 2HG PRO 30 10.922 -10.014 0.178 223 HG3 PRO 30 1HG PRO 30 11.184 -8.273 0.449 224 HD2 PRO 30 2HD PRO 30 11.697 -9.332 -1.933 225 HD3 PRO 30 1HD PRO 30 12.784 -8.101 -1.251 226 H ILE 31 H ILE 31 12.443 -12.128 -1.104 227 HA ILE 31 HA ILE 31 11.338 -13.993 0.559 228 HB ILE 31 HB ILE 31 12.352 -14.997 -2.124 229 HG12 ILE 31 2HG1 ILE 31 11.689 -12.691 -2.658 230 HG13 ILE 31 1HG1 ILE 31 10.573 -13.837 -3.378 231 HG21 ILE 31 1HG2 ILE 31 9.672 -15.279 -0.721 232 HG22 ILE 31 2HG2 ILE 31 10.964 -16.478 -0.762 233 HG23 ILE 31 3HG2 ILE 31 10.123 -16.047 -2.249 234 HD11 ILE 31 3HD1 ILE 31 8.950 -13.311 -1.588 235 HD12 ILE 31 1HD1 ILE 31 9.403 -11.909 -2.555 236 HD13 ILE 31 2HD1 ILE 31 10.085 -12.122 -0.945 237 HA PRO 32 HA PRO 32 15.161 -15.860 2.326 238 HB2 PRO 32 2HB PRO 32 13.132 -17.911 3.243 239 HB3 PRO 32 1HB PRO 32 14.388 -17.071 4.182 240 HG2 PRO 32 2HG PRO 32 11.853 -16.349 4.411 241 HG3 PRO 32 1HG PRO 32 13.142 -15.122 4.377 242 HD2 PRO 32 2HD PRO 32 11.208 -15.889 2.212 243 HD3 PRO 32 1HD PRO 32 11.860 -14.292 2.635 244 HA PRO 33 HA PRO 33 16.530 -18.930 -0.608 245 HB2 PRO 33 2HB PRO 33 17.910 -20.726 1.089 246 HB3 PRO 33 1HB PRO 33 18.573 -19.232 0.400 247 HG2 PRO 33 2HG PRO 33 17.390 -19.693 3.114 248 HG3 PRO 33 1HG PRO 33 18.822 -18.742 2.647 249 HD2 PRO 33 2HD PRO 33 16.522 -17.516 3.218 250 HD3 PRO 33 1HD PRO 33 17.534 -16.938 1.874 251 H GLU 34 H GLU 34 15.300 -20.535 2.382 252 HA GLU 34 HA GLU 34 14.508 -22.964 1.103 253 HB2 GLU 34 2HB GLU 34 13.427 -21.782 3.700 254 HB3 GLU 34 1HB GLU 34 13.264 -23.458 3.186 255 HG2 GLU 34 2HG GLU 34 15.865 -22.057 3.887 256 HG3 GLU 34 1HG GLU 34 14.987 -23.181 4.917 257 H GLU 35 H GLU 35 12.816 -19.963 1.909 258 HA GLU 35 HA GLU 35 10.187 -20.655 1.344 259 HB2 GLU 35 2HB GLU 35 11.089 -18.533 2.463 260 HB3 GLU 35 1HB GLU 35 11.443 -17.921 0.857 261 HG2 GLU 35 2HG GLU 35 9.412 -16.906 1.365 262 HG3 GLU 35 1HG GLU 35 8.914 -18.274 0.374 263 H ARG 36 H ARG 36 12.463 -18.884 -0.856 264 HA ARG 36 HA ARG 36 10.688 -18.914 -3.079 265 HB2 ARG 36 2HB ARG 36 12.567 -17.901 -4.294 266 HB3 ARG 36 1HB ARG 36 12.380 -17.157 -2.710 267 HG2 ARG 36 2HG ARG 36 14.234 -18.777 -1.916 268 HG3 ARG 36 1HG ARG 36 14.528 -19.077 -3.630 269 HD2 ARG 36 2HD ARG 36 14.727 -16.409 -2.198 270 HD3 ARG 36 1HD ARG 36 16.069 -17.385 -2.791 271 HE ARG 36 HE ARG 36 14.932 -16.986 -5.081 272 HH11 ARG 36 1HH1 ARG 36 15.072 -14.614 -2.472 273 HH12 ARG 36 2HH1 ARG 36 15.031 -13.251 -3.546 274 HH21 ARG 36 1HH2 ARG 36 14.895 -15.193 -6.478 275 HH22 ARG 36 2HH2 ARG 36 14.932 -13.583 -5.827 276 H ASP 37 H ASP 37 12.873 -21.287 -1.856 277 HA ASP 37 HA ASP 37 13.748 -22.567 -4.215 278 HB2 ASP 37 2HB ASP 37 14.856 -23.035 -2.108 279 HB3 ASP 37 1HB ASP 37 13.363 -23.591 -1.367 280 H ASP 38 H ASP 38 11.090 -23.425 -1.985 281 HA ASP 38 HA ASP 38 9.924 -25.253 -3.962 282 HB2 ASP 38 2HB ASP 38 10.173 -26.036 -1.644 283 HB3 ASP 38 1HB ASP 38 9.206 -24.690 -1.053 284 H PHE 39 H PHE 39 9.180 -22.187 -2.377 285 HA PHE 39 HA PHE 39 6.479 -22.098 -3.494 286 HB2 PHE 39 2HB PHE 39 7.899 -20.148 -1.627 287 HB3 PHE 39 1HB PHE 39 6.240 -19.961 -2.196 288 HD1 PHE 39 HD2 PHE 39 4.454 -21.505 -1.417 289 HD2 PHE 39 HD1 PHE 39 8.443 -21.839 0.084 290 HE1 PHE 39 HE2 PHE 39 3.650 -22.939 0.407 291 HE2 PHE 39 HE1 PHE 39 7.629 -23.281 1.896 292 HZ PHE 39 HZ PHE 39 5.236 -23.830 2.066 293 H ASP 40 H ASP 40 5.765 -20.117 -4.498 294 HA ASP 40 HA ASP 40 7.368 -19.677 -6.878 295 HB2 ASP 40 2HB ASP 40 4.482 -18.873 -6.246 296 HB3 ASP 40 1HB ASP 40 5.257 -18.764 -7.826 297 H GLY 41 H GLY 41 7.249 -17.408 -7.814 298 HA2 GLY 41 2HA GLY 41 8.301 -15.338 -6.307 299 HA3 GLY 41 1HA GLY 41 7.429 -15.139 -7.815 300 H LEU 42 H LEU 42 6.382 -13.208 -7.232 301 HA LEU 42 HA LEU 42 5.515 -12.690 -4.558 302 HB2 LEU 42 2HB LEU 42 4.987 -11.182 -7.133 303 HB3 LEU 42 1HB LEU 42 4.550 -10.596 -5.533 304 HG LEU 42 HG LEU 42 7.376 -11.127 -6.519 305 HD11 LEU 42 1HD1 LEU 42 5.979 -8.506 -5.907 306 HD12 LEU 42 2HD1 LEU 42 6.380 -9.125 -7.511 307 HD13 LEU 42 3HD1 LEU 42 7.667 -8.701 -6.388 308 HD21 LEU 42 3HD2 LEU 42 8.131 -10.195 -4.378 309 HD22 LEU 42 1HD2 LEU 42 7.182 -11.655 -4.125 310 HD23 LEU 42 2HD2 LEU 42 6.465 -10.069 -3.817 311 H SER 43 H SER 43 3.960 -14.077 -3.847 312 HA SER 43 HA SER 43 1.367 -14.232 -5.187 313 HB2 SER 43 2HB SER 43 2.340 -16.248 -4.030 314 HB3 SER 43 1HB SER 43 2.242 -15.394 -2.491 315 HG SER 43 HG SER 43 0.444 -16.807 -2.921 316 H TYR 44 H TYR 44 -0.009 -12.649 -4.900 317 HA TYR 44 HA TYR 44 -0.561 -11.469 -2.306 318 HB2 TYR 44 2HB TYR 44 -0.397 -9.096 -3.207 319 HB3 TYR 44 1HB TYR 44 1.142 -9.903 -2.979 320 HD1 TYR 44 HD1 TYR 44 -1.358 -9.093 -5.684 321 HD2 TYR 44 HD2 TYR 44 2.740 -9.836 -4.745 322 HE1 TYR 44 HE1 TYR 44 -0.731 -8.455 -7.963 323 HE2 TYR 44 HE2 TYR 44 3.370 -9.198 -7.034 324 HH TYR 44 HH TYR 44 2.448 -8.982 -9.214 325 H PHE 45 H PHE 45 -2.269 -9.448 -3.121 326 HA PHE 45 HA PHE 45 -4.594 -11.011 -3.772 327 HB2 PHE 45 2HB PHE 45 -4.386 -7.985 -3.419 328 HB3 PHE 45 1HB PHE 45 -5.858 -8.948 -3.365 329 HD1 PHE 45 HD1 PHE 45 -2.732 -8.112 -1.547 330 HD2 PHE 45 HD2 PHE 45 -6.503 -10.104 -1.314 331 HE1 PHE 45 HE1 PHE 45 -2.474 -8.326 0.884 332 HE2 PHE 45 HE2 PHE 45 -6.238 -10.315 1.112 333 HZ PHE 45 HZ PHE 45 -4.224 -9.431 2.221 334 H ASP 46 H ASP 46 -5.818 -10.946 -5.646 335 HA ASP 46 HA ASP 46 -4.605 -9.764 -8.046 336 HB2 ASP 46 2HB ASP 46 -5.215 -12.148 -8.178 337 HB3 ASP 46 1HB ASP 46 -6.874 -11.778 -7.727 338 HA PRO 47 HA PRO 47 -7.333 -6.176 -8.094 339 HB2 PRO 47 2HB PRO 47 -7.349 -6.708 -11.078 340 HB3 PRO 47 1HB PRO 47 -7.048 -5.191 -10.199 341 HG2 PRO 47 2HG PRO 47 -5.025 -6.553 -11.239 342 HG3 PRO 47 1HG PRO 47 -4.870 -5.774 -9.646 343 HD2 PRO 47 2HD PRO 47 -5.244 -8.671 -10.306 344 HD3 PRO 47 1HD PRO 47 -4.309 -7.924 -8.994 345 H ASP 48 H ASP 48 -9.307 -6.737 -7.200 346 HA ASP 48 HA ASP 48 -11.396 -7.813 -9.016 347 HB2 ASP 48 2HB ASP 48 -11.462 -7.491 -5.981 348 HB3 ASP 48 1HB ASP 48 -12.842 -7.986 -6.953 349 HA PRO 49 HA PRO 49 -12.574 -3.420 -9.448 350 HB2 PRO 49 2HB PRO 49 -15.083 -4.600 -10.627 351 HB3 PRO 49 1HB PRO 49 -13.950 -3.428 -11.330 352 HG2 PRO 49 2HG PRO 49 -14.005 -5.935 -12.207 353 HG3 PRO 49 1HG PRO 49 -12.461 -5.066 -12.030 354 HD2 PRO 49 2HD PRO 49 -13.671 -7.143 -10.210 355 HD3 PRO 49 1HD PRO 49 -11.987 -6.954 -10.752 356 H ASP 50 H ASP 50 -14.826 -5.887 -8.314 357 HA ASP 50 HA ASP 50 -16.795 -4.234 -7.157 358 HB2 ASP 50 2HB ASP 50 -16.116 -7.128 -6.471 359 HB3 ASP 50 1HB ASP 50 -17.650 -6.314 -6.164 360 H TYR 51 H TYR 51 -13.713 -5.232 -5.966 361 HA TYR 51 HA TYR 51 -14.430 -4.985 -3.140 362 HB2 TYR 51 2HB TYR 51 -12.787 -6.752 -4.274 363 HB3 TYR 51 1HB TYR 51 -11.598 -5.473 -4.095 364 HD1 TYR 51 HD2 TYR 51 -10.999 -4.648 -1.760 365 HD2 TYR 51 HD1 TYR 51 -13.551 -8.019 -2.381 366 HE1 TYR 51 HE2 TYR 51 -10.682 -5.331 0.579 367 HE2 TYR 51 HE1 TYR 51 -13.246 -8.689 -0.057 368 HH TYR 51 HH TYR 51 -11.870 -6.677 2.281 369 H ARG 52 H ARG 52 -13.180 -3.064 -5.661 370 HA ARG 52 HA ARG 52 -11.538 -1.272 -4.158 371 HB2 ARG 52 2HB ARG 52 -11.269 -1.658 -6.600 372 HB3 ARG 52 1HB ARG 52 -12.835 -0.911 -6.899 373 HG2 ARG 52 2HG ARG 52 -12.022 1.243 -6.157 374 HG3 ARG 52 1HG ARG 52 -10.500 0.534 -5.607 375 HD2 ARG 52 2HD ARG 52 -10.095 1.640 -7.702 376 HD3 ARG 52 1HD ARG 52 -10.001 -0.098 -7.984 377 HE ARG 52 HE ARG 52 -12.483 0.270 -8.711 378 HH11 ARG 52 1HH1 ARG 52 -9.812 2.462 -9.364 379 HH12 ARG 52 2HH1 ARG 52 -10.508 3.059 -10.833 380 HH21 ARG 52 1HH2 ARG 52 -13.358 1.024 -10.648 381 HH22 ARG 52 2HH2 ARG 52 -12.528 2.237 -11.562 382 H VAL 53 H VAL 53 -12.140 0.466 -2.954 383 HA VAL 53 HA VAL 53 -14.975 1.346 -2.942 384 HB VAL 53 HB VAL 53 -14.735 1.865 -0.541 385 HG11 VAL 53 1HG1 VAL 53 -15.515 -0.394 -1.092 386 HG12 VAL 53 2HG1 VAL 53 -14.559 -0.430 0.390 387 HG13 VAL 53 3HG1 VAL 53 -13.854 -0.995 -1.129 388 HG21 VAL 53 3HG2 VAL 53 -12.716 1.233 0.760 389 HG22 VAL 53 1HG2 VAL 53 -12.346 2.457 -0.456 390 HG23 VAL 53 2HG2 VAL 53 -11.890 0.774 -0.731 391 H GLU 54 H GLU 54 -14.944 3.702 -1.717 392 HA GLU 54 HA GLU 54 -12.726 5.327 -2.851 393 HB2 GLU 54 2HB GLU 54 -14.333 7.158 -3.258 394 HB3 GLU 54 1HB GLU 54 -14.753 5.720 -4.177 395 HG2 GLU 54 2HG GLU 54 -16.530 5.183 -2.565 396 HG3 GLU 54 1HG GLU 54 -16.097 6.588 -1.595 397 H ALA 55 H ALA 55 -12.203 7.265 -1.641 398 HA ALA 55 HA ALA 55 -12.985 7.311 1.190 399 HB1 ALA 55 3HB ALA 55 -10.099 7.027 0.271 400 HB2 ALA 55 1HB ALA 55 -11.051 5.770 1.063 401 HB3 ALA 55 2HB ALA 55 -10.642 7.247 1.937 402 H THR 56 H THR 56 -12.725 9.324 2.147 403 HA THR 56 HA THR 56 -11.993 11.600 0.447 404 HB THR 56 HB THR 56 -13.150 11.531 3.275 405 HG1 THR 56 HG1 THR 56 -14.357 10.879 1.088 406 HG21 THR 56 3HG2 THR 56 -12.900 13.864 1.325 407 HG22 THR 56 1HG2 THR 56 -11.959 13.654 2.804 408 HG23 THR 56 2HG2 THR 56 -13.700 13.914 2.898 409 H VAL 57 H VAL 57 -10.079 12.577 0.658 410 HA VAL 57 HA VAL 57 -7.968 11.533 2.266 411 HB VAL 57 HB VAL 57 -7.978 14.100 0.584 412 HG11 VAL 57 1HG1 VAL 57 -6.030 13.875 2.063 413 HG12 VAL 57 2HG1 VAL 57 -5.556 13.723 0.372 414 HG13 VAL 57 3HG1 VAL 57 -5.676 12.282 1.388 415 HG21 VAL 57 3HG2 VAL 57 -7.192 12.761 -1.317 416 HG22 VAL 57 1HG2 VAL 57 -8.777 12.204 -0.781 417 HG23 VAL 57 2HG2 VAL 57 -7.332 11.281 -0.364 418 H THR 58 H THR 58 -7.379 12.210 4.234 419 HA THR 58 HA THR 58 -8.374 14.765 5.356 420 HB THR 58 HB THR 58 -7.538 12.250 6.886 421 HG1 THR 58 HG1 THR 58 -10.065 13.094 5.919 422 HG21 THR 58 3HG2 THR 58 -9.058 14.722 7.802 423 HG22 THR 58 1HG2 THR 58 -7.397 14.310 8.232 424 HG23 THR 58 2HG2 THR 58 -8.727 13.295 8.788 425 H VAL 59 H VAL 59 -6.652 16.059 4.746 426 HA VAL 59 HA VAL 59 -3.901 15.115 4.966 427 HB VAL 59 HB VAL 59 -5.097 17.644 3.727 428 HG11 VAL 59 1HG1 VAL 59 -2.808 18.280 3.012 429 HG12 VAL 59 2HG1 VAL 59 -2.135 16.960 3.973 430 HG13 VAL 59 3HG1 VAL 59 -2.963 18.299 4.767 431 HG21 VAL 59 3HG2 VAL 59 -4.153 16.700 1.634 432 HG22 VAL 59 1HG2 VAL 59 -5.303 15.597 2.393 433 HG23 VAL 59 2HG2 VAL 59 -3.569 15.293 2.530 434 H HIS 60 H HIS 60 -2.622 15.603 6.573 435 HA HIS 60 HA HIS 60 -3.503 17.184 8.840 436 HB2 HIS 60 2HB HIS 60 -1.079 15.409 8.318 437 HB3 HIS 60 1HB HIS 60 -1.296 16.318 9.818 438 HD1 HIS 60 HD1 HIS 60 -3.588 14.014 7.779 439 HD2 HIS 60 HD2 HIS 60 -2.366 14.660 11.704 440 HE1 HIS 60 HE1 HIS 60 -4.909 12.400 9.167 441 HE2 HIS 60 HE2 HIS 60 -4.259 12.906 11.549 442 H GLU 61 H GLU 61 -3.167 19.275 8.867 443 HA GLU 61 HA GLU 61 -1.808 20.816 7.017 444 HB2 GLU 61 2HB GLU 61 -2.100 22.689 8.697 445 HB3 GLU 61 1HB GLU 61 -3.563 21.772 8.353 446 HG2 GLU 61 2HG GLU 61 -3.205 20.477 10.461 447 HG3 GLU 61 1HG GLU 61 -1.808 21.492 10.809 448 H THR 62 H THR 62 -0.651 19.593 10.111 449 HA THR 62 HA THR 62 2.101 20.491 9.479 450 HB THR 62 HB THR 62 2.514 20.295 11.980 451 HG1 THR 62 HG1 THR 62 0.426 18.986 12.187 452 HG21 THR 62 3HG2 THR 62 1.405 22.411 12.594 453 HG22 THR 62 1HG2 THR 62 0.336 22.270 11.197 454 HG23 THR 62 2HG2 THR 62 2.068 22.516 10.963 455 HA PRO 63 HA PRO 63 2.192 15.945 8.850 456 HB2 PRO 63 2HB PRO 63 4.525 15.832 7.416 457 HB3 PRO 63 1HB PRO 63 2.998 16.392 6.706 458 HG2 PRO 63 2HG PRO 63 5.296 18.009 7.753 459 HG3 PRO 63 1HG PRO 63 4.342 18.231 6.267 460 HD2 PRO 63 2HD PRO 63 3.892 19.684 8.535 461 HD3 PRO 63 1HD PRO 63 2.602 19.287 7.377 462 H GLU 64 H GLU 64 2.811 14.523 10.377 463 HA GLU 64 HA GLU 64 5.019 15.133 12.212 464 HB2 GLU 64 2HB GLU 64 4.004 13.356 13.628 465 HB3 GLU 64 1HB GLU 64 2.853 14.618 13.205 466 HG2 GLU 64 2HG GLU 64 1.984 13.089 11.376 467 HG3 GLU 64 1HG GLU 64 3.004 11.817 12.039 468 H SER 65 H SER 65 6.739 13.726 12.630 469 HA SER 65 HA SER 65 7.673 12.139 10.427 470 HB2 SER 65 2HB SER 65 8.854 12.702 13.181 471 HB3 SER 65 1HB SER 65 9.703 11.844 11.891 472 HG SER 65 HG SER 65 8.593 14.363 11.362 473 H VAL 66 H VAL 66 7.282 10.050 10.114 474 HA VAL 66 HA VAL 66 6.833 8.174 12.352 475 HB VAL 66 HB VAL 66 5.464 7.955 9.616 476 HG11 VAL 66 1HG1 VAL 66 5.679 5.838 10.832 477 HG12 VAL 66 2HG1 VAL 66 3.987 6.323 10.727 478 HG13 VAL 66 3HG1 VAL 66 4.873 6.532 12.241 479 HG21 VAL 66 3HG2 VAL 66 4.621 10.007 10.635 480 HG22 VAL 66 1HG2 VAL 66 4.244 9.154 12.136 481 HG23 VAL 66 2HG2 VAL 66 3.363 8.770 10.655 482 H ASP 67 H ASP 67 8.379 6.579 12.297 483 HA ASP 67 HA ASP 67 10.288 6.472 10.092 484 HB2 ASP 67 2HB ASP 67 10.216 4.814 12.659 485 HB3 ASP 67 1HB ASP 67 11.560 4.904 11.520 486 H LEU 68 H LEU 68 9.824 5.268 8.356 487 HA LEU 68 HA LEU 68 8.463 2.651 8.695 488 HB2 LEU 68 2HB LEU 68 8.092 4.560 6.352 489 HB3 LEU 68 1HB LEU 68 7.312 2.998 6.555 490 HG LEU 68 HG LEU 68 6.833 5.447 8.298 491 HD11 LEU 68 1HD1 LEU 68 5.916 5.728 6.045 492 HD12 LEU 68 2HD1 LEU 68 4.637 5.571 7.243 493 HD13 LEU 68 3HD1 LEU 68 5.037 4.205 6.200 494 HD21 LEU 68 3HD2 LEU 68 5.428 2.752 8.359 495 HD22 LEU 68 1HD2 LEU 68 4.976 4.177 9.297 496 HD23 LEU 68 2HD2 LEU 68 6.519 3.383 9.595 497 H GLU 69 H GLU 69 8.858 1.196 6.828 498 HA GLU 69 HA GLU 69 11.635 0.970 6.180 499 HB2 GLU 69 2HB GLU 69 11.005 -1.005 4.877 500 HB3 GLU 69 1HB GLU 69 10.136 -1.025 6.405 501 HG2 GLU 69 2HG GLU 69 8.068 -0.359 5.325 502 HG3 GLU 69 1HG GLU 69 8.901 -0.056 3.804 503 H THR 70 H THR 70 12.694 1.621 4.338 504 HA THR 70 HA THR 70 11.083 2.301 1.948 505 HB THR 70 HB THR 70 12.793 4.027 2.679 506 HG1 THR 70 HG1 THR 70 12.071 3.721 0.457 507 HG21 THR 70 3HG2 THR 70 14.841 1.965 1.791 508 HG22 THR 70 1HG2 THR 70 14.605 2.529 3.447 509 HG23 THR 70 2HG2 THR 70 15.169 3.648 2.207 510 H SER 71 H SER 71 12.054 1.414 -0.099 511 HA SER 71 HA SER 71 11.815 -1.394 0.071 512 HB2 SER 71 2HB SER 71 12.295 -1.271 -2.404 513 HB3 SER 71 1HB SER 71 11.025 -0.166 -1.866 514 HG SER 71 HG SER 71 12.933 0.588 -3.290 515 H ASP 72 H ASP 72 14.647 0.702 -0.604 516 HA ASP 72 HA ASP 72 16.570 -1.350 -0.794 517 HB2 ASP 72 2HB ASP 72 16.547 1.026 -1.777 518 HB3 ASP 72 1HB ASP 72 17.008 1.607 -0.184 519 H ASP 73 H ASP 73 15.313 -2.034 1.546 520 HA ASP 73 HA ASP 73 15.890 -3.134 3.456 521 HB2 ASP 73 2HB ASP 73 18.661 -1.889 3.157 522 HB3 ASP 73 1HB ASP 73 18.232 -3.157 4.299 523 H ARG 74 H ARG 74 15.990 0.258 3.361 524 HA ARG 74 HA ARG 74 17.419 0.590 5.908 525 HB2 ARG 74 2HB ARG 74 18.167 1.619 3.721 526 HB3 ARG 74 1HB ARG 74 16.711 2.596 3.727 527 HG2 ARG 74 2HG ARG 74 17.490 3.776 5.728 528 HG3 ARG 74 1HG ARG 74 18.927 2.746 5.788 529 HD2 ARG 74 2HD ARG 74 18.202 4.652 3.522 530 HD3 ARG 74 1HD ARG 74 19.430 4.932 4.755 531 HE ARG 74 HE ARG 74 20.755 3.173 3.814 532 HH11 ARG 74 1HH1 ARG 74 18.012 4.018 1.769 533 HH12 ARG 74 2HH1 ARG 74 18.723 3.331 0.344 534 HH21 ARG 74 1HH2 ARG 74 21.649 2.284 1.939 535 HH22 ARG 74 2HH2 ARG 74 20.774 2.351 0.438 536 H THR 75 H THR 75 16.650 2.735 7.097 537 HA THR 75 HA THR 75 13.703 2.745 7.378 538 HB THR 75 HB THR 75 15.637 3.354 9.678 539 HG1 THR 75 HG1 THR 75 14.450 0.942 8.853 540 HG21 THR 75 3HG2 THR 75 13.386 4.381 9.878 541 HG22 THR 75 1HG2 THR 75 13.582 3.095 11.070 542 HG23 THR 75 2HG2 THR 75 12.631 2.809 9.611 543 H VAL 76 H VAL 76 12.898 4.711 7.063 544 HA VAL 76 HA VAL 76 14.613 7.093 7.138 545 HB VAL 76 HB VAL 76 13.737 7.892 4.908 546 HG11 VAL 76 1HG1 VAL 76 16.018 6.974 5.063 547 HG12 VAL 76 2HG1 VAL 76 15.306 6.582 3.499 548 HG13 VAL 76 3HG1 VAL 76 15.408 5.346 4.758 549 HG21 VAL 76 3HG2 VAL 76 12.809 5.025 4.533 550 HG22 VAL 76 1HG2 VAL 76 12.822 6.279 3.288 551 HG23 VAL 76 2HG2 VAL 76 11.773 6.443 4.695 552 H ARG 77 H ARG 77 13.531 8.958 7.543 553 HA ARG 77 HA ARG 77 11.053 8.848 8.927 554 HB2 ARG 77 2HB ARG 77 12.760 10.469 9.535 555 HB3 ARG 77 1HB ARG 77 12.773 11.168 7.928 556 HG2 ARG 77 2HG ARG 77 10.231 11.297 9.543 557 HG3 ARG 77 1HG ARG 77 11.563 12.367 9.963 558 HD2 ARG 77 2HD ARG 77 10.307 12.217 7.202 559 HD3 ARG 77 1HD ARG 77 9.867 13.388 8.443 560 HE ARG 77 HE ARG 77 12.041 14.376 8.263 561 HH11 ARG 77 1HH1 ARG 77 11.371 12.049 5.710 562 HH12 ARG 77 2HH1 ARG 77 12.580 12.686 4.644 563 HH21 ARG 77 1HH2 ARG 77 13.600 15.216 6.832 564 HH22 ARG 77 2HH2 ARG 77 13.843 14.483 5.282 565 H TYR 78 H TYR 78 9.104 8.710 8.007 566 HA TYR 78 HA TYR 78 8.514 10.048 5.444 567 HB2 TYR 78 2HB TYR 78 7.026 7.901 7.015 568 HB3 TYR 78 1HB TYR 78 6.230 8.841 5.760 569 HD1 TYR 78 HD2 TYR 78 9.519 6.985 6.067 570 HD2 TYR 78 HD1 TYR 78 6.004 7.690 3.746 571 HE1 TYR 78 HE2 TYR 78 10.286 5.371 4.385 572 HE2 TYR 78 HE1 TYR 78 6.772 6.080 2.070 573 HH TYR 78 HH TYR 78 9.258 3.890 2.623 574 H LEU 79 H LEU 79 7.191 11.768 5.405 575 HA LEU 79 HA LEU 79 6.188 12.913 7.916 576 HB2 LEU 79 2HB LEU 79 6.523 14.059 5.119 577 HB3 LEU 79 1HB LEU 79 5.632 14.900 6.379 578 HG LEU 79 HG LEU 79 8.575 14.139 6.532 579 HD11 LEU 79 1HD1 LEU 79 8.181 15.947 4.916 580 HD12 LEU 79 2HD1 LEU 79 9.051 16.528 6.330 581 HD13 LEU 79 3HD1 LEU 79 7.330 16.881 6.149 582 HD21 LEU 79 3HD2 LEU 79 6.880 15.728 8.500 583 HD22 LEU 79 1HD2 LEU 79 8.631 15.510 8.591 584 HD23 LEU 79 2HD2 LEU 79 7.565 14.121 8.765 585 H HIS 80 H HIS 80 4.150 12.657 8.475 586 HA HIS 80 HA HIS 80 2.293 11.183 6.833 587 HB2 HIS 80 2HB HIS 80 2.473 10.766 9.259 588 HB3 HIS 80 1HB HIS 80 2.024 12.430 9.603 589 HD2 HIS 80 HD2 HIS 80 -0.013 10.178 7.117 590 HE1 HIS 80 HE1 HIS 80 -2.337 10.965 10.561 591 HE2 HIS 80 HE2 HIS 80 -2.274 9.801 8.310 592 H VAL 81 H VAL 81 1.582 12.349 5.156 593 HA VAL 81 HA VAL 81 0.836 15.167 5.469 594 HB VAL 81 HB VAL 81 0.708 15.258 3.008 595 HG11 VAL 81 1HG1 VAL 81 2.859 15.703 4.076 596 HG12 VAL 81 2HG1 VAL 81 3.107 14.916 2.518 597 HG13 VAL 81 3HG1 VAL 81 3.282 13.989 4.012 598 HG21 VAL 81 3HG2 VAL 81 1.343 13.336 1.597 599 HG22 VAL 81 1HG2 VAL 81 -0.095 12.969 2.550 600 HG23 VAL 81 2HG2 VAL 81 1.470 12.308 3.028 601 H ALA 82 H ALA 82 -0.705 12.037 4.869 602 HA ALA 82 HA ALA 82 -3.346 13.337 4.831 603 HB1 ALA 82 3HB ALA 82 -4.032 12.139 2.783 604 HB2 ALA 82 1HB ALA 82 -2.400 11.486 2.607 605 HB3 ALA 82 2HB ALA 82 -2.679 13.223 2.459 606 H THR 83 H THR 83 -5.108 11.835 5.063 607 HA THR 83 HA THR 83 -4.543 9.047 5.744 608 HB THR 83 HB THR 83 -6.208 10.900 7.527 609 HG1 THR 83 HG1 THR 83 -4.194 9.636 8.795 610 HG21 THR 83 3HG2 THR 83 -6.416 8.942 9.019 611 HG22 THR 83 1HG2 THR 83 -5.549 7.946 7.846 612 HG23 THR 83 2HG2 THR 83 -7.133 8.611 7.443 613 H LEU 84 H LEU 84 -5.652 8.122 4.149 614 HA LEU 84 HA LEU 84 -8.000 9.240 2.920 615 HB2 LEU 84 2HB LEU 84 -6.969 6.408 2.496 616 HB3 LEU 84 1HB LEU 84 -7.842 7.428 1.363 617 HG LEU 84 HG LEU 84 -4.933 7.695 2.216 618 HD11 LEU 84 1HD1 LEU 84 -4.415 7.281 -0.144 619 HD12 LEU 84 2HD1 LEU 84 -6.134 7.110 -0.504 620 HD13 LEU 84 3HD1 LEU 84 -5.333 5.949 0.556 621 HD21 LEU 84 3HD2 LEU 84 -6.478 9.608 0.430 622 HD22 LEU 84 1HD2 LEU 84 -4.730 9.621 0.685 623 HD23 LEU 84 2HD2 LEU 84 -5.815 9.965 2.027 624 H SER 85 H SER 85 -9.773 9.259 4.192 625 HA SER 85 HA SER 85 -10.445 7.059 6.006 626 HB2 SER 85 2HB SER 85 -11.596 9.875 5.757 627 HB3 SER 85 1HB SER 85 -11.966 8.720 7.041 628 HG SER 85 HG SER 85 -9.555 10.086 6.509 629 H PHE 86 H PHE 86 -12.186 5.767 5.700 630 HA PHE 86 HA PHE 86 -14.293 6.251 3.756 631 HB2 PHE 86 2HB PHE 86 -13.812 4.092 2.523 632 HB3 PHE 86 1HB PHE 86 -12.602 5.332 2.261 633 HD1 PHE 86 HD1 PHE 86 -10.333 5.125 3.282 634 HD2 PHE 86 HD2 PHE 86 -13.207 1.983 3.636 635 HE1 PHE 86 HE1 PHE 86 -8.563 3.579 3.970 636 HE2 PHE 86 HE2 PHE 86 -11.425 0.439 4.329 637 HZ PHE 86 HZ PHE 86 -9.100 1.234 4.501 638 H ASP 87 H ASP 87 -15.519 3.931 3.613 639 HA ASP 87 HA ASP 87 -15.701 2.746 6.335 640 HB2 ASP 87 2HB ASP 87 -18.026 2.223 5.912 641 HB3 ASP 87 1HB ASP 87 -17.788 3.930 5.560 642 H LEU 88 H LEU 88 -15.687 0.495 6.493 643 HA LEU 88 HA LEU 88 -15.671 -1.197 4.146 644 HB2 LEU 88 2HB LEU 88 -13.269 -0.449 4.319 645 HB3 LEU 88 1HB LEU 88 -13.195 -1.119 5.939 646 HG LEU 88 HG LEU 88 -13.594 -3.400 4.997 647 HD11 LEU 88 1HD1 LEU 88 -14.846 -2.810 2.966 648 HD12 LEU 88 2HD1 LEU 88 -13.443 -3.799 2.572 649 HD13 LEU 88 3HD1 LEU 88 -13.402 -2.059 2.274 650 HD21 LEU 88 3HD2 LEU 88 -11.288 -2.621 5.390 651 HD22 LEU 88 1HD2 LEU 88 -11.226 -1.959 3.752 652 HD23 LEU 88 2HD2 LEU 88 -11.368 -3.702 4.001 653 H ASP 89 H ASP 89 -16.523 -3.134 4.653 654 HA ASP 89 HA ASP 89 -17.382 -4.910 5.744 655 HB2 ASP 89 2HB ASP 89 -15.250 -5.118 6.954 656 HB3 ASP 89 1HB ASP 89 -15.783 -3.947 8.152 657 H GLY 90 H GLY 90 -17.330 -2.439 8.305 658 HA2 GLY 90 2HA GLY 90 -19.973 -1.508 7.957 659 HA3 GLY 90 1HA GLY 90 -19.958 -2.740 9.224 660 H GLU 91 H GLU 91 -17.185 -0.741 8.639 661 HA GLU 91 HA GLU 91 -17.642 0.926 11.010 662 HB2 GLU 91 2HB GLU 91 -15.375 0.321 11.882 663 HB3 GLU 91 1HB GLU 91 -16.482 -1.050 11.877 664 HG2 GLU 91 2HG GLU 91 -15.433 -1.978 9.897 665 HG3 GLU 91 1HG GLU 91 -14.410 -0.557 9.709 666 H SER 92 H SER 92 -16.201 2.745 11.120 667 HA SER 92 HA SER 92 -15.461 3.851 8.534 668 HB2 SER 92 2HB SER 92 -16.556 5.262 10.276 669 HB3 SER 92 1HB SER 92 -15.166 5.036 11.336 670 HG SER 92 HG SER 92 -14.084 6.462 10.211 671 H ARG 93 H ARG 93 -13.727 2.725 7.776 672 HA ARG 93 HA ARG 93 -11.270 2.507 9.383 673 HB2 ARG 93 2HB ARG 93 -12.031 1.297 6.704 674 HB3 ARG 93 1HB ARG 93 -10.438 1.130 7.424 675 HG2 ARG 93 2HG ARG 93 -13.013 0.119 8.665 676 HG3 ARG 93 1HG ARG 93 -11.857 -0.861 7.759 677 HD2 ARG 93 2HD ARG 93 -11.324 -1.276 10.016 678 HD3 ARG 93 1HD ARG 93 -10.108 -0.106 9.506 679 HE ARG 93 HE ARG 93 -12.544 0.663 11.008 680 HH11 ARG 93 1HH1 ARG 93 -9.029 0.780 10.699 681 HH12 ARG 93 2HH1 ARG 93 -8.842 1.892 12.015 682 HH21 ARG 93 1HH2 ARG 93 -12.258 2.133 12.704 683 HH22 ARG 93 2HH2 ARG 93 -10.665 2.654 13.147 684 H ASP 94 H ASP 94 -9.444 3.564 8.935 685 HA ASP 94 HA ASP 94 -9.259 5.265 6.517 686 HB2 ASP 94 2HB ASP 94 -8.119 6.999 7.858 687 HB3 ASP 94 1HB ASP 94 -9.759 6.728 8.423 688 H LEU 95 H LEU 95 -7.258 5.388 5.600 689 HA LEU 95 HA LEU 95 -5.039 3.800 6.778 690 HB2 LEU 95 2HB LEU 95 -5.678 4.156 3.814 691 HB3 LEU 95 1HB LEU 95 -4.285 3.307 4.468 692 HG LEU 95 HG LEU 95 -7.191 2.449 4.624 693 HD11 LEU 95 1HD1 LEU 95 -6.136 2.006 2.471 694 HD12 LEU 95 2HD1 LEU 95 -6.428 0.497 3.333 695 HD13 LEU 95 3HD1 LEU 95 -4.798 1.172 3.269 696 HD21 LEU 95 3HD2 LEU 95 -6.159 1.913 6.774 697 HD22 LEU 95 1HD2 LEU 95 -4.809 1.119 5.956 698 HD23 LEU 95 2HD2 LEU 95 -6.437 0.444 5.846 699 H HIS 96 H HIS 96 -3.117 4.883 6.922 700 HA HIS 96 HA HIS 96 -3.271 7.780 6.464 701 HB2 HIS 96 2HB HIS 96 -1.220 6.104 7.988 702 HB3 HIS 96 1HB HIS 96 -1.283 7.866 7.941 703 HD2 HIS 96 HD2 HIS 96 -3.597 4.931 9.236 704 HE1 HIS 96 HE1 HIS 96 -4.258 8.411 11.534 705 HE2 HIS 96 HE2 HIS 96 -5.088 6.084 11.000 706 H ALA 97 H ALA 97 -2.224 8.727 4.858 707 HA ALA 97 HA ALA 97 -0.504 7.153 3.066 708 HB1 ALA 97 3HB ALA 97 -1.085 8.867 1.376 709 HB2 ALA 97 1HB ALA 97 -2.057 9.726 2.576 710 HB3 ALA 97 2HB ALA 97 -2.528 8.109 2.051 711 H PHE 98 H PHE 98 1.610 7.522 3.223 712 HA PHE 98 HA PHE 98 2.614 10.098 4.325 713 HB2 PHE 98 2HB PHE 98 4.125 7.447 4.424 714 HB3 PHE 98 1HB PHE 98 4.434 8.918 5.331 715 HD1 PHE 98 HD2 PHE 98 2.406 5.859 5.132 716 HD2 PHE 98 HD1 PHE 98 3.213 9.371 7.418 717 HE1 PHE 98 HE2 PHE 98 1.241 4.874 7.056 718 HE2 PHE 98 HE1 PHE 98 2.058 8.376 9.344 719 HZ PHE 98 HZ PHE 98 1.062 6.128 9.165 720 H ARG 99 H ARG 99 4.890 10.479 3.628 721 HA ARG 99 HA ARG 99 6.077 9.048 1.453 722 HB2 ARG 99 2HB ARG 99 6.338 10.945 -0.095 723 HB3 ARG 99 1HB ARG 99 4.649 10.512 0.100 724 HG2 ARG 99 2HG ARG 99 5.207 12.562 2.029 725 HG3 ARG 99 1HG ARG 99 5.922 13.080 0.504 726 HD2 ARG 99 2HD ARG 99 3.034 12.266 0.956 727 HD3 ARG 99 1HD ARG 99 3.629 13.904 0.692 728 HE ARG 99 HE ARG 99 4.312 12.124 -1.453 729 HH11 ARG 99 1HH1 ARG 99 1.706 14.157 -0.238 730 HH12 ARG 99 2HH1 ARG 99 0.960 14.328 -1.793 731 HH21 ARG 99 1HH2 ARG 99 3.362 12.357 -3.454 732 HH22 ARG 99 2HH2 ARG 99 1.912 13.296 -3.639 733 H GLN 100 H GLN 100 8.343 9.824 1.162 734 HA GLN 100 HA GLN 100 9.479 9.724 3.682 735 HB2 GLN 100 2HB GLN 100 10.838 10.527 1.091 736 HB3 GLN 100 1HB GLN 100 11.661 9.968 2.546 737 HG2 GLN 100 2HG GLN 100 10.600 7.768 2.353 738 HG3 GLN 100 1HG GLN 100 9.650 8.316 0.974 739 HE21 GLN 100 1HE2 GLN 100 13.096 9.000 1.493 740 HE22 GLN 100 2HE2 GLN 100 13.654 8.090 0.138 741 H ALA 101 H ALA 101 10.295 12.561 1.538 742 HA ALA 101 HA ALA 101 10.108 14.256 3.988 743 HB1 ALA 101 3HB ALA 101 12.425 14.007 3.221 744 HB2 ALA 101 1HB ALA 101 11.880 15.679 3.049 745 HB3 ALA 101 2HB ALA 101 11.984 14.632 1.632 746 H ALA 102 H ALA 102 10.359 15.112 0.509 747 HA ALA 102 HA ALA 102 7.939 16.804 0.796 748 HB1 ALA 102 3HB ALA 102 10.006 18.145 1.049 749 HB2 ALA 102 1HB ALA 102 9.141 18.579 -0.430 750 HB3 ALA 102 2HB ALA 102 10.583 17.564 -0.512 751 H ASP 103 H ASP 103 7.817 14.222 -0.353 752 HA ASP 103 HA ASP 103 8.181 14.281 -3.197 753 HB2 ASP 103 2HB ASP 103 8.198 12.107 -2.146 754 HB3 ASP 103 1HB ASP 103 6.653 12.392 -1.356 755 H GLU 104 H GLU 104 6.695 14.648 -4.768 756 HA GLU 104 HA GLU 104 3.881 15.146 -4.191 757 HB2 GLU 104 2HB GLU 104 3.858 17.307 -5.394 758 HB3 GLU 104 1HB GLU 104 4.857 17.382 -3.949 759 HG2 GLU 104 2HG GLU 104 6.885 17.164 -5.349 760 HG3 GLU 104 1HG GLU 104 5.877 17.122 -6.794 761 H SER 105 H SER 105 5.861 13.303 -5.658 762 HA SER 105 HA SER 105 4.892 13.271 -8.400 763 HB2 SER 105 2HB SER 105 7.225 12.575 -7.824 764 HB3 SER 105 1HB SER 105 6.581 11.240 -6.869 765 HG SER 105 HG SER 105 5.720 10.360 -8.766 766 H ARG 106 H ARG 106 3.233 12.838 -5.820 767 HA ARG 106 HA ARG 106 1.081 12.228 -5.565 768 HB2 ARG 106 2HB ARG 106 1.348 10.509 -8.069 769 HB3 ARG 106 1HB ARG 106 -0.156 10.942 -7.263 770 HG2 ARG 106 2HG ARG 106 1.717 12.840 -8.714 771 HG3 ARG 106 1HG ARG 106 0.153 12.266 -9.295 772 HD2 ARG 106 2HD ARG 106 -0.987 13.442 -7.485 773 HD3 ARG 106 1HD ARG 106 0.562 13.934 -6.792 774 HE ARG 106 HE ARG 106 -0.372 14.818 -9.462 775 HH11 ARG 106 1HH1 ARG 106 1.144 15.575 -6.374 776 HH12 ARG 106 2HH1 ARG 106 1.426 17.235 -6.782 777 HH21 ARG 106 1HH2 ARG 106 -0.019 17.013 -9.959 778 HH22 ARG 106 2HH2 ARG 106 0.768 18.046 -8.809 779 H THR 107 H THR 107 3.633 10.587 -4.838 780 HA THR 107 HA THR 107 2.687 7.844 -4.779 781 HB THR 107 HB THR 107 5.281 9.065 -3.736 782 HG1 THR 107 HG1 THR 107 4.375 8.402 -6.252 783 HG21 THR 107 3HG2 THR 107 4.591 6.148 -4.300 784 HG22 THR 107 1HG2 THR 107 4.781 6.857 -2.694 785 HG23 THR 107 2HG2 THR 107 6.162 6.763 -3.786 786 H LEU 108 H LEU 108 1.025 7.756 -3.379 787 HA LEU 108 HA LEU 108 1.261 8.620 -0.585 788 HB2 LEU 108 2HB LEU 108 -1.116 7.472 -2.116 789 HB3 LEU 108 1HB LEU 108 -1.158 8.066 -0.463 790 HG LEU 108 HG LEU 108 -0.668 9.743 -2.955 791 HD11 LEU 108 1HD1 LEU 108 -3.059 9.649 -1.084 792 HD12 LEU 108 2HD1 LEU 108 -3.000 9.041 -2.740 793 HD13 LEU 108 3HD1 LEU 108 -2.850 10.770 -2.435 794 HD21 LEU 108 3HD2 LEU 108 -0.729 11.715 -1.452 795 HD22 LEU 108 1HD2 LEU 108 0.640 10.664 -1.094 796 HD23 LEU 108 2HD2 LEU 108 -0.782 10.647 -0.048 797 H PHE 109 H PHE 109 2.021 7.190 0.820 798 HA PHE 109 HA PHE 109 2.048 4.301 0.204 799 HB2 PHE 109 2HB PHE 109 4.226 5.414 0.711 800 HB3 PHE 109 1HB PHE 109 3.603 5.937 2.271 801 HD1 PHE 109 HD1 PHE 109 4.409 2.869 0.274 802 HD2 PHE 109 HD2 PHE 109 3.832 4.508 4.183 803 HE1 PHE 109 HE1 PHE 109 5.236 0.784 1.279 804 HE2 PHE 109 HE2 PHE 109 4.659 2.418 5.180 805 HZ PHE 109 HZ PHE 109 5.363 0.551 3.730 806 H VAL 110 H VAL 110 0.113 3.424 0.953 807 HA VAL 110 HA VAL 110 -0.729 4.111 3.713 808 HB VAL 110 HB VAL 110 -3.023 3.412 3.189 809 HG11 VAL 110 1HG1 VAL 110 -2.008 5.541 1.280 810 HG12 VAL 110 2HG1 VAL 110 -2.474 5.775 2.968 811 HG13 VAL 110 3HG1 VAL 110 -3.689 5.317 1.775 812 HG21 VAL 110 3HG2 VAL 110 -2.119 3.050 0.305 813 HG22 VAL 110 1HG2 VAL 110 -3.796 3.016 0.861 814 HG23 VAL 110 2HG2 VAL 110 -2.663 1.776 1.396 815 HA PRO 111 HA PRO 111 0.091 -0.315 4.458 816 HB2 PRO 111 2HB PRO 111 0.359 -0.094 7.175 817 HB3 PRO 111 1HB PRO 111 1.686 0.287 6.061 818 HG2 PRO 111 2HG PRO 111 -0.164 2.148 7.495 819 HG3 PRO 111 1HG PRO 111 1.584 2.298 7.197 820 HD2 PRO 111 2HD PRO 111 -0.344 3.583 5.696 821 HD3 PRO 111 1HD PRO 111 1.279 3.189 5.092 822 H PHE 112 H PHE 112 -1.640 -1.718 4.663 823 HA PHE 112 HA PHE 112 -3.704 -1.022 6.628 824 HB2 PHE 112 2HB PHE 112 -5.492 -1.953 5.360 825 HB3 PHE 112 1HB PHE 112 -4.661 -0.795 4.348 826 HD1 PHE 112 HD1 PHE 112 -3.323 -1.575 2.384 827 HD2 PHE 112 HD2 PHE 112 -5.652 -4.282 4.738 828 HE1 PHE 112 HE1 PHE 112 -3.270 -3.222 0.571 829 HE2 PHE 112 HE2 PHE 112 -5.583 -5.930 2.925 830 HZ PHE 112 HZ PHE 112 -4.396 -5.403 0.834 831 H ARG 113 H ARG 113 -3.652 -2.355 8.267 832 HA ARG 113 HA ARG 113 -2.617 -5.122 7.955 833 HB2 ARG 113 2HB ARG 113 -1.388 -3.691 9.581 834 HB3 ARG 113 1HB ARG 113 -2.888 -3.337 10.431 835 HG2 ARG 113 2HG ARG 113 -3.086 -5.768 11.011 836 HG3 ARG 113 1HG ARG 113 -1.521 -6.051 10.241 837 HD2 ARG 113 2HD ARG 113 -0.464 -4.486 11.860 838 HD3 ARG 113 1HD ARG 113 -2.033 -4.247 12.637 839 HE ARG 113 HE ARG 113 -1.714 -6.930 12.758 840 HH11 ARG 113 1HH1 ARG 113 0.421 -4.298 13.740 841 HH12 ARG 113 2HH1 ARG 113 1.155 -5.218 15.015 842 HH21 ARG 113 1HH2 ARG 113 -0.739 -8.092 14.463 843 HH22 ARG 113 2HH2 ARG 113 0.502 -7.353 15.422 844 H ASP 114 H ASP 114 -4.252 -6.664 7.921 845 HA ASP 114 HA ASP 114 -6.833 -5.991 9.209 846 HB2 ASP 114 2HB ASP 114 -8.039 -6.985 7.418 847 HB3 ASP 114 1HB ASP 114 -6.836 -5.973 6.638 848 H LYS 115 H LYS 115 -8.031 -8.493 9.027 849 HA LYS 115 HA LYS 115 -6.862 -9.623 11.395 850 HB2 LYS 115 2HB LYS 115 -9.224 -10.583 9.735 851 HB3 LYS 115 1HB LYS 115 -8.819 -11.163 11.350 852 HG2 LYS 115 2HG LYS 115 -9.604 -8.314 10.639 853 HG3 LYS 115 1HG LYS 115 -10.665 -9.515 11.375 854 HD2 LYS 115 2HD LYS 115 -8.098 -8.503 12.660 855 HD3 LYS 115 1HD LYS 115 -9.693 -7.820 12.977 856 HE2 LYS 115 2HE LYS 115 -10.462 -9.964 13.855 857 HE3 LYS 115 1HE LYS 115 -8.904 -10.699 13.483 858 HZ1 LYS 115 3HZ LYS 115 -7.873 -9.151 15.041 859 HZ2 LYS 115 1HZ LYS 115 -9.028 -10.119 15.803 860 HZ3 LYS 115 2HZ LYS 115 -9.384 -8.508 15.429 861 H THR 116 H THR 116 -6.493 -10.412 8.038 862 HA THR 116 HA THR 116 -5.904 -13.224 8.403 863 HB THR 116 HB THR 116 -5.327 -13.226 5.999 864 HG1 THR 116 HG1 THR 116 -6.056 -10.622 5.506 865 HG21 THR 116 3HG2 THR 116 -7.502 -12.566 5.072 866 HG22 THR 116 1HG2 THR 116 -7.863 -11.637 6.530 867 HG23 THR 116 2HG2 THR 116 -7.722 -13.396 6.614 868 H THR 117 H THR 117 -4.086 -10.635 9.341 869 HA THR 117 HA THR 117 -1.518 -10.888 8.416 870 HB THR 117 HB THR 117 -2.290 -10.341 11.323 871 HG1 THR 117 HG1 THR 117 -3.056 -8.544 10.565 872 HG21 THR 117 3HG2 THR 117 -0.190 -9.020 11.409 873 HG22 THR 117 1HG2 THR 117 0.199 -9.527 9.760 874 HG23 THR 117 2HG2 THR 117 0.153 -10.715 11.063 875 H GLY 118 H GLY 118 -0.313 -12.697 8.214 876 HA2 GLY 118 2HA GLY 118 1.195 -14.286 8.943 877 HA3 GLY 118 1HA GLY 118 0.536 -14.157 10.568 878 H GLN 119 H GLN 119 -1.625 -14.673 7.894 879 HA GLN 119 HA GLN 119 -1.709 -17.595 8.236 880 HB2 GLN 119 2HB GLN 119 -4.135 -15.752 8.509 881 HB3 GLN 119 1HB GLN 119 -4.268 -17.487 8.245 882 HG2 GLN 119 2HG GLN 119 -2.981 -16.169 10.657 883 HG3 GLN 119 1HG GLN 119 -4.600 -16.863 10.609 884 HE21 GLN 119 1HE2 GLN 119 -2.327 -17.567 12.308 885 HE22 GLN 119 2HE2 GLN 119 -2.026 -19.245 12.041 886 H GLN 120 H GLN 120 -3.889 -15.315 6.550 887 HA GLN 120 HA GLN 120 -3.430 -16.697 3.995 888 HB2 GLN 120 2HB GLN 120 -5.390 -14.470 4.706 889 HB3 GLN 120 1HB GLN 120 -5.352 -15.370 3.192 890 HG2 GLN 120 2HG GLN 120 -5.984 -17.423 4.352 891 HG3 GLN 120 1HG GLN 120 -5.921 -16.591 5.908 892 HE21 GLN 120 1HE2 GLN 120 -8.070 -16.929 6.428 893 HE22 GLN 120 2HE2 GLN 120 -9.385 -16.199 5.578 894 H SER 121 H SER 121 -3.090 -13.569 5.540 895 HA SER 121 HA SER 121 -1.282 -12.625 3.402 896 HB2 SER 121 2HB SER 121 -2.707 -11.119 5.642 897 HB3 SER 121 1HB SER 121 -1.541 -10.381 4.540 898 HG SER 121 HG SER 121 -4.160 -11.153 4.111 899 H TYR 122 H TYR 122 0.530 -11.230 4.413 900 HA TYR 122 HA TYR 122 2.061 -13.023 6.129 901 HB2 TYR 122 2HB TYR 122 2.855 -10.604 4.457 902 HB3 TYR 122 1HB TYR 122 3.987 -11.555 5.414 903 HD1 TYR 122 HD2 TYR 122 1.816 -11.601 2.394 904 HD2 TYR 122 HD1 TYR 122 4.710 -13.778 4.666 905 HE1 TYR 122 HE2 TYR 122 2.102 -13.181 0.533 906 HE2 TYR 122 HE1 TYR 122 4.982 -15.352 2.813 907 HH TYR 122 HH TYR 122 3.702 -16.149 0.867 908 H ASP 123 H ASP 123 3.615 -11.980 7.657 909 HA ASP 123 HA ASP 123 2.243 -10.782 9.805 910 HB2 ASP 123 2HB ASP 123 5.237 -11.114 9.347 911 HB3 ASP 123 1HB ASP 123 4.522 -10.623 10.882 912 H GLY 124 H GLY 124 2.932 -8.844 11.000 913 HA2 GLY 124 2HA GLY 124 3.514 -6.633 11.270 914 HA3 GLY 124 1HA GLY 124 4.205 -6.624 9.655 915 H GLY 125 H GLY 125 2.747 -6.478 7.865 916 HA2 GLY 125 2HA GLY 125 -0.036 -5.906 8.075 917 HA3 GLY 125 1HA GLY 125 0.900 -4.409 7.961 918 H ARG 126 H ARG 126 -0.770 -4.800 5.956 919 HA ARG 126 HA ARG 126 0.922 -5.629 3.657 920 HB2 ARG 126 2HB ARG 126 -2.076 -4.979 3.722 921 HB3 ARG 126 1HB ARG 126 -1.149 -5.152 2.245 922 HG2 ARG 126 2HG ARG 126 -2.230 -7.190 2.384 923 HG3 ARG 126 1HG ARG 126 -0.656 -7.562 3.086 924 HD2 ARG 126 2HD ARG 126 -3.088 -6.851 4.749 925 HD3 ARG 126 1HD ARG 126 -2.679 -8.504 4.286 926 HE ARG 126 HE ARG 126 -0.438 -7.312 5.457 927 HH11 ARG 126 1HH1 ARG 126 -3.651 -8.408 6.447 928 HH12 ARG 126 2HH1 ARG 126 -3.149 -8.764 8.073 929 HH21 ARG 126 1HH2 ARG 126 0.206 -7.899 7.550 930 HH22 ARG 126 2HH2 ARG 126 -0.970 -8.470 8.678 931 H TYR 127 H TYR 127 0.923 -3.930 1.913 932 HA TYR 127 HA TYR 127 -0.046 -1.319 2.681 933 HB2 TYR 127 2HB TYR 127 2.231 -0.253 2.100 934 HB3 TYR 127 1HB TYR 127 2.027 -1.004 3.674 935 HD1 TYR 127 HD2 TYR 127 3.071 -3.249 4.152 936 HD2 TYR 127 HD1 TYR 127 3.970 -1.048 0.586 937 HE1 TYR 127 HE2 TYR 127 5.143 -4.512 3.880 938 HE2 TYR 127 HE1 TYR 127 6.042 -2.333 0.323 939 HH TYR 127 HH TYR 127 7.617 -3.614 2.091 940 H MET 128 H MET 128 -0.889 -0.406 1.151 941 HA MET 128 HA MET 128 -0.519 -1.210 -1.650 942 HB2 MET 128 2HB MET 128 -2.795 -1.254 -0.115 943 HB3 MET 128 1HB MET 128 -2.878 0.415 -0.671 944 HG2 MET 128 2HG MET 128 -2.530 -1.837 -2.641 945 HG3 MET 128 1HG MET 128 -4.120 -1.391 -2.019 946 HE1 MET 128 3HE MET 128 -4.817 2.058 -3.444 947 HE2 MET 128 1HE MET 128 -4.349 1.598 -1.806 948 HE3 MET 128 2HE MET 128 -5.474 0.590 -2.720 949 H GLU 129 H GLU 129 -0.300 0.522 -3.229 950 HA GLU 129 HA GLU 129 0.594 3.115 -2.102 951 HB2 GLU 129 2HB GLU 129 2.550 1.593 -2.501 952 HB3 GLU 129 1HB GLU 129 2.111 1.496 -4.201 953 HG2 GLU 129 2HG GLU 129 2.519 3.916 -4.442 954 HG3 GLU 129 1HG GLU 129 2.941 4.023 -2.733 955 H LEU 130 H LEU 130 -0.539 4.679 -3.005 956 HA LEU 130 HA LEU 130 -1.834 4.288 -5.639 957 HB2 LEU 130 2HB LEU 130 -2.559 6.528 -3.711 958 HB3 LEU 130 1HB LEU 130 -3.502 5.849 -5.025 959 HG LEU 130 HG LEU 130 -3.508 3.671 -3.495 960 HD11 LEU 130 1HD1 LEU 130 -3.548 4.178 -1.091 961 HD12 LEU 130 2HD1 LEU 130 -3.041 5.837 -1.426 962 HD13 LEU 130 3HD1 LEU 130 -1.964 4.487 -1.799 963 HD21 LEU 130 3HD2 LEU 130 -5.625 4.370 -2.500 964 HD22 LEU 130 1HD2 LEU 130 -5.518 4.924 -4.169 965 HD23 LEU 130 2HD2 LEU 130 -5.258 6.061 -2.844 966 H GLU 131 H GLU 131 -1.620 5.843 -7.235 967 HA GLU 131 HA GLU 131 -0.251 8.368 -6.618 968 HB2 GLU 131 2HB GLU 131 0.348 6.620 -9.040 969 HB3 GLU 131 1HB GLU 131 0.847 8.303 -8.900 970 HG2 GLU 131 2HG GLU 131 2.218 7.738 -6.933 971 HG3 GLU 131 1HG GLU 131 1.726 6.049 -7.065 972 HA PRO 132 HA PRO 132 -4.359 9.368 -8.565 973 HB2 PRO 132 2HB PRO 132 -4.409 11.917 -7.434 974 HB3 PRO 132 1HB PRO 132 -5.026 10.468 -6.614 975 HG2 PRO 132 2HG PRO 132 -2.338 11.781 -6.332 976 HG3 PRO 132 1HG PRO 132 -3.447 11.205 -5.061 977 HD2 PRO 132 2HD PRO 132 -1.359 9.720 -5.778 978 HD3 PRO 132 1HD PRO 132 -2.921 8.944 -5.439 979 H ASP 133 H ASP 133 -4.879 11.245 -9.995 980 HA ASP 133 HA ASP 133 -2.824 11.862 -11.859 981 HB2 ASP 133 2HB ASP 133 -5.144 11.753 -12.586 982 HB3 ASP 133 1HB ASP 133 -5.624 13.009 -11.448 983 H ARG 134 H ARG 134 -4.673 13.976 -9.659 984 HA ARG 134 HA ARG 134 -2.543 16.017 -9.748 985 HB2 ARG 134 2HB ARG 134 -4.368 17.585 -9.136 986 HB3 ARG 134 1HB ARG 134 -4.691 16.727 -10.632 987 HG2 ARG 134 2HG ARG 134 -6.757 16.387 -9.761 988 HG3 ARG 134 1HG ARG 134 -5.994 15.097 -8.836 989 HD2 ARG 134 2HD ARG 134 -5.690 16.640 -6.939 990 HD3 ARG 134 1HD ARG 134 -6.394 17.953 -7.878 991 HE ARG 134 HE ARG 134 -7.784 16.028 -6.365 992 HH11 ARG 134 1HH1 ARG 134 -8.122 17.758 -9.425 993 HH12 ARG 134 2HH1 ARG 134 -9.849 17.647 -9.414 994 HH21 ARG 134 1HH2 ARG 134 -10.033 15.931 -6.372 995 HH22 ARG 134 2HH2 ARG 134 -10.930 16.615 -7.691 996 H ASP 135 H ASP 135 -2.691 17.473 -7.661 997 HA ASP 135 HA ASP 135 -1.868 15.746 -5.465 998 HB2 ASP 135 2HB ASP 135 -0.534 17.771 -6.120 999 HB3 ASP 135 1HB ASP 135 -1.877 18.792 -5.618 1000 H LEU 136 H LEU 136 -2.860 15.644 -3.453 1001 HA LEU 136 HA LEU 136 -5.733 16.338 -3.492 1002 HB2 LEU 136 2HB LEU 136 -4.272 14.206 -1.881 1003 HB3 LEU 136 1HB LEU 136 -6.014 14.445 -1.945 1004 HG LEU 136 HG LEU 136 -4.263 13.558 -4.278 1005 HD11 LEU 136 1HD1 LEU 136 -6.261 11.944 -2.667 1006 HD12 LEU 136 2HD1 LEU 136 -4.506 11.804 -2.576 1007 HD13 LEU 136 3HD1 LEU 136 -5.343 11.374 -4.065 1008 HD21 LEU 136 3HD2 LEU 136 -6.368 13.181 -5.512 1009 HD22 LEU 136 1HD2 LEU 136 -6.165 14.881 -5.092 1010 HD23 LEU 136 2HD2 LEU 136 -7.286 13.873 -4.173 1011 H SER 137 H SER 137 -6.695 17.228 -1.719 1012 HA SER 137 HA SER 137 -5.054 18.200 0.544 1013 HB2 SER 137 2HB SER 137 -7.294 19.717 -0.890 1014 HB3 SER 137 1HB SER 137 -6.401 20.288 0.524 1015 HG SER 137 HG SER 137 -4.758 19.550 -1.529 1016 H ASP 138 H ASP 138 -6.618 18.838 2.441 1017 HA ASP 138 HA ASP 138 -8.258 16.584 3.081 1018 HB2 ASP 138 2HB ASP 138 -8.823 17.781 5.166 1019 HB3 ASP 138 1HB ASP 138 -7.096 17.793 4.861 1020 H GLY 139 H GLY 139 -10.069 16.202 1.999 1021 HA2 GLY 139 2HA GLY 139 -12.478 17.074 1.865 1022 HA3 GLY 139 1HA GLY 139 -11.761 18.454 1.043 1023 H ASP 140 H ASP 140 -9.760 16.885 -0.385 1024 HA ASP 140 HA ASP 140 -11.136 16.087 -2.731 1025 HB2 ASP 140 2HB ASP 140 -8.293 15.650 -1.755 1026 HB3 ASP 140 1HB ASP 140 -8.838 14.917 -3.259 1027 H GLU 141 H GLU 141 -11.223 13.934 -3.682 1028 HA GLU 141 HA GLU 141 -11.385 11.733 -1.699 1029 HB2 GLU 141 2HB GLU 141 -12.934 12.111 -4.302 1030 HB3 GLU 141 1HB GLU 141 -13.056 10.704 -3.244 1031 HG2 GLU 141 2HG GLU 141 -13.929 12.129 -1.430 1032 HG3 GLU 141 1HG GLU 141 -13.768 13.547 -2.463 1033 H ILE 142 H ILE 142 -11.094 9.539 -2.771 1034 HA ILE 142 HA ILE 142 -9.123 9.290 -4.861 1035 HB ILE 142 HB ILE 142 -7.684 10.136 -3.041 1036 HG12 ILE 142 2HG1 ILE 142 -6.043 8.219 -2.842 1037 HG13 ILE 142 1HG1 ILE 142 -7.252 7.155 -3.549 1038 HG21 ILE 142 1HG2 ILE 142 -7.409 8.938 -0.902 1039 HG22 ILE 142 2HG2 ILE 142 -8.705 7.830 -1.353 1040 HG23 ILE 142 3HG2 ILE 142 -9.052 9.543 -1.116 1041 HD11 ILE 142 3HD1 ILE 142 -5.566 7.849 -5.167 1042 HD12 ILE 142 1HD1 ILE 142 -5.998 9.540 -4.917 1043 HD13 ILE 142 2HD1 ILE 142 -7.166 8.425 -5.633 1044 H THR 143 H THR 143 -8.835 7.042 -5.426 1045 HA THR 143 HA THR 143 -11.062 5.345 -4.473 1046 HB THR 143 HB THR 143 -9.434 4.737 -6.974 1047 HG1 THR 143 HG1 THR 143 -11.281 6.858 -6.615 1048 HG21 THR 143 3HG2 THR 143 -11.248 3.190 -6.268 1049 HG22 THR 143 1HG2 THR 143 -11.601 3.948 -7.820 1050 HG23 THR 143 2HG2 THR 143 -12.407 4.516 -6.356 1051 H LEU 144 H LEU 144 -10.610 3.384 -3.396 1052 HA LEU 144 HA LEU 144 -7.773 2.781 -2.817 1053 HB2 LEU 144 2HB LEU 144 -10.186 3.057 -1.038 1054 HB3 LEU 144 1HB LEU 144 -9.042 1.803 -0.614 1055 HG LEU 144 HG LEU 144 -8.662 3.895 0.658 1056 HD11 LEU 144 1HD1 LEU 144 -6.774 2.363 0.255 1057 HD12 LEU 144 2HD1 LEU 144 -6.235 4.037 0.348 1058 HD13 LEU 144 3HD1 LEU 144 -6.366 3.241 -1.223 1059 HD21 LEU 144 3HD2 LEU 144 -9.400 5.514 -1.063 1060 HD22 LEU 144 1HD2 LEU 144 -7.953 5.161 -2.014 1061 HD23 LEU 144 2HD2 LEU 144 -7.808 5.912 -0.424 1062 H ASP 145 H ASP 145 -7.403 1.094 -4.106 1063 HA ASP 145 HA ASP 145 -9.109 -1.320 -3.957 1064 HB2 ASP 145 2HB ASP 145 -7.461 -1.976 -5.999 1065 HB3 ASP 145 1HB ASP 145 -8.945 -1.061 -6.237 1066 H PHE 146 H PHE 146 -8.433 -2.225 -2.129 1067 HA PHE 146 HA PHE 146 -5.748 -2.508 -1.199 1068 HB2 PHE 146 2HB PHE 146 -8.105 -4.270 -0.406 1069 HB3 PHE 146 1HB PHE 146 -6.691 -3.855 0.568 1070 HD1 PHE 146 HD2 PHE 146 -6.402 -1.019 0.398 1071 HD2 PHE 146 HD1 PHE 146 -10.030 -3.278 0.556 1072 HE1 PHE 146 HE2 PHE 146 -7.586 0.942 1.238 1073 HE2 PHE 146 HE1 PHE 146 -11.219 -1.297 1.406 1074 HZ PHE 146 HZ PHE 146 -9.998 0.817 1.747 1075 H ASN 147 H ASN 147 -7.381 -4.073 -3.638 1076 HA ASN 147 HA ASN 147 -6.206 -6.674 -3.573 1077 HB2 ASN 147 2HB ASN 147 -7.469 -5.218 -5.930 1078 HB3 ASN 147 1HB ASN 147 -7.212 -6.956 -5.781 1079 HD21 ASN 147 1HD2 ASN 147 -9.105 -7.929 -5.493 1080 HD22 ASN 147 2HD2 ASN 147 -10.394 -7.360 -4.488 1081 H LEU 148 H LEU 148 -4.923 -3.633 -4.367 1082 HA LEU 148 HA LEU 148 -2.871 -4.751 -6.182 1083 HB2 LEU 148 2HB LEU 148 -3.190 -1.838 -5.375 1084 HB3 LEU 148 1HB LEU 148 -2.292 -2.492 -6.734 1085 HG LEU 148 HG LEU 148 -5.291 -2.173 -6.447 1086 HD11 LEU 148 1HD1 LEU 148 -5.060 -0.844 -8.518 1087 HD12 LEU 148 2HD1 LEU 148 -3.314 -1.103 -8.480 1088 HD13 LEU 148 3HD1 LEU 148 -4.101 -0.195 -7.189 1089 HD21 LEU 148 3HD2 LEU 148 -5.015 -4.399 -7.409 1090 HD22 LEU 148 1HD2 LEU 148 -3.896 -3.769 -8.626 1091 HD23 LEU 148 2HD2 LEU 148 -5.592 -3.281 -8.639 1092 H ALA 149 H ALA 149 -3.165 -5.121 -3.141 1093 HA ALA 149 HA ALA 149 -1.023 -3.729 -1.875 1094 HB1 ALA 149 3HB ALA 149 -2.363 -6.311 -1.042 1095 HB2 ALA 149 1HB ALA 149 -2.891 -4.682 -0.618 1096 HB3 ALA 149 2HB ALA 149 -1.343 -5.290 -0.024 1097 H TYR 150 H TYR 150 1.063 -4.383 -1.412 1098 HA TYR 150 HA TYR 150 2.174 -6.412 -3.263 1099 HB2 TYR 150 2HB TYR 150 3.691 -4.132 -1.910 1100 HB3 TYR 150 1HB TYR 150 4.187 -5.082 -3.313 1101 HD1 TYR 150 HD1 TYR 150 2.573 -4.916 -5.430 1102 HD2 TYR 150 HD2 TYR 150 2.673 -2.023 -2.285 1103 HE1 TYR 150 HE1 TYR 150 1.502 -3.273 -6.904 1104 HE2 TYR 150 HE2 TYR 150 1.616 -0.384 -3.765 1105 HH TYR 150 HH TYR 150 1.242 0.077 -6.075 1106 H SER 151 H SER 151 3.400 -8.070 -2.498 1107 HA SER 151 HA SER 151 3.172 -9.039 0.066 1108 HB2 SER 151 2HB SER 151 5.362 -9.679 -1.949 1109 HB3 SER 151 1HB SER 151 4.790 -10.723 -0.646 1110 HG SER 151 HG SER 151 3.205 -11.331 -1.867 1111 HA PRO 152 HA PRO 152 5.804 -6.157 2.210 1112 HB2 PRO 152 2HB PRO 152 5.681 -7.952 4.593 1113 HB3 PRO 152 1HB PRO 152 4.998 -6.328 4.369 1114 HG2 PRO 152 2HG PRO 152 3.428 -8.498 4.488 1115 HG3 PRO 152 1HG PRO 152 3.039 -7.117 3.433 1116 HD2 PRO 152 2HD PRO 152 4.322 -9.750 2.696 1117 HD3 PRO 152 1HD PRO 152 3.012 -8.863 1.879 1118 H PHE 153 H PHE 153 7.959 -5.954 1.820 1119 HA PHE 153 HA PHE 153 9.952 -7.746 1.598 1120 HB2 PHE 153 2HB PHE 153 10.136 -4.968 2.832 1121 HB3 PHE 153 1HB PHE 153 11.540 -5.913 2.359 1122 HD1 PHE 153 HD2 PHE 153 12.024 -6.324 -0.066 1123 HD2 PHE 153 HD1 PHE 153 8.820 -3.773 1.154 1124 HE1 PHE 153 HE2 PHE 153 11.940 -5.339 -2.314 1125 HE2 PHE 153 HE1 PHE 153 8.752 -2.787 -1.093 1126 HZ PHE 153 HZ PHE 153 10.316 -3.565 -2.831 1127 H CYS 154 H CYS 154 9.004 -6.209 4.651 1128 HA CYS 154 HA CYS 154 11.122 -7.262 6.203 1129 HB2 CYS 154 2HB CYS 154 8.480 -6.056 7.102 1130 HB3 CYS 154 1HB CYS 154 9.932 -6.235 8.088 1131 HG CYS 154 HG CYS 154 9.520 -4.168 5.401 1132 H ALA 155 H ALA 155 7.722 -8.276 5.824 1133 HA ALA 155 HA ALA 155 7.623 -10.331 7.715 1134 HB1 ALA 155 3HB ALA 155 5.636 -9.452 6.574 1135 HB2 ALA 155 1HB ALA 155 5.719 -11.210 6.432 1136 HB3 ALA 155 2HB ALA 155 6.164 -10.187 5.061 1137 H TYR 156 H TYR 156 8.822 -10.403 4.388 1138 HA TYR 156 HA TYR 156 9.521 -13.195 4.392 1139 HB2 TYR 156 2HB TYR 156 10.397 -10.906 2.601 1140 HB3 TYR 156 1HB TYR 156 10.963 -12.555 2.380 1141 HD1 TYR 156 HD2 TYR 156 9.124 -14.403 2.035 1142 HD2 TYR 156 HD1 TYR 156 8.404 -10.228 1.500 1143 HE1 TYR 156 HE2 TYR 156 7.188 -14.915 0.607 1144 HE2 TYR 156 HE1 TYR 156 6.483 -10.741 0.087 1145 HH TYR 156 HH TYR 156 5.195 -13.920 -0.251 1146 H SER 157 H SER 157 11.300 -10.211 5.213 1147 HA SER 157 HA SER 157 13.615 -11.793 6.084 1148 HB2 SER 157 2HB SER 157 14.056 -11.275 3.690 1149 HB3 SER 157 1HB SER 157 13.848 -9.558 4.021 1150 HG SER 157 HG SER 157 15.920 -11.290 4.801 1151 H ASP 158 H ASP 158 14.442 -10.999 7.922 1152 HA ASP 158 HA ASP 158 13.210 -8.656 9.138 1153 HB2 ASP 158 2HB ASP 158 14.215 -9.365 11.210 1154 HB3 ASP 158 1HB ASP 158 13.586 -10.801 10.413 1155 H THR 159 H THR 159 16.090 -9.330 7.399 1156 HA THR 159 HA THR 159 17.814 -7.301 8.390 1157 HB THR 159 HB THR 159 19.058 -7.576 6.284 1158 HG1 THR 159 HG1 THR 159 16.707 -8.926 5.441 1159 HG21 THR 159 3HG2 THR 159 19.390 -9.328 7.984 1160 HG22 THR 159 1HG2 THR 159 19.518 -10.001 6.357 1161 HG23 THR 159 2HG2 THR 159 18.052 -10.258 7.306 1162 H PHE 160 H PHE 160 14.999 -7.238 6.369 1163 HA PHE 160 HA PHE 160 15.292 -4.417 5.633 1164 HB2 PHE 160 2HB PHE 160 13.016 -6.425 5.239 1165 HB3 PHE 160 1HB PHE 160 12.931 -4.738 4.741 1166 HD1 PHE 160 HD2 PHE 160 15.137 -7.762 4.272 1167 HD2 PHE 160 HD1 PHE 160 13.467 -4.243 2.509 1168 HE1 PHE 160 HE2 PHE 160 16.094 -8.391 2.098 1169 HE2 PHE 160 HE1 PHE 160 14.432 -4.870 0.345 1170 HZ PHE 160 HZ PHE 160 15.743 -6.949 0.128 1171 H SER 161 H SER 161 14.885 -2.984 7.210 1172 HA SER 161 HA SER 161 13.810 -3.682 9.758 1173 HB2 SER 161 2HB SER 161 14.053 -1.128 10.098 1174 HB3 SER 161 1HB SER 161 15.519 -2.035 9.721 1175 HG SER 161 HG SER 161 15.455 -1.291 7.640 1176 H CYS 162 H CYS 162 11.703 -3.610 10.459 1177 HA CYS 162 HA CYS 162 9.657 -3.374 8.516 1178 HB2 CYS 162 2HB CYS 162 8.185 -3.976 10.488 1179 HB3 CYS 162 1HB CYS 162 9.532 -5.083 10.216 1180 HG CYS 162 HG CYS 162 10.048 -2.557 12.397 1181 HA PRO 163 HA PRO 163 8.149 0.812 9.459 1182 HB2 PRO 163 2HB PRO 163 5.714 0.699 8.275 1183 HB3 PRO 163 1HB PRO 163 7.196 0.631 7.294 1184 HG2 PRO 163 2HG PRO 163 5.421 -1.621 8.176 1185 HG3 PRO 163 1HG PRO 163 6.136 -1.307 6.576 1186 HD2 PRO 163 2HD PRO 163 7.225 -3.061 8.399 1187 HD3 PRO 163 1HD PRO 163 8.179 -2.217 7.163 1188 H LEU 164 H LEU 164 6.302 1.818 10.688 1189 HA LEU 164 HA LEU 164 4.975 -0.062 12.558 1190 HB2 LEU 164 2HB LEU 164 6.551 1.476 13.710 1191 HB3 LEU 164 1HB LEU 164 5.739 2.858 12.995 1192 HG LEU 164 HG LEU 164 3.671 2.296 14.263 1193 HD11 LEU 164 1HD1 LEU 164 3.932 -0.115 14.496 1194 HD12 LEU 164 2HD1 LEU 164 3.712 0.633 16.074 1195 HD13 LEU 164 3HD1 LEU 164 5.319 0.110 15.567 1196 HD21 LEU 164 3HD2 LEU 164 6.131 2.641 16.018 1197 HD22 LEU 164 1HD2 LEU 164 4.467 2.992 16.494 1198 HD23 LEU 164 2HD2 LEU 164 5.230 3.929 15.214 1199 HA PRO 165 HA PRO 165 1.412 1.748 10.228 1200 HB2 PRO 165 2HB PRO 165 0.100 -0.827 10.954 1201 HB3 PRO 165 1HB PRO 165 0.342 -0.113 9.348 1202 HG2 PRO 165 2HG PRO 165 1.679 -2.318 10.140 1203 HG3 PRO 165 1HG PRO 165 2.399 -1.112 9.047 1204 HD2 PRO 165 2HD PRO 165 2.821 -1.457 12.014 1205 HD3 PRO 165 1HD PRO 165 4.016 -1.146 10.732 1206 HA PRO 166 HA PRO 166 -0.092 2.995 14.390 1207 HB2 PRO 166 2HB PRO 166 -2.083 4.710 13.401 1208 HB3 PRO 166 1HB PRO 166 -0.391 5.173 13.666 1209 HG2 PRO 166 2HG PRO 166 -1.739 4.324 11.130 1210 HG3 PRO 166 1HG PRO 166 -0.567 5.636 11.402 1211 HD2 PRO 166 2HD PRO 166 0.206 3.311 10.315 1212 HD3 PRO 166 1HD PRO 166 1.260 4.170 11.463 1213 H GLU 167 H GLU 167 -1.955 2.583 15.629 1214 HA GLU 167 HA GLU 167 -3.416 0.254 15.019 1215 HB2 GLU 167 2HB GLU 167 -4.044 2.372 17.113 1216 HB3 GLU 167 1HB GLU 167 -4.715 0.739 17.076 1217 HG2 GLU 167 2HG GLU 167 -2.478 -0.210 17.424 1218 HG3 GLU 167 1HG GLU 167 -1.776 1.410 17.419 1219 H SER 168 H SER 168 -4.045 3.552 14.252 1220 HA SER 168 HA SER 168 -6.874 3.459 13.987 1221 HB2 SER 168 2HB SER 168 -5.506 5.550 14.363 1222 HB3 SER 168 1HB SER 168 -4.959 5.439 12.693 1223 HG SER 168 HG SER 168 -7.250 5.507 12.119 1224 H ASN 169 H ASN 169 -4.313 2.336 11.869 1225 HA ASN 169 HA ASN 169 -6.116 2.314 9.528 1226 HB2 ASN 169 2HB ASN 169 -4.264 1.989 8.076 1227 HB3 ASN 169 1HB ASN 169 -3.731 3.185 9.240 1228 HD21 ASN 169 1HD2 ASN 169 -3.413 -0.189 8.258 1229 HD22 ASN 169 2HD2 ASN 169 -1.898 -0.463 9.043 1230 H TRP 170 H TRP 170 -5.791 0.417 12.069 1231 HA TRP 170 HA TRP 170 -5.399 -2.179 10.849 1232 HB2 TRP 170 2HB TRP 170 -6.324 -1.374 13.637 1233 HB3 TRP 170 1HB TRP 170 -6.125 -3.046 13.125 1234 HD1 TRP 170 HD1 TRP 170 -3.295 -1.204 11.635 1235 HE1 TRP 170 HE1 TRP 170 -1.191 -1.433 13.081 1236 HE3 TRP 170 HE3 TRP 170 -5.420 -3.039 15.917 1237 HZ2 TRP 170 HZ2 TRP 170 -0.497 -2.283 15.684 1238 HZ3 TRP 170 HZ3 TRP 170 -3.963 -3.536 17.839 1239 HH2 TRP 170 HH2 TRP 170 -1.551 -3.165 17.727 1240 H LEU 171 H LEU 171 -6.911 -3.148 9.691 1241 HA LEU 171 HA LEU 171 -9.724 -2.406 9.790 1242 HB2 LEU 171 2HB LEU 171 -8.528 -4.579 8.029 1243 HB3 LEU 171 1HB LEU 171 -9.958 -3.604 7.738 1244 HG LEU 171 HG LEU 171 -7.069 -2.664 7.525 1245 HD11 LEU 171 1HD1 LEU 171 -7.712 -4.149 5.692 1246 HD12 LEU 171 2HD1 LEU 171 -7.503 -2.500 5.109 1247 HD13 LEU 171 3HD1 LEU 171 -9.127 -3.149 5.349 1248 HD21 LEU 171 3HD2 LEU 171 -8.464 -0.802 8.284 1249 HD22 LEU 171 1HD2 LEU 171 -9.600 -1.083 6.959 1250 HD23 LEU 171 2HD2 LEU 171 -7.950 -0.555 6.618 1251 H GLU 172 H GLU 172 -11.041 -3.497 11.281 1252 HA GLU 172 HA GLU 172 -10.237 -6.158 12.232 1253 HB2 GLU 172 2HB GLU 172 -11.054 -4.350 13.818 1254 HB3 GLU 172 1HB GLU 172 -12.654 -4.506 13.095 1255 HG2 GLU 172 2HG GLU 172 -12.855 -6.795 13.868 1256 HG3 GLU 172 1HG GLU 172 -11.176 -6.816 14.405 1257 H THR 173 H THR 173 -10.557 -6.529 9.799 1258 HA THR 173 HA THR 173 -12.848 -8.227 9.451 1259 HB THR 173 HB THR 173 -13.811 -6.138 8.635 1260 HG1 THR 173 HG1 THR 173 -14.600 -7.601 7.310 1261 HG21 THR 173 3HG2 THR 173 -11.741 -4.879 8.113 1262 HG22 THR 173 1HG2 THR 173 -12.881 -4.856 6.764 1263 HG23 THR 173 2HG2 THR 173 -11.472 -5.914 6.709 1264 H ALA 174 H ALA 174 -12.509 -9.708 7.670 1265 HA ALA 174 HA ALA 174 -9.671 -10.195 7.107 1266 HB1 ALA 174 3HB ALA 174 -12.124 -11.898 6.512 1267 HB2 ALA 174 1HB ALA 174 -11.045 -12.084 7.896 1268 HB3 ALA 174 2HB ALA 174 -10.446 -12.385 6.263 1269 H VAL 175 H VAL 175 -8.799 -9.422 5.284 1270 HA VAL 175 HA VAL 175 -10.477 -8.560 3.024 1271 HB VAL 175 HB VAL 175 -7.494 -8.097 3.562 1272 HG11 VAL 175 1HG1 VAL 175 -7.514 -6.568 1.612 1273 HG12 VAL 175 2HG1 VAL 175 -9.182 -7.030 1.261 1274 HG13 VAL 175 3HG1 VAL 175 -7.891 -8.225 1.136 1275 HG21 VAL 175 3HG2 VAL 175 -9.845 -6.157 3.669 1276 HG22 VAL 175 1HG2 VAL 175 -8.146 -5.734 3.919 1277 HG23 VAL 175 2HG2 VAL 175 -8.964 -6.803 5.056 1278 H THR 176 H THR 176 -11.082 -10.570 2.271 1279 HA THR 176 HA THR 176 -9.025 -12.354 1.173 1280 HB THR 176 HB THR 176 -10.877 -13.964 0.870 1281 HG1 THR 176 HG1 THR 176 -12.428 -11.755 1.145 1282 HG21 THR 176 3HG2 THR 176 -9.765 -13.913 3.084 1283 HG22 THR 176 1HG2 THR 176 -11.470 -14.348 3.240 1284 HG23 THR 176 2HG2 THR 176 -10.935 -12.717 3.648 1285 H ALA 177 H ALA 177 -8.326 -11.572 -0.717 1286 HA ALA 177 HA ALA 177 -10.187 -11.091 -2.938 1287 HB1 ALA 177 3HB ALA 177 -9.809 -8.865 -1.954 1288 HB2 ALA 177 1HB ALA 177 -9.045 -8.983 -3.540 1289 HB3 ALA 177 2HB ALA 177 -8.063 -9.090 -2.076 1290 H GLY 178 H GLY 178 -9.302 -11.682 -4.929 1291 HA2 GLY 178 2HA GLY 178 -8.058 -13.074 -6.266 1292 HA3 GLY 178 1HA GLY 178 -6.700 -12.150 -5.652 1293 H GLU 179 H GLU 179 -5.262 -13.881 -5.654 1294 HA GLU 179 HA GLU 179 -5.792 -16.239 -4.012 1295 HB2 GLU 179 2HB GLU 179 -4.543 -16.372 -6.223 1296 HB3 GLU 179 1HB GLU 179 -3.225 -15.478 -5.482 1297 HG2 GLU 179 2HG GLU 179 -2.770 -17.896 -5.578 1298 HG3 GLU 179 1HG GLU 179 -2.802 -17.295 -3.920 1299 H ARG 180 H ARG 180 -4.179 -16.889 -2.354 1300 HA ARG 180 HA ARG 180 -2.811 -14.761 -0.884 1301 HB2 ARG 180 2HB ARG 180 -3.925 -15.146 1.201 1302 HB3 ARG 180 1HB ARG 180 -5.214 -14.974 0.025 1303 HG2 ARG 180 2HG ARG 180 -4.206 -17.634 1.116 1304 HG3 ARG 180 1HG ARG 180 -5.633 -16.779 1.698 1305 HD2 ARG 180 2HD ARG 180 -5.265 -17.843 -1.127 1306 HD3 ARG 180 1HD ARG 180 -6.200 -18.628 0.150 1307 HE ARG 180 HE ARG 180 -7.350 -16.223 0.061 1308 HH11 ARG 180 1HH1 ARG 180 -6.596 -18.413 -2.602 1309 HH12 ARG 180 2HH1 ARG 180 -7.923 -17.855 -3.566 1310 HH21 ARG 180 1HH2 ARG 180 -9.081 -15.561 -1.178 1311 HH22 ARG 180 2HH2 ARG 180 -9.333 -16.234 -2.755 1312 H THR 181 H THR 181 -0.974 -15.628 0.306 1313 HA THR 181 HA THR 181 -0.086 -18.213 -0.027 1314 HB THR 181 HB THR 181 1.380 -16.449 0.822 1315 HG1 THR 181 HG1 THR 181 1.848 -18.039 2.923 1316 HG21 THR 181 3HG2 THR 181 1.397 -15.755 3.184 1317 HG22 THR 181 1HG2 THR 181 -0.059 -16.705 3.490 1318 HG23 THR 181 2HG2 THR 181 -0.125 -15.305 2.417 1319 H ASP 182 H ASP 182 -1.036 -20.011 0.424 1320 HA ASP 182 HA ASP 182 -2.725 -20.412 2.830 1321 HB2 ASP 182 2HB ASP 182 -3.819 -20.838 0.634 1322 HB3 ASP 182 1HB ASP 182 -2.610 -22.060 0.259 1323 H LEU 183 H LEU 183 -2.530 -22.377 4.025 1324 HA LEU 183 HA LEU 183 0.156 -22.995 4.723 1325 HB2 LEU 183 2HB LEU 183 -0.713 -24.344 6.496 1326 HB3 LEU 183 1HB LEU 183 -1.714 -22.913 6.386 1327 HG LEU 183 HG LEU 183 -2.525 -25.621 5.259 1328 HD11 LEU 183 1HD1 LEU 183 -3.952 -25.943 7.209 1329 HD12 LEU 183 2HD1 LEU 183 -3.358 -24.441 7.922 1330 HD13 LEU 183 3HD1 LEU 183 -2.261 -25.805 7.695 1331 HD21 LEU 183 3HD2 LEU 183 -3.730 -23.755 4.211 1332 HD22 LEU 183 1HD2 LEU 183 -4.233 -23.167 5.801 1333 HD23 LEU 183 2HD2 LEU 183 -4.810 -24.727 5.205 1334 H GLU 184 H GLU 184 -2.153 -24.541 2.635 1335 HA GLU 184 HA GLU 184 -0.414 -26.919 2.257 1336 HB2 GLU 184 2HB GLU 184 -3.392 -26.571 1.691 1337 HB3 GLU 184 1HB GLU 184 -2.469 -28.030 1.341 1338 HG2 GLU 184 2HG GLU 184 -3.013 -26.862 4.087 1339 HG3 GLU 184 1HG GLU 184 -3.790 -28.275 3.382 1340 H HIS 185 H HIS 185 -0.352 -27.764 0.036 1341 HA HIS 185 HA HIS 185 -0.280 -25.668 -2.036 1342 HB2 HIS 185 2HB HIS 185 0.823 -28.516 -2.018 1343 HB3 HIS 185 1HB HIS 185 0.931 -27.420 -3.391 1344 HD1 HIS 185 HD1 HIS 185 2.835 -28.525 -0.578 1345 HD2 HIS 185 HD2 HIS 185 2.419 -24.927 -2.604 1346 HE1 HIS 185 HE1 HIS 185 4.885 -27.196 -0.008 1347 HE2 HIS 185 HE2 HIS 185 4.731 -25.144 -1.460 Start of MODEL 4 1 H1 MET 1 1H MET 1 -19.529 4.938 -19.308 2 H2 MET 1 2H MET 1 -19.975 6.566 -19.198 3 H3 MET 1 3H MET 1 -19.849 5.622 -17.798 4 HA MET 1 HA MET 1 -17.604 6.256 -19.607 5 HB2 MET 1 2HB MET 1 -18.444 8.284 -18.463 6 HB3 MET 1 1HB MET 1 -18.337 7.474 -16.910 7 HG2 MET 1 2HG MET 1 -15.903 7.443 -17.045 8 HG3 MET 1 1HG MET 1 -15.957 8.111 -18.681 9 HE1 MET 1 3HE MET 1 -14.244 9.374 -16.179 10 HE2 MET 1 1HE MET 1 -14.535 11.092 -16.449 11 HE3 MET 1 2HE MET 1 -14.191 10.031 -17.815 12 H ASP 2 H ASP 2 -16.847 4.189 -19.610 13 HA ASP 2 HA ASP 2 -16.068 2.877 -17.061 14 HB2 ASP 2 2HB ASP 2 -16.122 1.710 -19.882 15 HB3 ASP 2 1HB ASP 2 -15.860 0.824 -18.385 16 H GLU 3 H GLU 3 -14.906 4.682 -19.604 17 HA GLU 3 HA GLU 3 -12.398 3.864 -20.241 18 HB2 GLU 3 2HB GLU 3 -13.376 6.727 -19.916 19 HB3 GLU 3 1HB GLU 3 -11.865 6.289 -20.705 20 HG2 GLU 3 2HG GLU 3 -13.497 6.733 -22.411 21 HG3 GLU 3 1HG GLU 3 -13.162 5.005 -22.410 22 H ASP 4 H ASP 4 -13.327 5.371 -17.219 23 HA ASP 4 HA ASP 4 -10.698 5.976 -16.261 24 HB2 ASP 4 2HB ASP 4 -11.768 6.230 -14.049 25 HB3 ASP 4 1HB ASP 4 -12.719 7.040 -15.287 26 H THR 5 H THR 5 -12.799 3.114 -16.088 27 HA THR 5 HA THR 5 -11.157 1.720 -14.164 28 HB THR 5 HB THR 5 -13.578 0.742 -15.748 29 HG1 THR 5 HG1 THR 5 -13.820 2.674 -14.297 30 HG21 THR 5 3HG2 THR 5 -13.843 -0.858 -13.862 31 HG22 THR 5 1HG2 THR 5 -12.315 -0.289 -13.174 32 HG23 THR 5 2HG2 THR 5 -12.333 -1.121 -14.729 33 H GLU 6 H GLU 6 -11.592 1.652 -17.719 34 HA GLU 6 HA GLU 6 -9.931 -0.665 -18.111 35 HB2 GLU 6 2HB GLU 6 -10.002 -0.203 -20.457 36 HB3 GLU 6 1HB GLU 6 -11.592 0.195 -19.820 37 HG2 GLU 6 2HG GLU 6 -11.019 2.586 -19.855 38 HG3 GLU 6 1HG GLU 6 -9.412 2.202 -20.466 39 H ASP 7 H ASP 7 -9.361 2.736 -17.713 40 HA ASP 7 HA ASP 7 -6.558 2.788 -18.429 41 HB2 ASP 7 2HB ASP 7 -7.862 4.868 -18.456 42 HB3 ASP 7 1HB ASP 7 -8.245 4.686 -16.753 43 H TRP 8 H TRP 8 -8.446 2.357 -15.494 44 HA TRP 8 HA TRP 8 -6.396 1.987 -13.613 45 HB2 TRP 8 2HB TRP 8 -8.653 2.321 -12.865 46 HB3 TRP 8 1HB TRP 8 -9.245 0.955 -13.794 47 HD1 TRP 8 HD1 TRP 8 -7.089 1.650 -10.630 48 HE1 TRP 8 HE1 TRP 8 -7.326 -0.373 -9.069 49 HE3 TRP 8 HE3 TRP 8 -9.892 -1.427 -13.630 50 HZ2 TRP 8 HZ2 TRP 8 -8.535 -2.916 -9.065 51 HZ3 TRP 8 HZ3 TRP 8 -10.558 -3.639 -12.764 52 HH2 TRP 8 HH2 TRP 8 -9.889 -4.367 -10.523 53 H GLU 9 H GLU 9 -7.899 -0.268 -15.908 54 HA GLU 9 HA GLU 9 -6.523 -2.629 -15.057 55 HB2 GLU 9 2HB GLU 9 -8.639 -2.636 -16.385 56 HB3 GLU 9 1HB GLU 9 -7.770 -1.972 -17.762 57 HG2 GLU 9 2HG GLU 9 -6.384 -4.033 -17.852 58 HG3 GLU 9 1HG GLU 9 -7.303 -4.694 -16.499 59 H THR 10 H THR 10 -5.873 -0.091 -17.421 60 HA THR 10 HA THR 10 -3.613 -1.167 -18.702 61 HB THR 10 HB THR 10 -4.326 1.786 -18.274 62 HG1 THR 10 HG1 THR 10 -5.050 1.287 -20.608 63 HG21 THR 10 3HG2 THR 10 -1.985 1.465 -19.095 64 HG22 THR 10 1HG2 THR 10 -3.014 2.204 -20.320 65 HG23 THR 10 2HG2 THR 10 -2.598 0.493 -20.436 66 H GLN 11 H GLN 11 -3.816 1.120 -15.906 67 HA GLN 11 HA GLN 11 -1.013 1.150 -15.387 68 HB2 GLN 11 2HB GLN 11 -1.547 2.284 -13.275 69 HB3 GLN 11 1HB GLN 11 -2.455 2.987 -14.609 70 HG2 GLN 11 2HG GLN 11 -4.480 1.858 -13.900 71 HG3 GLN 11 1HG GLN 11 -3.601 0.973 -12.656 72 HE21 GLN 11 1HE2 GLN 11 -4.964 1.763 -11.017 73 HE22 GLN 11 2HE2 GLN 11 -4.893 3.398 -10.469 74 H LEU 12 H LEU 12 -3.563 -1.055 -14.468 75 HA LEU 12 HA LEU 12 -2.388 -2.310 -12.216 76 HB2 LEU 12 2HB LEU 12 -4.671 -2.719 -12.454 77 HB3 LEU 12 1HB LEU 12 -4.563 -2.925 -14.190 78 HG LEU 12 HG LEU 12 -3.560 -5.205 -13.816 79 HD11 LEU 12 1HD1 LEU 12 -3.815 -6.299 -11.617 80 HD12 LEU 12 2HD1 LEU 12 -4.250 -4.745 -10.908 81 HD13 LEU 12 3HD1 LEU 12 -2.642 -4.982 -11.584 82 HD21 LEU 12 3HD2 LEU 12 -6.319 -4.757 -12.646 83 HD22 LEU 12 1HD2 LEU 12 -5.691 -6.280 -13.284 84 HD23 LEU 12 2HD2 LEU 12 -5.921 -4.905 -14.362 85 H GLN 13 H GLN 13 -2.470 -3.330 -15.678 86 HA GLN 13 HA GLN 13 -0.739 -5.559 -15.276 87 HB2 GLN 13 2HB GLN 13 -0.668 -5.738 -17.726 88 HB3 GLN 13 1HB GLN 13 -2.312 -5.503 -17.150 89 HG2 GLN 13 2HG GLN 13 -2.136 -3.090 -17.767 90 HG3 GLN 13 1HG GLN 13 -0.545 -3.417 -18.449 91 HE21 GLN 13 1HE2 GLN 13 -1.352 -6.036 -19.580 92 HE22 GLN 13 2HE2 GLN 13 -2.341 -5.662 -20.940 93 H ALA 14 H ALA 14 -0.173 -2.171 -15.835 94 HA ALA 14 HA ALA 14 2.605 -2.300 -16.472 95 HB1 ALA 14 3HB ALA 14 1.030 -0.059 -15.148 96 HB2 ALA 14 1HB ALA 14 1.269 -0.276 -16.882 97 HB3 ALA 14 2HB ALA 14 2.648 0.086 -15.844 98 H ASN 15 H ASN 15 0.800 -1.911 -13.401 99 HA ASN 15 HA ASN 15 2.875 -1.665 -11.576 100 HB2 ASN 15 2HB ASN 15 0.147 -2.981 -11.224 101 HB3 ASN 15 1HB ASN 15 1.258 -2.744 -9.880 102 HD21 ASN 15 1HD2 ASN 15 -1.436 -1.650 -10.316 103 HD22 ASN 15 2HD2 ASN 15 -1.265 0.068 -10.245 104 H ARG 16 H ARG 16 1.138 -4.756 -12.226 105 HA ARG 16 HA ARG 16 2.916 -6.356 -10.718 106 HB2 ARG 16 2HB ARG 16 1.845 -8.331 -12.035 107 HB3 ARG 16 1HB ARG 16 0.816 -7.349 -11.005 108 HG2 ARG 16 2HG ARG 16 -0.077 -6.162 -12.916 109 HG3 ARG 16 1HG ARG 16 1.050 -6.976 -14.003 110 HD2 ARG 16 2HD ARG 16 -1.325 -7.866 -14.017 111 HD3 ARG 16 1HD ARG 16 -0.070 -9.072 -13.757 112 HE ARG 16 HE ARG 16 -0.757 -8.574 -11.244 113 HH11 ARG 16 1HH1 ARG 16 -2.895 -9.128 -13.999 114 HH12 ARG 16 2HH1 ARG 16 -4.145 -9.828 -13.021 115 HH21 ARG 16 1HH2 ARG 16 -2.388 -9.572 -10.006 116 HH22 ARG 16 2HH2 ARG 16 -3.861 -10.080 -10.775 117 H ASP 17 H ASP 17 3.141 -5.321 -14.039 118 HA ASP 17 HA ASP 17 5.213 -7.006 -14.964 119 HB2 ASP 17 2HB ASP 17 3.952 -5.748 -16.555 120 HB3 ASP 17 1HB ASP 17 4.247 -4.228 -15.725 121 H GLU 18 H GLU 18 5.517 -3.588 -13.835 122 HA GLU 18 HA GLU 18 8.417 -3.830 -13.905 123 HB2 GLU 18 2HB GLU 18 8.457 -1.409 -13.625 124 HB3 GLU 18 1HB GLU 18 7.312 -1.870 -14.876 125 HG2 GLU 18 2HG GLU 18 5.481 -1.630 -13.093 126 HG3 GLU 18 1HG GLU 18 6.703 -0.858 -12.088 127 H LYS 19 H LYS 19 5.981 -3.955 -11.473 128 HA LYS 19 HA LYS 19 7.626 -3.204 -9.235 129 HB2 LYS 19 2HB LYS 19 5.010 -3.228 -9.376 130 HB3 LYS 19 1HB LYS 19 5.136 -4.945 -9.021 131 HG2 LYS 19 2HG LYS 19 4.695 -3.807 -6.959 132 HG3 LYS 19 1HG LYS 19 6.382 -4.330 -6.904 133 HD2 LYS 19 2HD LYS 19 7.118 -2.050 -7.520 134 HD3 LYS 19 1HD LYS 19 5.435 -1.528 -7.632 135 HE2 LYS 19 2HE LYS 19 5.144 -2.004 -5.212 136 HE3 LYS 19 1HE LYS 19 6.846 -2.470 -5.112 137 HZ1 LYS 19 3HZ LYS 19 5.836 0.208 -5.909 138 HZ2 LYS 19 1HZ LYS 19 7.462 -0.232 -5.769 139 HZ3 LYS 19 2HZ LYS 19 6.475 -0.186 -4.397 140 H ASP 20 H ASP 20 6.938 -6.166 -11.002 141 HA ASP 20 HA ASP 20 8.125 -8.029 -9.235 142 HB2 ASP 20 2HB ASP 20 6.768 -8.822 -11.130 143 HB3 ASP 20 1HB ASP 20 7.931 -8.166 -12.278 144 H ARG 21 H ARG 21 9.492 -6.028 -11.857 145 HA ARG 21 HA ARG 21 12.116 -7.268 -11.594 146 HB2 ARG 21 2HB ARG 21 12.862 -5.902 -13.423 147 HB3 ARG 21 1HB ARG 21 11.284 -6.550 -13.842 148 HG2 ARG 21 2HG ARG 21 10.234 -4.390 -13.378 149 HG3 ARG 21 1HG ARG 21 11.781 -3.728 -12.840 150 HD2 ARG 21 2HD ARG 21 11.315 -2.994 -15.119 151 HD3 ARG 21 1HD ARG 21 12.705 -4.081 -15.109 152 HE ARG 21 HE ARG 21 11.421 -5.744 -16.172 153 HH11 ARG 21 1HH1 ARG 21 9.524 -2.832 -15.683 154 HH12 ARG 21 2HH1 ARG 21 8.278 -3.315 -16.791 155 HH21 ARG 21 1HH2 ARG 21 9.744 -6.381 -17.592 156 HH22 ARG 21 2HH2 ARG 21 8.401 -5.314 -17.869 157 H PHE 22 H PHE 22 10.449 -4.500 -10.306 158 HA PHE 22 HA PHE 22 12.662 -3.124 -9.221 159 HB2 PHE 22 2HB PHE 22 10.295 -2.268 -9.237 160 HB3 PHE 22 1HB PHE 22 9.878 -3.443 -7.994 161 HD1 PHE 22 HD2 PHE 22 10.695 -3.142 -5.666 162 HD2 PHE 22 HD1 PHE 22 11.634 -0.277 -8.696 163 HE1 PHE 22 HE2 PHE 22 11.398 -1.543 -3.939 164 HE2 PHE 22 HE1 PHE 22 12.345 1.311 -6.957 165 HZ PHE 22 HZ PHE 22 12.223 0.683 -4.584 166 H PHE 23 H PHE 23 10.720 -5.855 -7.992 167 HA PHE 23 HA PHE 23 12.368 -6.255 -5.621 168 HB2 PHE 23 2HB PHE 23 10.053 -7.818 -6.814 169 HB3 PHE 23 1HB PHE 23 10.915 -8.352 -5.383 170 HD1 PHE 23 HD2 PHE 23 9.805 -4.826 -6.162 171 HD2 PHE 23 HD1 PHE 23 9.209 -8.332 -3.795 172 HE1 PHE 23 HE2 PHE 23 8.184 -3.621 -4.745 173 HE2 PHE 23 HE1 PHE 23 7.605 -7.125 -2.397 174 HZ PHE 23 HZ PHE 23 7.099 -4.784 -2.858 175 H SER 24 H SER 24 12.723 -7.143 -8.884 176 HA SER 24 HA SER 24 14.208 -9.637 -8.279 177 HB2 SER 24 2HB SER 24 13.254 -8.519 -10.956 178 HB3 SER 24 1HB SER 24 14.129 -10.038 -10.751 179 HG SER 24 HG SER 24 11.525 -9.624 -10.561 180 H GLU 25 H GLU 25 14.650 -6.550 -10.055 181 HA GLU 25 HA GLU 25 17.468 -7.262 -10.611 182 HB2 GLU 25 2HB GLU 25 15.698 -5.220 -12.045 183 HB3 GLU 25 1HB GLU 25 17.304 -5.744 -12.531 184 HG2 GLU 25 2HG GLU 25 14.828 -7.489 -12.475 185 HG3 GLU 25 1HG GLU 25 15.523 -6.752 -13.915 186 H HIS 26 H HIS 26 15.324 -4.585 -9.613 187 HA HIS 26 HA HIS 26 17.440 -2.692 -9.128 188 HB2 HIS 26 2HB HIS 26 15.200 -1.853 -9.626 189 HB3 HIS 26 1HB HIS 26 14.513 -2.705 -8.243 190 HD2 HIS 26 HD2 HIS 26 16.876 0.402 -8.912 191 HE1 HIS 26 HE1 HIS 26 15.364 0.576 -4.967 192 HE2 HIS 26 HE2 HIS 26 16.646 1.823 -6.758 193 H ARG 27 H ARG 27 15.412 -4.743 -7.041 194 HA ARG 27 HA ARG 27 17.511 -4.764 -4.961 195 HB2 ARG 27 2HB ARG 27 14.497 -4.501 -4.504 196 HB3 ARG 27 1HB ARG 27 15.636 -4.928 -3.233 197 HG2 ARG 27 2HG ARG 27 15.611 -2.330 -4.787 198 HG3 ARG 27 1HG ARG 27 15.016 -2.549 -3.143 199 HD2 ARG 27 2HD ARG 27 17.222 -2.912 -2.288 200 HD3 ARG 27 1HD ARG 27 17.894 -3.136 -3.907 201 HE ARG 27 HE ARG 27 16.720 -0.523 -3.381 202 HH11 ARG 27 1HH1 ARG 27 19.704 -2.420 -3.412 203 HH12 ARG 27 2HH1 ARG 27 20.723 -1.021 -3.515 204 HH21 ARG 27 1HH2 ARG 27 18.071 1.280 -3.577 205 HH22 ARG 27 2HH2 ARG 27 19.799 1.080 -3.609 206 H GLN 28 H GLN 28 17.634 -6.714 -3.809 207 HA GLN 28 HA GLN 28 17.017 -9.140 -5.088 208 HB2 GLN 28 2HB GLN 28 17.914 -10.230 -3.147 209 HB3 GLN 28 1HB GLN 28 18.843 -8.753 -3.342 210 HG2 GLN 28 2HG GLN 28 16.611 -9.192 -1.333 211 HG3 GLN 28 1HG GLN 28 18.330 -9.228 -0.978 212 HE21 GLN 28 1HE2 GLN 28 16.171 -7.557 0.108 213 HE22 GLN 28 2HE2 GLN 28 16.687 -5.925 -0.113 214 H SER 29 H SER 29 15.319 -10.576 -4.858 215 HA SER 29 HA SER 29 12.783 -9.813 -4.083 216 HB2 SER 29 2HB SER 29 13.878 -12.655 -4.166 217 HB3 SER 29 1HB SER 29 12.163 -12.227 -4.165 218 HG SER 29 HG SER 29 13.514 -10.871 -6.087 219 HA PRO 30 HA PRO 30 13.059 -9.973 0.489 220 HB2 PRO 30 2HB PRO 30 10.422 -9.362 1.013 221 HB3 PRO 30 1HB PRO 30 11.607 -8.129 0.535 222 HG2 PRO 30 2HG PRO 30 9.590 -9.549 -1.172 223 HG3 PRO 30 1HG PRO 30 10.002 -7.819 -1.122 224 HD2 PRO 30 2HD PRO 30 10.993 -9.440 -3.044 225 HD3 PRO 30 1HD PRO 30 11.953 -8.102 -2.376 226 H ILE 31 H ILE 31 10.710 -11.686 -1.520 227 HA ILE 31 HA ILE 31 9.837 -13.621 0.360 228 HB ILE 31 HB ILE 31 10.128 -14.170 -2.632 229 HG12 ILE 31 2HG1 ILE 31 9.039 -11.960 -2.409 230 HG13 ILE 31 1HG1 ILE 31 7.925 -13.159 -3.041 231 HG21 ILE 31 1HG2 ILE 31 8.092 -15.165 -0.602 232 HG22 ILE 31 2HG2 ILE 31 9.443 -16.089 -1.257 233 HG23 ILE 31 3HG2 ILE 31 8.129 -15.589 -2.319 234 HD11 ILE 31 3HD1 ILE 31 6.879 -13.307 -0.808 235 HD12 ILE 31 1HD1 ILE 31 6.811 -11.688 -1.506 236 HD13 ILE 31 2HD1 ILE 31 7.978 -12.050 -0.237 237 HA PRO 32 HA PRO 32 13.921 -15.579 0.975 238 HB2 PRO 32 2HB PRO 32 12.143 -17.822 1.980 239 HB3 PRO 32 1HB PRO 32 13.585 -17.102 2.735 240 HG2 PRO 32 2HG PRO 32 11.194 -16.465 3.644 241 HG3 PRO 32 1HG PRO 32 12.431 -15.198 3.453 242 HD2 PRO 32 2HD PRO 32 10.062 -15.805 1.695 243 HD3 PRO 32 1HD PRO 32 10.736 -14.232 2.176 244 HA PRO 33 HA PRO 33 14.691 -18.009 -2.697 245 HB2 PRO 33 2HB PRO 33 16.509 -19.667 -0.923 246 HB3 PRO 33 1HB PRO 33 16.859 -18.886 -2.484 247 HG2 PRO 33 2HG PRO 33 17.751 -17.802 -0.239 248 HG3 PRO 33 1HG PRO 33 17.104 -16.768 -1.536 249 HD2 PRO 33 2HD PRO 33 15.824 -17.568 1.062 250 HD3 PRO 33 1HD PRO 33 15.744 -16.022 0.189 251 H GLU 34 H GLU 34 14.219 -19.857 0.285 252 HA GLU 34 HA GLU 34 13.442 -22.328 -0.981 253 HB2 GLU 34 2HB GLU 34 13.123 -21.399 1.904 254 HB3 GLU 34 1HB GLU 34 12.945 -23.058 1.337 255 HG2 GLU 34 2HG GLU 34 15.289 -23.228 0.826 256 HG3 GLU 34 1HG GLU 34 15.532 -21.499 1.068 257 H GLU 35 H GLU 35 11.745 -19.604 0.565 258 HA GLU 35 HA GLU 35 9.151 -20.560 0.560 259 HB2 GLU 35 2HB GLU 35 10.057 -18.476 1.688 260 HB3 GLU 35 1HB GLU 35 10.010 -17.671 0.127 261 HG2 GLU 35 2HG GLU 35 8.079 -17.026 1.424 262 HG3 GLU 35 1HG GLU 35 7.546 -18.006 0.059 263 H ARG 36 H ARG 36 10.771 -18.554 -1.943 264 HA ARG 36 HA ARG 36 8.502 -18.638 -3.724 265 HB2 ARG 36 2HB ARG 36 9.938 -17.288 -5.239 266 HB3 ARG 36 1HB ARG 36 9.833 -16.607 -3.621 267 HG2 ARG 36 2HG ARG 36 12.071 -17.591 -3.098 268 HG3 ARG 36 1HG ARG 36 12.181 -18.158 -4.765 269 HD2 ARG 36 2HD ARG 36 11.961 -15.261 -3.877 270 HD3 ARG 36 1HD ARG 36 13.423 -16.059 -4.458 271 HE ARG 36 HE ARG 36 11.006 -15.657 -6.128 272 HH11 ARG 36 1HH1 ARG 36 14.514 -15.550 -5.815 273 HH12 ARG 36 2HH1 ARG 36 14.755 -15.085 -7.467 274 HH21 ARG 36 1HH2 ARG 36 11.339 -15.074 -8.269 275 HH22 ARG 36 2HH2 ARG 36 12.948 -14.816 -8.857 276 H ASP 37 H ASP 37 10.837 -20.914 -3.050 277 HA ASP 37 HA ASP 37 11.052 -22.025 -5.744 278 HB2 ASP 37 2HB ASP 37 12.968 -22.248 -4.188 279 HB3 ASP 37 1HB ASP 37 11.971 -23.152 -3.054 280 H ASP 38 H ASP 38 9.620 -23.011 -2.602 281 HA ASP 38 HA ASP 38 8.222 -25.291 -3.736 282 HB2 ASP 38 2HB ASP 38 9.113 -25.392 -1.454 283 HB3 ASP 38 1HB ASP 38 8.128 -24.022 -0.963 284 H PHE 39 H PHE 39 7.321 -22.113 -2.501 285 HA PHE 39 HA PHE 39 4.614 -22.296 -3.667 286 HB2 PHE 39 2HB PHE 39 5.852 -20.295 -1.716 287 HB3 PHE 39 1HB PHE 39 4.303 -20.019 -2.507 288 HD1 PHE 39 HD1 PHE 39 6.075 -22.125 -0.024 289 HD2 PHE 39 HD2 PHE 39 2.297 -21.191 -1.786 290 HE1 PHE 39 HE1 PHE 39 4.926 -23.358 1.776 291 HE2 PHE 39 HE2 PHE 39 1.156 -22.419 0.017 292 HZ PHE 39 HZ PHE 39 2.464 -23.499 1.799 293 H ASP 40 H ASP 40 3.957 -20.209 -4.876 294 HA ASP 40 HA ASP 40 5.828 -19.753 -7.009 295 HB2 ASP 40 2HB ASP 40 3.376 -19.867 -7.421 296 HB3 ASP 40 1HB ASP 40 3.121 -18.469 -6.385 297 H GLY 41 H GLY 41 6.403 -17.492 -7.651 298 HA2 GLY 41 2HA GLY 41 7.996 -16.147 -5.825 299 HA3 GLY 41 1HA GLY 41 7.477 -15.517 -7.369 300 H LEU 42 H LEU 42 7.355 -13.446 -6.685 301 HA LEU 42 HA LEU 42 6.464 -12.316 -4.317 302 HB2 LEU 42 2HB LEU 42 6.031 -11.075 -7.063 303 HB3 LEU 42 1HB LEU 42 6.169 -10.213 -5.539 304 HG LEU 42 HG LEU 42 8.426 -11.764 -6.860 305 HD11 LEU 42 1HD1 LEU 42 7.783 -9.835 -8.200 306 HD12 LEU 42 2HD1 LEU 42 9.363 -9.600 -7.460 307 HD13 LEU 42 3HD1 LEU 42 7.950 -8.780 -6.790 308 HD21 LEU 42 3HD2 LEU 42 9.896 -10.604 -5.232 309 HD22 LEU 42 1HD2 LEU 42 8.731 -11.665 -4.444 310 HD23 LEU 42 2HD2 LEU 42 8.470 -9.921 -4.444 311 H SER 43 H SER 43 4.544 -12.962 -3.367 312 HA SER 43 HA SER 43 2.171 -13.602 -4.772 313 HB2 SER 43 2HB SER 43 2.463 -12.865 -1.824 314 HB3 SER 43 1HB SER 43 1.135 -13.778 -2.550 315 HG SER 43 HG SER 43 2.985 -15.226 -3.260 316 H TYR 44 H TYR 44 0.926 -12.221 -5.826 317 HA TYR 44 HA TYR 44 0.481 -9.466 -4.811 318 HB2 TYR 44 2HB TYR 44 1.925 -9.496 -6.852 319 HB3 TYR 44 1HB TYR 44 0.680 -10.389 -7.721 320 HD1 TYR 44 HD1 TYR 44 0.765 -7.258 -5.595 321 HD2 TYR 44 HD2 TYR 44 -0.461 -9.023 -9.293 322 HE1 TYR 44 HE1 TYR 44 -0.174 -5.109 -6.319 323 HE2 TYR 44 HE2 TYR 44 -1.400 -6.863 -10.009 324 HH TYR 44 HH TYR 44 -0.811 -3.929 -8.267 325 H PHE 45 H PHE 45 -1.624 -8.731 -4.932 326 HA PHE 45 HA PHE 45 -3.674 -10.791 -5.111 327 HB2 PHE 45 2HB PHE 45 -3.989 -7.852 -4.356 328 HB3 PHE 45 1HB PHE 45 -5.147 -9.151 -4.061 329 HD1 PHE 45 HD1 PHE 45 -3.832 -11.308 -2.832 330 HD2 PHE 45 HD2 PHE 45 -2.893 -7.161 -2.394 331 HE1 PHE 45 HE1 PHE 45 -2.732 -11.780 -0.681 332 HE2 PHE 45 HE2 PHE 45 -1.803 -7.643 -0.245 333 HZ PHE 45 HZ PHE 45 -1.713 -9.949 0.614 334 H ASP 46 H ASP 46 -5.451 -10.658 -6.477 335 HA ASP 46 HA ASP 46 -4.863 -9.525 -9.113 336 HB2 ASP 46 2HB ASP 46 -5.057 -12.037 -8.773 337 HB3 ASP 46 1HB ASP 46 -6.730 -11.812 -8.294 338 HA PRO 47 HA PRO 47 -8.061 -6.396 -8.914 339 HB2 PRO 47 2HB PRO 47 -9.340 -6.904 -11.420 340 HB3 PRO 47 1HB PRO 47 -7.949 -5.838 -11.145 341 HG2 PRO 47 2HG PRO 47 -7.972 -8.717 -12.003 342 HG3 PRO 47 1HG PRO 47 -6.988 -7.364 -12.614 343 HD2 PRO 47 2HD PRO 47 -5.844 -9.057 -10.969 344 HD3 PRO 47 1HD PRO 47 -5.625 -7.317 -10.658 345 H ASP 48 H ASP 48 -9.493 -6.967 -7.286 346 HA ASP 48 HA ASP 48 -12.059 -8.186 -8.112 347 HB2 ASP 48 2HB ASP 48 -10.914 -7.494 -5.367 348 HB3 ASP 48 1HB ASP 48 -12.620 -7.864 -5.600 349 HA PRO 49 HA PRO 49 -12.812 -3.612 -8.843 350 HB2 PRO 49 2HB PRO 49 -15.221 -4.900 -10.152 351 HB3 PRO 49 1HB PRO 49 -14.177 -3.588 -10.748 352 HG2 PRO 49 2HG PRO 49 -13.929 -6.019 -11.758 353 HG3 PRO 49 1HG PRO 49 -12.473 -5.054 -11.408 354 HD2 PRO 49 2HD PRO 49 -13.655 -7.336 -9.830 355 HD3 PRO 49 1HD PRO 49 -11.949 -6.967 -10.178 356 H ASP 50 H ASP 50 -15.229 -6.062 -7.847 357 HA ASP 50 HA ASP 50 -17.068 -4.269 -6.634 358 HB2 ASP 50 2HB ASP 50 -17.723 -6.494 -7.451 359 HB3 ASP 50 1HB ASP 50 -16.686 -7.270 -6.264 360 H TYR 51 H TYR 51 -14.118 -5.693 -5.414 361 HA TYR 51 HA TYR 51 -14.889 -5.334 -2.608 362 HB2 TYR 51 2HB TYR 51 -13.402 -7.286 -3.677 363 HB3 TYR 51 1HB TYR 51 -12.084 -6.153 -3.412 364 HD1 TYR 51 HD1 TYR 51 -14.594 -8.300 -1.806 365 HD2 TYR 51 HD2 TYR 51 -11.387 -5.573 -1.062 366 HE1 TYR 51 HE1 TYR 51 -14.536 -9.016 0.531 367 HE2 TYR 51 HE2 TYR 51 -11.325 -6.316 1.288 368 HH TYR 51 HH TYR 51 -12.762 -7.369 2.908 369 H ARG 52 H ARG 52 -13.357 -3.578 -5.082 370 HA ARG 52 HA ARG 52 -11.544 -1.895 -3.697 371 HB2 ARG 52 2HB ARG 52 -11.729 -2.318 -6.208 372 HB3 ARG 52 1HB ARG 52 -13.138 -1.267 -6.229 373 HG2 ARG 52 2HG ARG 52 -11.734 0.621 -5.489 374 HG3 ARG 52 1HG ARG 52 -10.330 -0.447 -5.431 375 HD2 ARG 52 2HD ARG 52 -10.105 0.670 -7.487 376 HD3 ARG 52 1HD ARG 52 -10.788 -0.891 -7.943 377 HE ARG 52 HE ARG 52 -12.969 0.744 -7.654 378 HH11 ARG 52 1HH1 ARG 52 -10.029 0.917 -9.592 379 HH12 ARG 52 2HH1 ARG 52 -10.777 1.830 -10.866 380 HH21 ARG 52 1HH2 ARG 52 -13.918 2.010 -9.314 381 HH22 ARG 52 2HH2 ARG 52 -12.975 2.445 -10.705 382 H VAL 53 H VAL 53 -11.885 0.012 -2.496 383 HA VAL 53 HA VAL 53 -14.683 0.986 -2.197 384 HB VAL 53 HB VAL 53 -14.261 1.538 0.128 385 HG11 VAL 53 1HG1 VAL 53 -13.333 -1.319 -0.373 386 HG12 VAL 53 2HG1 VAL 53 -15.011 -0.775 -0.306 387 HG13 VAL 53 3HG1 VAL 53 -14.003 -0.691 1.138 388 HG21 VAL 53 3HG2 VAL 53 -11.419 0.509 -0.247 389 HG22 VAL 53 1HG2 VAL 53 -12.129 1.017 1.288 390 HG23 VAL 53 2HG2 VAL 53 -11.894 2.191 -0.005 391 H GLU 54 H GLU 54 -14.859 3.273 -1.444 392 HA GLU 54 HA GLU 54 -12.754 5.050 -2.544 393 HB2 GLU 54 2HB GLU 54 -14.538 6.777 -2.669 394 HB3 GLU 54 1HB GLU 54 -14.952 5.351 -3.613 395 HG2 GLU 54 2HG GLU 54 -16.520 4.599 -1.906 396 HG3 GLU 54 1HG GLU 54 -16.011 5.886 -0.818 397 H ALA 55 H ALA 55 -12.225 6.988 -1.287 398 HA ALA 55 HA ALA 55 -13.026 7.086 1.529 399 HB1 ALA 55 3HB ALA 55 -10.101 6.915 0.726 400 HB2 ALA 55 1HB ALA 55 -11.022 5.635 1.520 401 HB3 ALA 55 2HB ALA 55 -10.725 7.157 2.361 402 H THR 56 H THR 56 -12.936 9.114 2.407 403 HA THR 56 HA THR 56 -12.391 11.372 0.623 404 HB THR 56 HB THR 56 -13.592 11.319 3.438 405 HG1 THR 56 HG1 THR 56 -14.710 10.337 1.428 406 HG21 THR 56 3HG2 THR 56 -13.546 13.563 1.372 407 HG22 THR 56 1HG2 THR 56 -12.623 13.537 2.873 408 HG23 THR 56 2HG2 THR 56 -14.388 13.602 2.925 409 H VAL 57 H VAL 57 -10.523 12.437 0.725 410 HA VAL 57 HA VAL 57 -8.394 11.762 2.526 411 HB VAL 57 HB VAL 57 -8.518 14.038 0.482 412 HG11 VAL 57 1HG1 VAL 57 -6.064 13.866 0.431 413 HG12 VAL 57 2HG1 VAL 57 -6.106 12.582 1.641 414 HG13 VAL 57 3HG1 VAL 57 -6.624 14.215 2.068 415 HG21 VAL 57 3HG2 VAL 57 -7.513 12.478 -1.142 416 HG22 VAL 57 1HG2 VAL 57 -9.093 11.902 -0.604 417 HG23 VAL 57 2HG2 VAL 57 -7.620 11.164 0.032 418 H THR 58 H THR 58 -7.694 12.877 4.285 419 HA THR 58 HA THR 58 -8.694 15.600 4.875 420 HB THR 58 HB THR 58 -8.332 13.293 6.852 421 HG1 THR 58 HG1 THR 58 -10.516 14.443 5.539 422 HG21 THR 58 3HG2 THR 58 -7.666 15.427 7.896 423 HG22 THR 58 1HG2 THR 58 -9.202 14.865 8.558 424 HG23 THR 58 2HG2 THR 58 -9.179 16.171 7.372 425 H VAL 59 H VAL 59 -6.939 16.885 4.664 426 HA VAL 59 HA VAL 59 -4.242 15.731 4.860 427 HB VAL 59 HB VAL 59 -5.324 18.258 3.532 428 HG11 VAL 59 1HG1 VAL 59 -3.021 18.835 2.829 429 HG12 VAL 59 2HG1 VAL 59 -2.376 17.540 3.839 430 HG13 VAL 59 3HG1 VAL 59 -3.185 18.919 4.584 431 HG21 VAL 59 3HG2 VAL 59 -3.819 15.839 2.459 432 HG22 VAL 59 1HG2 VAL 59 -4.386 17.207 1.496 433 HG23 VAL 59 2HG2 VAL 59 -5.550 16.147 2.289 434 H HIS 60 H HIS 60 -2.825 16.295 6.359 435 HA HIS 60 HA HIS 60 -3.682 17.963 8.618 436 HB2 HIS 60 2HB HIS 60 -1.388 15.994 8.184 437 HB3 HIS 60 1HB HIS 60 -1.493 17.012 9.622 438 HD1 HIS 60 HD1 HIS 60 -4.129 14.870 7.838 439 HD2 HIS 60 HD2 HIS 60 -2.505 15.472 11.620 440 HE1 HIS 60 HE1 HIS 60 -5.444 13.388 9.381 441 HE2 HIS 60 HE2 HIS 60 -4.284 13.601 11.600 442 H GLU 61 H GLU 61 -3.201 20.061 8.576 443 HA GLU 61 HA GLU 61 -1.514 21.428 6.828 444 HB2 GLU 61 2HB GLU 61 -1.828 23.373 8.341 445 HB3 GLU 61 1HB GLU 61 -3.340 22.525 8.052 446 HG2 GLU 61 2HG GLU 61 -3.121 21.408 10.265 447 HG3 GLU 61 1HG GLU 61 -1.633 22.305 10.553 448 H THR 62 H THR 62 -0.848 20.017 9.965 449 HA THR 62 HA THR 62 2.041 20.577 9.684 450 HB THR 62 HB THR 62 2.095 20.249 12.219 451 HG1 THR 62 HG1 THR 62 -0.336 20.874 12.890 452 HG21 THR 62 3HG2 THR 62 0.401 22.565 11.186 453 HG22 THR 62 1HG2 THR 62 2.162 22.540 11.312 454 HG23 THR 62 2HG2 THR 62 1.172 22.505 12.772 455 HA PRO 63 HA PRO 63 1.526 16.029 8.959 456 HB2 PRO 63 2HB PRO 63 3.861 15.685 7.537 457 HB3 PRO 63 1HB PRO 63 2.375 16.320 6.806 458 HG2 PRO 63 2HG PRO 63 4.773 17.827 7.796 459 HG3 PRO 63 1HG PRO 63 3.842 18.055 6.296 460 HD2 PRO 63 2HD PRO 63 3.469 19.638 8.474 461 HD3 PRO 63 1HD PRO 63 2.140 19.227 7.367 462 H GLU 64 H GLU 64 2.025 14.620 10.575 463 HA GLU 64 HA GLU 64 4.181 15.125 12.429 464 HB2 GLU 64 2HB GLU 64 3.336 13.114 13.626 465 HB3 GLU 64 1HB GLU 64 2.058 14.276 13.298 466 HG2 GLU 64 2HG GLU 64 1.183 12.930 11.506 467 HG3 GLU 64 1HG GLU 64 2.557 11.834 11.578 468 H SER 65 H SER 65 5.828 13.551 12.976 469 HA SER 65 HA SER 65 7.042 12.379 10.591 470 HB2 SER 65 2HB SER 65 9.049 12.204 12.150 471 HB3 SER 65 1HB SER 65 8.460 13.845 11.878 472 HG SER 65 HG SER 65 8.017 12.202 14.152 473 H VAL 66 H VAL 66 6.445 10.360 10.173 474 HA VAL 66 HA VAL 66 6.076 8.368 12.341 475 HB VAL 66 HB VAL 66 4.900 8.232 9.519 476 HG11 VAL 66 1HG1 VAL 66 4.212 6.632 12.018 477 HG12 VAL 66 2HG1 VAL 66 5.110 6.043 10.617 478 HG13 VAL 66 3HG1 VAL 66 3.413 6.492 10.449 479 HG21 VAL 66 3HG2 VAL 66 2.723 8.924 10.478 480 HG22 VAL 66 1HG2 VAL 66 3.939 10.196 10.619 481 HG23 VAL 66 2HG2 VAL 66 3.500 9.229 12.032 482 H ASP 67 H ASP 67 7.788 7.006 12.421 483 HA ASP 67 HA ASP 67 9.708 6.858 10.250 484 HB2 ASP 67 2HB ASP 67 9.619 5.541 12.996 485 HB3 ASP 67 1HB ASP 67 10.904 5.230 11.830 486 H LEU 68 H LEU 68 9.443 5.544 8.609 487 HA LEU 68 HA LEU 68 8.269 2.848 8.964 488 HB2 LEU 68 2HB LEU 68 7.843 4.621 6.519 489 HB3 LEU 68 1HB LEU 68 7.203 3.006 6.753 490 HG LEU 68 HG LEU 68 6.367 5.468 8.337 491 HD11 LEU 68 1HD1 LEU 68 5.625 5.565 6.001 492 HD12 LEU 68 2HD1 LEU 68 4.269 5.343 7.101 493 HD13 LEU 68 3HD1 LEU 68 4.872 3.975 6.163 494 HD21 LEU 68 3HD2 LEU 68 5.209 2.657 8.396 495 HD22 LEU 68 1HD2 LEU 68 4.557 4.065 9.242 496 HD23 LEU 68 2HD2 LEU 68 6.136 3.424 9.688 497 H GLU 69 H GLU 69 8.937 1.445 7.036 498 HA GLU 69 HA GLU 69 11.756 1.795 6.409 499 HB2 GLU 69 2HB GLU 69 11.568 -0.417 5.333 500 HB3 GLU 69 1HB GLU 69 10.935 -0.453 6.973 501 HG2 GLU 69 2HG GLU 69 8.639 -0.463 6.157 502 HG3 GLU 69 1HG GLU 69 9.190 -0.229 4.498 503 H THR 70 H THR 70 12.576 1.968 4.282 504 HA THR 70 HA THR 70 10.692 2.775 2.148 505 HB THR 70 HB THR 70 12.579 4.365 2.675 506 HG1 THR 70 HG1 THR 70 11.867 4.657 0.658 507 HG21 THR 70 3HG2 THR 70 14.866 3.848 1.946 508 HG22 THR 70 1HG2 THR 70 14.377 2.203 1.522 509 HG23 THR 70 2HG2 THR 70 14.361 2.725 3.208 510 H SER 71 H SER 71 11.812 2.089 -0.095 511 HA SER 71 HA SER 71 11.479 -0.799 -0.143 512 HB2 SER 71 2HB SER 71 11.276 -0.336 -2.621 513 HB3 SER 71 1HB SER 71 10.135 0.567 -1.629 514 HG SER 71 HG SER 71 12.619 1.617 -2.554 515 H ASP 72 H ASP 72 14.075 0.325 0.839 516 HA ASP 72 HA ASP 72 16.014 -0.652 -1.150 517 HB2 ASP 72 2HB ASP 72 16.142 2.139 0.116 518 HB3 ASP 72 1HB ASP 72 17.406 1.420 -0.872 519 H ASP 73 H ASP 73 14.952 -1.538 1.467 520 HA ASP 73 HA ASP 73 15.679 -2.691 3.314 521 HB2 ASP 73 2HB ASP 73 18.455 -2.328 2.084 522 HB3 ASP 73 1HB ASP 73 18.098 -3.386 3.443 523 H ARG 74 H ARG 74 15.509 0.300 3.395 524 HA ARG 74 HA ARG 74 17.351 0.855 5.661 525 HB2 ARG 74 2HB ARG 74 18.083 1.893 3.469 526 HB3 ARG 74 1HB ARG 74 16.584 2.805 3.437 527 HG2 ARG 74 2HG ARG 74 17.243 4.115 5.344 528 HG3 ARG 74 1HG ARG 74 18.632 3.072 5.665 529 HD2 ARG 74 2HD ARG 74 18.274 4.814 3.195 530 HD3 ARG 74 1HD ARG 74 19.294 5.207 4.585 531 HE ARG 74 HE ARG 74 20.454 2.979 3.987 532 HH11 ARG 74 1HH1 ARG 74 19.153 5.178 1.571 533 HH12 ARG 74 2HH1 ARG 74 20.277 4.681 0.351 534 HH21 ARG 74 1HH2 ARG 74 21.917 2.344 2.382 535 HH22 ARG 74 2HH2 ARG 74 21.845 3.077 0.810 536 H THR 75 H THR 75 16.547 2.913 6.867 537 HA THR 75 HA THR 75 13.603 2.812 7.229 538 HB THR 75 HB THR 75 15.571 3.563 9.455 539 HG1 THR 75 HG1 THR 75 14.765 1.032 8.553 540 HG21 THR 75 3HG2 THR 75 12.680 2.578 9.533 541 HG22 THR 75 1HG2 THR 75 13.187 4.255 9.730 542 HG23 THR 75 2HG2 THR 75 13.657 3.046 10.926 543 H VAL 76 H VAL 76 12.644 4.816 7.107 544 HA VAL 76 HA VAL 76 14.238 7.261 7.212 545 HB VAL 76 HB VAL 76 13.147 8.154 5.069 546 HG11 VAL 76 1HG1 VAL 76 14.828 7.176 3.543 547 HG12 VAL 76 2HG1 VAL 76 15.163 5.902 4.715 548 HG13 VAL 76 3HG1 VAL 76 15.535 7.581 5.108 549 HG21 VAL 76 3HG2 VAL 76 12.614 5.213 4.522 550 HG22 VAL 76 1HG2 VAL 76 12.411 6.530 3.361 551 HG23 VAL 76 2HG2 VAL 76 11.396 6.456 4.800 552 H ARG 77 H ARG 77 13.121 9.019 7.789 553 HA ARG 77 HA ARG 77 10.615 8.851 9.109 554 HB2 ARG 77 2HB ARG 77 12.453 10.414 9.706 555 HB3 ARG 77 1HB ARG 77 12.290 11.236 8.168 556 HG2 ARG 77 2HG ARG 77 10.075 11.208 10.241 557 HG3 ARG 77 1HG ARG 77 11.364 12.403 10.245 558 HD2 ARG 77 2HD ARG 77 9.125 12.051 8.251 559 HD3 ARG 77 1HD ARG 77 9.590 13.497 9.145 560 HE ARG 77 HE ARG 77 11.196 12.350 6.926 561 HH11 ARG 77 1HH1 ARG 77 9.841 15.191 8.488 562 HH12 ARG 77 2HH1 ARG 77 10.564 16.294 7.363 563 HH21 ARG 77 1HH2 ARG 77 12.128 13.799 5.469 564 HH22 ARG 77 2HH2 ARG 77 11.865 15.505 5.649 565 H TYR 78 H TYR 78 8.640 8.906 8.192 566 HA TYR 78 HA TYR 78 8.179 10.167 5.554 567 HB2 TYR 78 2HB TYR 78 6.615 8.096 7.147 568 HB3 TYR 78 1HB TYR 78 5.855 9.013 5.852 569 HD1 TYR 78 HD2 TYR 78 9.061 7.062 6.310 570 HD2 TYR 78 HD1 TYR 78 5.688 7.873 3.827 571 HE1 TYR 78 HE2 TYR 78 9.851 5.397 4.687 572 HE2 TYR 78 HE1 TYR 78 6.471 6.209 2.205 573 HH TYR 78 HH TYR 78 8.851 3.938 2.888 574 H LEU 79 H LEU 79 6.607 11.750 5.353 575 HA LEU 79 HA LEU 79 5.628 13.032 7.827 576 HB2 LEU 79 2HB LEU 79 5.979 14.094 4.995 577 HB3 LEU 79 1HB LEU 79 5.045 14.955 6.209 578 HG LEU 79 HG LEU 79 8.012 14.295 6.426 579 HD11 LEU 79 1HD1 LEU 79 6.664 16.979 5.958 580 HD12 LEU 79 2HD1 LEU 79 7.558 16.047 4.754 581 HD13 LEU 79 3HD1 LEU 79 8.397 16.697 6.159 582 HD21 LEU 79 3HD2 LEU 79 6.236 15.884 8.327 583 HD22 LEU 79 1HD2 LEU 79 7.990 15.707 8.459 584 HD23 LEU 79 2HD2 LEU 79 6.948 14.300 8.646 585 H HIS 80 H HIS 80 3.577 12.871 8.346 586 HA HIS 80 HA HIS 80 1.721 11.337 6.748 587 HB2 HIS 80 2HB HIS 80 1.835 10.976 9.146 588 HB3 HIS 80 1HB HIS 80 1.574 12.683 9.469 589 HD2 HIS 80 HD2 HIS 80 -0.734 10.354 7.255 590 HE1 HIS 80 HE1 HIS 80 -2.886 11.863 10.567 591 HE2 HIS 80 HE2 HIS 80 -2.911 10.214 8.651 592 H VAL 81 H VAL 81 1.055 12.438 5.010 593 HA VAL 81 HA VAL 81 0.478 15.306 5.162 594 HB VAL 81 HB VAL 81 0.361 15.243 2.684 595 HG11 VAL 81 1HG1 VAL 81 2.875 13.955 3.826 596 HG12 VAL 81 2HG1 VAL 81 2.517 15.683 3.781 597 HG13 VAL 81 3HG1 VAL 81 2.762 14.797 2.277 598 HG21 VAL 81 3HG2 VAL 81 0.989 13.178 1.442 599 HG22 VAL 81 1HG2 VAL 81 -0.506 12.959 2.356 600 HG23 VAL 81 2HG2 VAL 81 1.003 12.273 2.959 601 H ALA 82 H ALA 82 -1.212 12.249 4.810 602 HA ALA 82 HA ALA 82 -3.800 13.668 4.721 603 HB1 ALA 82 3HB ALA 82 -4.592 12.305 2.815 604 HB2 ALA 82 1HB ALA 82 -2.987 11.586 2.655 605 HB3 ALA 82 2HB ALA 82 -3.216 13.310 2.360 606 H THR 83 H THR 83 -5.598 12.361 5.287 607 HA THR 83 HA THR 83 -5.091 9.611 6.240 608 HB THR 83 HB THR 83 -6.857 11.687 7.645 609 HG1 THR 83 HG1 THR 83 -4.276 11.246 7.870 610 HG21 THR 83 3HG2 THR 83 -7.235 9.938 9.356 611 HG22 THR 83 1HG2 THR 83 -6.309 8.778 8.398 612 HG23 THR 83 2HG2 THR 83 -7.843 9.406 7.790 613 H LEU 84 H LEU 84 -6.338 8.268 5.142 614 HA LEU 84 HA LEU 84 -8.497 9.296 3.419 615 HB2 LEU 84 2HB LEU 84 -7.245 6.519 3.309 616 HB3 LEU 84 1HB LEU 84 -8.114 7.367 2.040 617 HG LEU 84 HG LEU 84 -5.311 8.013 3.047 618 HD11 LEU 84 1HD1 LEU 84 -4.544 7.332 0.820 619 HD12 LEU 84 2HD1 LEU 84 -6.198 6.908 0.370 620 HD13 LEU 84 3HD1 LEU 84 -5.375 6.014 1.651 621 HD21 LEU 84 3HD2 LEU 84 -5.177 9.722 1.267 622 HD22 LEU 84 1HD2 LEU 84 -6.420 10.112 2.456 623 HD23 LEU 84 2HD2 LEU 84 -6.879 9.457 0.883 624 H SER 85 H SER 85 -10.319 9.330 4.654 625 HA SER 85 HA SER 85 -10.901 7.201 6.596 626 HB2 SER 85 2HB SER 85 -11.029 9.609 7.280 627 HB3 SER 85 1HB SER 85 -12.337 9.857 6.120 628 HG SER 85 HG SER 85 -12.314 8.169 8.406 629 H PHE 86 H PHE 86 -12.623 5.802 6.381 630 HA PHE 86 HA PHE 86 -14.706 6.032 4.444 631 HB2 PHE 86 2HB PHE 86 -14.051 4.159 2.964 632 HB3 PHE 86 1HB PHE 86 -12.907 5.482 2.864 633 HD1 PHE 86 HD1 PHE 86 -10.641 5.252 4.000 634 HD2 PHE 86 HD2 PHE 86 -13.325 1.946 3.592 635 HE1 PHE 86 HE1 PHE 86 -8.778 3.691 4.370 636 HE2 PHE 86 HE2 PHE 86 -11.455 0.393 3.967 637 HZ PHE 86 HZ PHE 86 -9.182 1.264 4.353 638 H ASP 87 H ASP 87 -15.515 3.546 4.082 639 HA ASP 87 HA ASP 87 -15.608 2.151 6.690 640 HB2 ASP 87 2HB ASP 87 -17.906 2.937 4.860 641 HB3 ASP 87 1HB ASP 87 -18.054 1.542 5.920 642 H LEU 88 H LEU 88 -15.582 -0.040 6.595 643 HA LEU 88 HA LEU 88 -15.717 -1.503 4.068 644 HB2 LEU 88 2HB LEU 88 -13.326 -0.892 4.264 645 HB3 LEU 88 1HB LEU 88 -13.261 -1.573 5.880 646 HG LEU 88 HG LEU 88 -13.669 -3.849 4.926 647 HD11 LEU 88 1HD1 LEU 88 -14.923 -3.256 2.905 648 HD12 LEU 88 2HD1 LEU 88 -13.524 -4.245 2.498 649 HD13 LEU 88 3HD1 LEU 88 -13.485 -2.503 2.207 650 HD21 LEU 88 3HD2 LEU 88 -11.285 -2.410 3.711 651 HD22 LEU 88 1HD2 LEU 88 -11.447 -4.156 3.912 652 HD23 LEU 88 2HD2 LEU 88 -11.366 -3.113 5.329 653 H ASP 89 H ASP 89 -16.866 -3.293 4.394 654 HA ASP 89 HA ASP 89 -17.771 -5.174 5.227 655 HB2 ASP 89 2HB ASP 89 -15.518 -5.733 6.070 656 HB3 ASP 89 1HB ASP 89 -15.834 -4.831 7.554 657 H GLY 90 H GLY 90 -17.193 -3.480 8.311 658 HA2 GLY 90 2HA GLY 90 -19.937 -2.593 8.612 659 HA3 GLY 90 1HA GLY 90 -19.520 -3.954 9.653 660 H GLU 91 H GLU 91 -16.974 -1.830 8.841 661 HA GLU 91 HA GLU 91 -17.166 -0.242 11.313 662 HB2 GLU 91 2HB GLU 91 -14.732 -0.863 11.797 663 HB3 GLU 91 1HB GLU 91 -15.910 -2.146 12.054 664 HG2 GLU 91 2HG GLU 91 -15.327 -3.117 9.844 665 HG3 GLU 91 1HG GLU 91 -14.122 -1.849 9.625 666 H SER 92 H SER 92 -16.145 1.733 11.220 667 HA SER 92 HA SER 92 -15.492 2.787 8.612 668 HB2 SER 92 2HB SER 92 -16.861 4.064 10.277 669 HB3 SER 92 1HB SER 92 -15.449 4.171 11.330 670 HG SER 92 HG SER 92 -15.535 5.148 8.660 671 H ARG 93 H ARG 93 -13.515 2.654 7.789 672 HA ARG 93 HA ARG 93 -11.178 2.144 9.526 673 HB2 ARG 93 2HB ARG 93 -11.555 1.618 6.552 674 HB3 ARG 93 1HB ARG 93 -10.162 1.142 7.510 675 HG2 ARG 93 2HG ARG 93 -12.977 0.077 7.896 676 HG3 ARG 93 1HG ARG 93 -11.702 -0.733 6.983 677 HD2 ARG 93 2HD ARG 93 -11.706 -1.782 9.096 678 HD3 ARG 93 1HD ARG 93 -10.329 -0.683 9.147 679 HE ARG 93 HE ARG 93 -12.805 0.376 10.217 680 HH11 ARG 93 1HH1 ARG 93 -9.925 -1.445 11.032 681 HH12 ARG 93 2HH1 ARG 93 -10.003 -1.057 12.716 682 HH21 ARG 93 1HH2 ARG 93 -12.842 0.963 12.421 683 HH22 ARG 93 2HH2 ARG 93 -11.654 0.309 13.505 684 H ASP 94 H ASP 94 -9.380 3.416 9.418 685 HA ASP 94 HA ASP 94 -9.213 5.588 7.387 686 HB2 ASP 94 2HB ASP 94 -7.981 5.579 10.195 687 HB3 ASP 94 1HB ASP 94 -7.887 6.890 9.023 688 H LEU 95 H LEU 95 -7.505 5.367 6.008 689 HA LEU 95 HA LEU 95 -5.074 3.935 6.938 690 HB2 LEU 95 2HB LEU 95 -6.111 4.221 4.082 691 HB3 LEU 95 1HB LEU 95 -4.532 3.577 4.506 692 HG LEU 95 HG LEU 95 -7.236 2.330 5.117 693 HD11 LEU 95 1HD1 LEU 95 -4.901 1.352 3.446 694 HD12 LEU 95 2HD1 LEU 95 -6.440 1.968 2.840 695 HD13 LEU 95 3HD1 LEU 95 -6.397 0.465 3.752 696 HD21 LEU 95 3HD2 LEU 95 -5.792 2.018 7.084 697 HD22 LEU 95 1HD2 LEU 95 -4.511 1.364 6.059 698 HD23 LEU 95 2HD2 LEU 95 -6.035 0.493 6.239 699 H HIS 96 H HIS 96 -3.388 5.220 7.239 700 HA HIS 96 HA HIS 96 -3.649 8.058 6.593 701 HB2 HIS 96 2HB HIS 96 -1.715 6.488 8.366 702 HB3 HIS 96 1HB HIS 96 -1.606 8.229 8.112 703 HD2 HIS 96 HD2 HIS 96 -4.939 6.227 8.942 704 HE1 HIS 96 HE1 HIS 96 -4.223 9.163 11.896 705 HE2 HIS 96 HE2 HIS 96 -5.930 7.580 10.919 706 H ALA 97 H ALA 97 -2.508 9.044 5.038 707 HA ALA 97 HA ALA 97 -0.875 7.369 3.248 708 HB1 ALA 97 3HB ALA 97 -2.925 8.312 2.262 709 HB2 ALA 97 1HB ALA 97 -1.495 9.008 1.499 710 HB3 ALA 97 2HB ALA 97 -2.406 9.940 2.692 711 H PHE 98 H PHE 98 1.237 7.761 3.194 712 HA PHE 98 HA PHE 98 2.295 10.348 4.203 713 HB2 PHE 98 2HB PHE 98 3.857 7.744 4.356 714 HB3 PHE 98 1HB PHE 98 4.072 9.225 5.274 715 HD1 PHE 98 HD1 PHE 98 2.593 9.721 7.201 716 HD2 PHE 98 HD2 PHE 98 2.381 5.997 5.128 717 HE1 PHE 98 HE1 PHE 98 1.412 8.721 9.104 718 HE2 PHE 98 HE2 PHE 98 1.201 5.002 7.044 719 HZ PHE 98 HZ PHE 98 0.724 6.376 9.025 720 H ARG 99 H ARG 99 4.523 10.718 3.499 721 HA ARG 99 HA ARG 99 5.751 9.221 1.399 722 HB2 ARG 99 2HB ARG 99 5.981 11.055 -0.236 723 HB3 ARG 99 1HB ARG 99 4.303 10.609 -0.015 724 HG2 ARG 99 2HG ARG 99 4.733 12.748 1.800 725 HG3 ARG 99 1HG ARG 99 5.577 13.218 0.328 726 HD2 ARG 99 2HD ARG 99 2.665 12.391 0.532 727 HD3 ARG 99 1HD ARG 99 3.255 14.039 0.353 728 HE ARG 99 HE ARG 99 4.100 12.257 -1.769 729 HH11 ARG 99 1HH1 ARG 99 1.476 14.375 -0.729 730 HH12 ARG 99 2HH1 ARG 99 0.878 14.610 -2.338 731 HH21 ARG 99 1HH2 ARG 99 3.281 12.578 -3.863 732 HH22 ARG 99 2HH2 ARG 99 1.888 13.599 -4.102 733 H GLN 100 H GLN 100 8.021 9.837 1.237 734 HA GLN 100 HA GLN 100 9.052 9.840 3.776 735 HB2 GLN 100 2HB GLN 100 10.535 10.473 1.202 736 HB3 GLN 100 1HB GLN 100 11.307 10.025 2.722 737 HG2 GLN 100 2HG GLN 100 10.162 7.831 2.659 738 HG3 GLN 100 1HG GLN 100 9.393 8.278 1.139 739 HE21 GLN 100 1HE2 GLN 100 12.768 9.004 1.928 740 HE22 GLN 100 2HE2 GLN 100 13.451 7.925 0.769 741 H ALA 101 H ALA 101 9.985 12.551 1.557 742 HA ALA 101 HA ALA 101 9.759 14.375 3.898 743 HB1 ALA 101 3HB ALA 101 11.567 15.725 2.925 744 HB2 ALA 101 1HB ALA 101 11.696 14.604 1.564 745 HB3 ALA 101 2HB ALA 101 12.094 14.065 3.196 746 H ALA 102 H ALA 102 10.062 14.951 0.368 747 HA ALA 102 HA ALA 102 7.692 16.730 0.481 748 HB1 ALA 102 3HB ALA 102 9.778 18.028 0.790 749 HB2 ALA 102 1HB ALA 102 8.993 18.430 -0.740 750 HB3 ALA 102 2HB ALA 102 10.412 17.381 -0.724 751 H ASP 103 H ASP 103 7.577 14.106 -0.584 752 HA ASP 103 HA ASP 103 8.163 13.962 -3.373 753 HB2 ASP 103 2HB ASP 103 7.886 11.877 -2.173 754 HB3 ASP 103 1HB ASP 103 6.293 12.340 -1.603 755 H GLU 104 H GLU 104 6.924 14.365 -5.126 756 HA GLU 104 HA GLU 104 4.115 15.192 -4.913 757 HB2 GLU 104 2HB GLU 104 6.228 16.900 -6.320 758 HB3 GLU 104 1HB GLU 104 4.492 17.187 -6.374 759 HG2 GLU 104 2HG GLU 104 4.507 17.544 -3.906 760 HG3 GLU 104 1HG GLU 104 6.251 17.331 -3.905 761 H SER 105 H SER 105 5.841 12.908 -5.888 762 HA SER 105 HA SER 105 5.120 12.712 -8.721 763 HB2 SER 105 2HB SER 105 7.337 11.875 -7.907 764 HB3 SER 105 1HB SER 105 6.509 10.716 -6.869 765 HG SER 105 HG SER 105 5.819 9.608 -8.648 766 H ARG 106 H ARG 106 3.240 12.754 -6.301 767 HA ARG 106 HA ARG 106 1.139 12.052 -5.778 768 HB2 ARG 106 2HB ARG 106 1.323 10.181 -8.179 769 HB3 ARG 106 1HB ARG 106 -0.142 10.576 -7.299 770 HG2 ARG 106 2HG ARG 106 1.487 12.554 -8.918 771 HG3 ARG 106 1HG ARG 106 0.047 11.716 -9.489 772 HD2 ARG 106 2HD ARG 106 -0.766 13.825 -8.858 773 HD3 ARG 106 1HD ARG 106 -1.158 12.811 -7.471 774 HE ARG 106 HE ARG 106 0.275 14.049 -6.178 775 HH11 ARG 106 1HH1 ARG 106 0.919 14.853 -9.548 776 HH12 ARG 106 2HH1 ARG 106 1.962 16.178 -9.153 777 HH21 ARG 106 1HH2 ARG 106 1.622 15.824 -5.692 778 HH22 ARG 106 2HH2 ARG 106 2.358 16.727 -6.980 779 H THR 107 H THR 107 3.761 10.460 -5.104 780 HA THR 107 HA THR 107 2.899 7.691 -4.960 781 HB THR 107 HB THR 107 5.530 8.955 -4.044 782 HG1 THR 107 HG1 THR 107 4.546 8.274 -6.570 783 HG21 THR 107 3HG2 THR 107 6.471 6.683 -4.352 784 HG22 THR 107 1HG2 THR 107 4.862 6.072 -4.774 785 HG23 THR 107 2HG2 THR 107 5.183 6.670 -3.148 786 H LEU 108 H LEU 108 1.429 7.414 -3.377 787 HA LEU 108 HA LEU 108 1.945 8.403 -0.626 788 HB2 LEU 108 2HB LEU 108 -0.702 7.684 -1.953 789 HB3 LEU 108 1HB LEU 108 -0.516 8.207 -0.283 790 HG LEU 108 HG LEU 108 0.165 9.908 -2.713 791 HD11 LEU 108 1HD1 LEU 108 -2.199 10.104 -0.838 792 HD12 LEU 108 2HD1 LEU 108 -2.243 9.575 -2.521 793 HD13 LEU 108 3HD1 LEU 108 -1.802 11.235 -2.135 794 HD21 LEU 108 3HD2 LEU 108 1.581 10.483 -0.806 795 HD22 LEU 108 1HD2 LEU 108 0.163 10.620 0.240 796 HD23 LEU 108 2HD2 LEU 108 0.400 11.759 -1.090 797 H PHE 109 H PHE 109 2.463 6.913 0.796 798 HA PHE 109 HA PHE 109 2.133 4.053 0.149 799 HB2 PHE 109 2HB PHE 109 4.450 4.846 0.516 800 HB3 PHE 109 1HB PHE 109 4.007 5.484 2.096 801 HD1 PHE 109 HD1 PHE 109 3.920 2.222 0.187 802 HD2 PHE 109 HD2 PHE 109 4.505 4.147 3.973 803 HE1 PHE 109 HE1 PHE 109 4.513 0.057 1.212 804 HE2 PHE 109 HE2 PHE 109 5.098 1.980 4.979 805 HZ PHE 109 HZ PHE 109 5.103 -0.061 3.603 806 H VAL 110 H VAL 110 0.391 3.164 1.080 807 HA VAL 110 HA VAL 110 -0.228 3.770 3.908 808 HB VAL 110 HB VAL 110 -2.610 3.169 3.529 809 HG11 VAL 110 1HG1 VAL 110 -1.990 5.539 3.474 810 HG12 VAL 110 2HG1 VAL 110 -3.333 5.226 2.380 811 HG13 VAL 110 3HG1 VAL 110 -1.704 5.452 1.734 812 HG21 VAL 110 3HG2 VAL 110 -1.960 3.117 0.555 813 HG22 VAL 110 1HG2 VAL 110 -3.577 3.019 1.261 814 HG23 VAL 110 2HG2 VAL 110 -2.412 1.726 1.542 815 HA PRO 111 HA PRO 111 0.413 -0.750 4.219 816 HB2 PRO 111 2HB PRO 111 1.179 -0.736 6.846 817 HB3 PRO 111 1HB PRO 111 2.317 -0.395 5.528 818 HG2 PRO 111 2HG PRO 111 0.968 1.523 7.389 819 HG3 PRO 111 1HG PRO 111 2.625 1.548 6.743 820 HD2 PRO 111 2HD PRO 111 0.538 3.081 5.734 821 HD3 PRO 111 1HD PRO 111 1.993 2.635 4.817 822 H PHE 112 H PHE 112 -1.225 -2.154 4.960 823 HA PHE 112 HA PHE 112 -3.011 -1.253 7.084 824 HB2 PHE 112 2HB PHE 112 -5.053 -1.895 5.951 825 HB3 PHE 112 1HB PHE 112 -4.213 -0.687 5.008 826 HD1 PHE 112 HD1 PHE 112 -3.127 -1.333 2.824 827 HD2 PHE 112 HD2 PHE 112 -5.560 -4.076 5.037 828 HE1 PHE 112 HE1 PHE 112 -3.441 -2.709 0.803 829 HE2 PHE 112 HE2 PHE 112 -5.857 -5.442 3.014 830 HZ PHE 112 HZ PHE 112 -4.805 -4.756 0.896 831 H ARG 113 H ARG 113 -3.157 -2.732 8.620 832 HA ARG 113 HA ARG 113 -2.318 -5.523 8.051 833 HB2 ARG 113 2HB ARG 113 -1.005 -4.281 9.796 834 HB3 ARG 113 1HB ARG 113 -2.480 -4.056 10.736 835 HG2 ARG 113 2HG ARG 113 -2.695 -6.517 10.970 836 HG3 ARG 113 1HG ARG 113 -1.215 -6.719 10.042 837 HD2 ARG 113 2HD ARG 113 0.027 -5.483 11.822 838 HD3 ARG 113 1HD ARG 113 -1.463 -5.427 12.775 839 HE ARG 113 HE ARG 113 -0.094 -7.939 11.964 840 HH11 ARG 113 1HH1 ARG 113 -1.897 -6.158 14.399 841 HH12 ARG 113 2HH1 ARG 113 -1.895 -7.483 15.519 842 HH21 ARG 113 1HH2 ARG 113 -0.163 -9.658 13.412 843 HH22 ARG 113 2HH2 ARG 113 -0.921 -9.451 14.962 844 H ASP 114 H ASP 114 -3.987 -7.052 7.980 845 HA ASP 114 HA ASP 114 -6.609 -6.280 9.107 846 HB2 ASP 114 2HB ASP 114 -7.732 -6.984 7.113 847 HB3 ASP 114 1HB ASP 114 -6.406 -5.964 6.571 848 H LYS 115 H LYS 115 -7.983 -8.668 8.509 849 HA LYS 115 HA LYS 115 -6.930 -10.332 10.628 850 HB2 LYS 115 2HB LYS 115 -9.437 -10.649 8.956 851 HB3 LYS 115 1HB LYS 115 -9.014 -11.700 10.296 852 HG2 LYS 115 2HG LYS 115 -9.535 -8.721 10.541 853 HG3 LYS 115 1HG LYS 115 -10.725 -9.978 10.847 854 HD2 LYS 115 2HD LYS 115 -10.030 -9.556 13.011 855 HD3 LYS 115 1HD LYS 115 -8.902 -10.842 12.591 856 HE2 LYS 115 2HE LYS 115 -7.159 -9.166 12.119 857 HE3 LYS 115 1HE LYS 115 -8.295 -7.864 12.476 858 HZ1 LYS 115 3HZ LYS 115 -7.452 -9.950 14.410 859 HZ2 LYS 115 1HZ LYS 115 -8.445 -8.619 14.739 860 HZ3 LYS 115 2HZ LYS 115 -6.817 -8.385 14.338 861 H THR 116 H THR 116 -6.479 -10.438 7.195 862 HA THR 116 HA THR 116 -5.926 -13.292 7.118 863 HB THR 116 HB THR 116 -4.967 -12.956 4.896 864 HG1 THR 116 HG1 THR 116 -5.309 -10.148 5.179 865 HG21 THR 116 3HG2 THR 116 -7.439 -12.980 4.994 866 HG22 THR 116 1HG2 THR 116 -6.868 -11.941 3.683 867 HG23 THR 116 2HG2 THR 116 -7.455 -11.226 5.185 868 H THR 117 H THR 117 -4.281 -10.369 7.997 869 HA THR 117 HA THR 117 -1.585 -11.207 7.669 870 HB THR 117 HB THR 117 -2.644 -9.013 9.514 871 HG1 THR 117 HG1 THR 117 -3.371 -8.789 7.309 872 HG21 THR 117 3HG2 THR 117 -0.421 -7.962 9.032 873 HG22 THR 117 1HG2 THR 117 0.052 -9.424 8.164 874 HG23 THR 117 2HG2 THR 117 -0.271 -9.491 9.899 875 H GLY 118 H GLY 118 -0.522 -12.654 8.866 876 HA2 GLY 118 2HA GLY 118 0.237 -13.749 10.808 877 HA3 GLY 118 1HA GLY 118 -1.151 -13.144 11.704 878 H GLN 119 H GLN 119 -3.068 -13.977 9.593 879 HA GLN 119 HA GLN 119 -3.364 -16.756 10.487 880 HB2 GLN 119 2HB GLN 119 -5.412 -14.932 9.158 881 HB3 GLN 119 1HB GLN 119 -5.744 -16.503 9.873 882 HG2 GLN 119 2HG GLN 119 -4.894 -13.977 11.322 883 HG3 GLN 119 1HG GLN 119 -6.477 -14.742 11.381 884 HE21 GLN 119 1HE2 GLN 119 -4.596 -14.054 13.539 885 HE22 GLN 119 2HE2 GLN 119 -4.299 -15.526 14.393 886 H GLN 120 H GLN 120 -4.880 -15.615 7.486 887 HA GLN 120 HA GLN 120 -3.651 -17.845 6.017 888 HB2 GLN 120 2HB GLN 120 -5.404 -17.320 4.270 889 HB3 GLN 120 1HB GLN 120 -6.043 -17.801 5.837 890 HG2 GLN 120 2HG GLN 120 -6.507 -15.456 6.392 891 HG3 GLN 120 1HG GLN 120 -5.847 -14.946 4.840 892 HE21 GLN 120 1HE2 GLN 120 -8.555 -14.729 6.100 893 HE22 GLN 120 2HE2 GLN 120 -9.641 -15.336 4.898 894 H SER 121 H SER 121 -2.343 -15.278 6.681 895 HA SER 121 HA SER 121 -0.632 -15.247 4.406 896 HB2 SER 121 2HB SER 121 -2.087 -12.643 5.107 897 HB3 SER 121 1HB SER 121 -0.663 -12.729 4.071 898 HG SER 121 HG SER 121 -2.273 -14.404 2.974 899 H TYR 122 H TYR 122 1.412 -14.056 5.012 900 HA TYR 122 HA TYR 122 2.107 -14.493 7.730 901 HB2 TYR 122 2HB TYR 122 3.618 -13.077 5.492 902 HB3 TYR 122 1HB TYR 122 4.313 -13.399 7.080 903 HD1 TYR 122 HD1 TYR 122 4.602 -15.813 7.845 904 HD2 TYR 122 HD2 TYR 122 3.536 -14.838 3.819 905 HE1 TYR 122 HE1 TYR 122 5.270 -18.061 7.121 906 HE2 TYR 122 HE2 TYR 122 4.215 -17.091 3.101 907 HH TYR 122 HH TYR 122 5.638 -18.936 3.858 908 H ASP 123 H ASP 123 3.336 -12.720 8.985 909 HA ASP 123 HA ASP 123 1.373 -10.716 9.703 910 HB2 ASP 123 2HB ASP 123 2.774 -12.112 11.337 911 HB3 ASP 123 1HB ASP 123 4.136 -11.071 10.939 912 H GLY 124 H GLY 124 2.834 -8.451 10.515 913 HA2 GLY 124 2HA GLY 124 4.340 -6.771 9.867 914 HA3 GLY 124 1HA GLY 124 4.520 -7.527 8.288 915 H GLY 125 H GLY 125 1.870 -7.794 7.497 916 HA2 GLY 125 2HA GLY 125 -0.150 -6.340 7.398 917 HA3 GLY 125 1HA GLY 125 0.950 -4.972 7.232 918 H ARG 126 H ARG 126 -0.763 -4.992 5.359 919 HA ARG 126 HA ARG 126 0.423 -6.200 2.931 920 HB2 ARG 126 2HB ARG 126 -2.376 -5.291 3.641 921 HB3 ARG 126 1HB ARG 126 -1.850 -5.019 1.990 922 HG2 ARG 126 2HG ARG 126 -3.122 -7.042 2.063 923 HG3 ARG 126 1HG ARG 126 -1.444 -7.450 1.729 924 HD2 ARG 126 2HD ARG 126 -2.647 -7.643 4.506 925 HD3 ARG 126 1HD ARG 126 -2.700 -8.974 3.344 926 HE ARG 126 HE ARG 126 -0.051 -7.980 3.700 927 HH11 ARG 126 1HH1 ARG 126 -2.421 -10.091 5.180 928 HH12 ARG 126 2HH1 ARG 126 -1.226 -11.041 5.998 929 HH21 ARG 126 1HH2 ARG 126 1.488 -9.160 4.816 930 HH22 ARG 126 2HH2 ARG 126 1.008 -10.508 5.794 931 H TYR 127 H TYR 127 1.421 -4.829 1.532 932 HA TYR 127 HA TYR 127 1.676 -1.987 2.313 933 HB2 TYR 127 2HB TYR 127 3.387 -3.728 0.454 934 HB3 TYR 127 1HB TYR 127 3.689 -2.027 0.803 935 HD1 TYR 127 HD2 TYR 127 2.970 -5.102 2.907 936 HD2 TYR 127 HD1 TYR 127 5.525 -1.732 2.263 937 HE1 TYR 127 HE2 TYR 127 4.343 -5.773 4.821 938 HE2 TYR 127 HE1 TYR 127 6.888 -2.424 4.187 939 HH TYR 127 HH TYR 127 6.872 -3.762 6.057 940 H MET 128 H MET 128 0.731 -0.470 1.053 941 HA MET 128 HA MET 128 -0.248 -1.184 -1.633 942 HB2 MET 128 2HB MET 128 -1.961 -1.449 0.494 943 HB3 MET 128 1HB MET 128 -2.181 0.268 0.185 944 HG2 MET 128 2HG MET 128 -2.465 -1.791 -2.007 945 HG3 MET 128 1HG MET 128 -3.801 -1.335 -0.959 946 HE1 MET 128 3HE MET 128 -4.882 2.071 -2.107 947 HE2 MET 128 1HE MET 128 -4.119 1.560 -0.603 948 HE3 MET 128 2HE MET 128 -5.331 0.530 -1.369 949 H GLU 129 H GLU 129 -0.317 0.581 -3.024 950 HA GLU 129 HA GLU 129 0.571 3.189 -1.979 951 HB2 GLU 129 2HB GLU 129 2.540 1.701 -2.579 952 HB3 GLU 129 1HB GLU 129 1.970 1.695 -4.244 953 HG2 GLU 129 2HG GLU 129 2.326 4.113 -4.403 954 HG3 GLU 129 1HG GLU 129 2.804 4.182 -2.705 955 H LEU 130 H LEU 130 -0.504 4.804 -2.940 956 HA LEU 130 HA LEU 130 -2.076 4.270 -5.398 957 HB2 LEU 130 2HB LEU 130 -2.745 6.558 -3.512 958 HB3 LEU 130 1HB LEU 130 -3.776 5.716 -4.650 959 HG LEU 130 HG LEU 130 -3.446 3.666 -2.966 960 HD11 LEU 130 1HD1 LEU 130 -2.927 6.037 -1.142 961 HD12 LEU 130 2HD1 LEU 130 -1.808 4.720 -1.507 962 HD13 LEU 130 3HD1 LEU 130 -3.289 4.390 -0.614 963 HD21 LEU 130 3HD2 LEU 130 -5.495 4.268 -1.817 964 HD22 LEU 130 1HD2 LEU 130 -5.606 4.725 -3.515 965 HD23 LEU 130 2HD2 LEU 130 -5.309 5.958 -2.287 966 H GLU 131 H GLU 131 -1.664 5.558 -7.115 967 HA GLU 131 HA GLU 131 -0.281 8.144 -6.733 968 HB2 GLU 131 2HB GLU 131 0.247 6.195 -9.026 969 HB3 GLU 131 1HB GLU 131 0.889 7.831 -8.909 970 HG2 GLU 131 2HG GLU 131 2.050 7.125 -6.761 971 HG3 GLU 131 1HG GLU 131 1.547 5.475 -7.114 972 HA PRO 132 HA PRO 132 -4.492 8.880 -8.600 973 HB2 PRO 132 2HB PRO 132 -4.715 11.428 -7.508 974 HB3 PRO 132 1HB PRO 132 -5.163 9.946 -6.638 975 HG2 PRO 132 2HG PRO 132 -2.603 11.517 -6.478 976 HG3 PRO 132 1HG PRO 132 -3.585 10.842 -5.154 977 HD2 PRO 132 2HD PRO 132 -1.376 9.582 -5.987 978 HD3 PRO 132 1HD PRO 132 -2.822 8.660 -5.521 979 H ASP 133 H ASP 133 -5.292 10.830 -9.914 980 HA ASP 133 HA ASP 133 -3.356 11.433 -11.984 981 HB2 ASP 133 2HB ASP 133 -5.741 10.832 -12.486 982 HB3 ASP 133 1HB ASP 133 -6.272 12.309 -11.694 983 H ARG 134 H ARG 134 -4.334 12.884 -9.092 984 HA ARG 134 HA ARG 134 -2.865 15.315 -9.537 985 HB2 ARG 134 2HB ARG 134 -4.685 16.887 -9.082 986 HB3 ARG 134 1HB ARG 134 -5.063 15.931 -10.502 987 HG2 ARG 134 2HG ARG 134 -7.112 15.714 -9.550 988 HG3 ARG 134 1HG ARG 134 -6.348 14.466 -8.570 989 HD2 ARG 134 2HD ARG 134 -5.922 16.157 -6.804 990 HD3 ARG 134 1HD ARG 134 -6.735 17.379 -7.786 991 HE ARG 134 HE ARG 134 -7.941 15.399 -6.120 992 HH11 ARG 134 1HH1 ARG 134 -8.565 17.190 -9.113 993 HH12 ARG 134 2HH1 ARG 134 -10.284 17.037 -8.953 994 HH21 ARG 134 1HH2 ARG 134 -10.156 15.271 -5.931 995 HH22 ARG 134 2HH2 ARG 134 -11.184 15.952 -7.151 996 H ASP 135 H ASP 135 -2.738 16.594 -7.433 997 HA ASP 135 HA ASP 135 -2.027 14.612 -5.450 998 HB2 ASP 135 2HB ASP 135 -0.625 16.692 -6.091 999 HB3 ASP 135 1HB ASP 135 -1.738 17.627 -5.102 1000 H LEU 136 H LEU 136 -2.908 14.372 -3.388 1001 HA LEU 136 HA LEU 136 -5.758 14.864 -3.344 1002 HB2 LEU 136 2HB LEU 136 -3.962 13.340 -1.430 1003 HB3 LEU 136 1HB LEU 136 -5.714 13.404 -1.312 1004 HG LEU 136 HG LEU 136 -4.083 12.107 -3.526 1005 HD11 LEU 136 1HD1 LEU 136 -6.023 10.876 -1.548 1006 HD12 LEU 136 2HD1 LEU 136 -4.266 10.821 -1.417 1007 HD13 LEU 136 3HD1 LEU 136 -5.070 10.030 -2.770 1008 HD21 LEU 136 3HD2 LEU 136 -7.106 12.436 -3.378 1009 HD22 LEU 136 1HD2 LEU 136 -6.243 11.414 -4.534 1010 HD23 LEU 136 2HD2 LEU 136 -6.024 13.162 -4.571 1011 H SER 137 H SER 137 -6.632 16.589 -2.471 1012 HA SER 137 HA SER 137 -5.188 18.271 -0.527 1013 HB2 SER 137 2HB SER 137 -7.661 18.877 -2.216 1014 HB3 SER 137 1HB SER 137 -6.756 20.039 -1.235 1015 HG SER 137 HG SER 137 -5.486 18.531 -3.266 1016 H ASP 138 H ASP 138 -6.907 19.491 0.996 1017 HA ASP 138 HA ASP 138 -8.069 17.433 2.665 1018 HB2 ASP 138 2HB ASP 138 -6.886 19.394 3.634 1019 HB3 ASP 138 1HB ASP 138 -8.121 20.467 2.987 1020 H GLY 139 H GLY 139 -10.016 16.611 2.284 1021 HA2 GLY 139 2HA GLY 139 -12.394 16.711 2.093 1022 HA3 GLY 139 1HA GLY 139 -12.264 18.286 1.318 1023 H ASP 140 H ASP 140 -9.946 16.194 0.096 1024 HA ASP 140 HA ASP 140 -11.201 15.906 -2.493 1025 HB2 ASP 140 2HB ASP 140 -8.651 16.270 -1.714 1026 HB3 ASP 140 1HB ASP 140 -8.628 14.522 -1.660 1027 H GLU 141 H GLU 141 -11.195 13.573 -3.556 1028 HA GLU 141 HA GLU 141 -11.473 11.406 -1.542 1029 HB2 GLU 141 2HB GLU 141 -12.954 11.785 -4.180 1030 HB3 GLU 141 1HB GLU 141 -12.970 10.278 -3.266 1031 HG2 GLU 141 2HG GLU 141 -13.999 11.441 -1.345 1032 HG3 GLU 141 1HG GLU 141 -13.969 12.952 -2.246 1033 H ILE 142 H ILE 142 -11.043 9.232 -2.424 1034 HA ILE 142 HA ILE 142 -9.222 8.879 -4.630 1035 HB ILE 142 HB ILE 142 -7.686 9.817 -2.904 1036 HG12 ILE 142 2HG1 ILE 142 -5.979 7.938 -2.864 1037 HG13 ILE 142 1HG1 ILE 142 -7.211 6.857 -3.504 1038 HG21 ILE 142 1HG2 ILE 142 -8.885 9.133 -0.877 1039 HG22 ILE 142 2HG2 ILE 142 -7.198 8.623 -0.807 1040 HG23 ILE 142 3HG2 ILE 142 -8.458 7.445 -1.172 1041 HD11 ILE 142 3HD1 ILE 142 -5.653 7.648 -5.213 1042 HD12 ILE 142 1HD1 ILE 142 -6.146 9.314 -4.900 1043 HD13 ILE 142 2HD1 ILE 142 -7.307 8.154 -5.556 1044 H THR 143 H THR 143 -8.913 6.605 -5.077 1045 HA THR 143 HA THR 143 -10.920 4.869 -3.773 1046 HB THR 143 HB THR 143 -9.525 4.248 -6.410 1047 HG1 THR 143 HG1 THR 143 -11.951 5.732 -6.271 1048 HG21 THR 143 3HG2 THR 143 -10.951 2.489 -5.440 1049 HG22 THR 143 1HG2 THR 143 -11.676 3.131 -6.913 1050 HG23 THR 143 2HG2 THR 143 -12.301 3.621 -5.336 1051 H LEU 144 H LEU 144 -10.214 3.196 -2.516 1052 HA LEU 144 HA LEU 144 -7.333 2.767 -2.148 1053 HB2 LEU 144 2HB LEU 144 -9.777 2.386 -0.412 1054 HB3 LEU 144 1HB LEU 144 -8.353 1.428 -0.064 1055 HG LEU 144 HG LEU 144 -8.581 3.496 1.351 1056 HD11 LEU 144 1HD1 LEU 144 -6.075 3.418 -0.357 1057 HD12 LEU 144 2HD1 LEU 144 -6.393 2.422 1.059 1058 HD13 LEU 144 3HD1 LEU 144 -6.231 4.166 1.235 1059 HD21 LEU 144 3HD2 LEU 144 -7.967 5.018 -1.207 1060 HD22 LEU 144 1HD2 LEU 144 -8.076 5.698 0.420 1061 HD23 LEU 144 2HD2 LEU 144 -9.511 5.025 -0.350 1062 H ASP 145 H ASP 145 -6.665 1.277 -3.585 1063 HA ASP 145 HA ASP 145 -8.193 -1.097 -4.251 1064 HB2 ASP 145 2HB ASP 145 -5.672 0.232 -5.270 1065 HB3 ASP 145 1HB ASP 145 -6.007 -1.439 -5.713 1066 H PHE 146 H PHE 146 -8.138 -2.209 -2.223 1067 HA PHE 146 HA PHE 146 -5.734 -3.124 -0.967 1068 HB2 PHE 146 2HB PHE 146 -8.450 -4.508 -0.907 1069 HB3 PHE 146 1HB PHE 146 -7.161 -4.622 0.288 1070 HD1 PHE 146 HD2 PHE 146 -6.401 -1.925 0.923 1071 HD2 PHE 146 HD1 PHE 146 -10.304 -3.459 0.055 1072 HE1 PHE 146 HE2 PHE 146 -7.418 -0.106 2.218 1073 HE2 PHE 146 HE1 PHE 146 -11.301 -1.630 1.357 1074 HZ PHE 146 HZ PHE 146 -9.858 0.040 2.435 1075 H ASN 147 H ASN 147 -7.748 -4.245 -3.550 1076 HA ASN 147 HA ASN 147 -6.683 -6.847 -3.941 1077 HB2 ASN 147 2HB ASN 147 -7.972 -6.846 -6.019 1078 HB3 ASN 147 1HB ASN 147 -8.944 -6.153 -4.729 1079 HD21 ASN 147 1HD2 ASN 147 -7.530 -3.502 -4.941 1080 HD22 ASN 147 2HD2 ASN 147 -8.155 -2.787 -6.370 1081 H LEU 148 H LEU 148 -5.280 -3.779 -4.656 1082 HA LEU 148 HA LEU 148 -3.437 -5.029 -6.625 1083 HB2 LEU 148 2HB LEU 148 -3.956 -2.051 -6.246 1084 HB3 LEU 148 1HB LEU 148 -2.921 -2.779 -7.455 1085 HG LEU 148 HG LEU 148 -5.949 -2.686 -7.370 1086 HD11 LEU 148 1HD1 LEU 148 -4.811 -0.801 -8.438 1087 HD12 LEU 148 2HD1 LEU 148 -5.709 -1.738 -9.629 1088 HD13 LEU 148 3HD1 LEU 148 -3.955 -1.903 -9.523 1089 HD21 LEU 148 3HD2 LEU 148 -6.006 -4.189 -9.365 1090 HD22 LEU 148 1HD2 LEU 148 -5.512 -5.005 -7.881 1091 HD23 LEU 148 2HD2 LEU 148 -4.304 -4.565 -9.084 1092 H ALA 149 H ALA 149 -3.479 -4.876 -3.528 1093 HA ALA 149 HA ALA 149 -1.191 -3.352 -2.765 1094 HB1 ALA 149 3HB ALA 149 -2.458 -5.703 -1.315 1095 HB2 ALA 149 1HB ALA 149 -2.899 -4.007 -1.114 1096 HB3 ALA 149 2HB ALA 149 -1.299 -4.566 -0.621 1097 H TYR 150 H TYR 150 0.909 -3.949 -2.450 1098 HA TYR 150 HA TYR 150 1.893 -6.053 -4.240 1099 HB2 TYR 150 2HB TYR 150 3.442 -3.825 -2.848 1100 HB3 TYR 150 1HB TYR 150 3.976 -4.788 -4.226 1101 HD1 TYR 150 HD1 TYR 150 2.339 -4.649 -6.362 1102 HD2 TYR 150 HD2 TYR 150 2.562 -1.657 -3.308 1103 HE1 TYR 150 HE1 TYR 150 1.383 -2.997 -7.900 1104 HE2 TYR 150 HE2 TYR 150 1.620 -0.005 -4.875 1105 HH TYR 150 HH TYR 150 0.165 -0.864 -7.802 1106 H SER 151 H SER 151 3.505 -7.555 -3.608 1107 HA SER 151 HA SER 151 3.520 -8.925 -1.347 1108 HB2 SER 151 2HB SER 151 6.050 -8.322 -2.929 1109 HB3 SER 151 1HB SER 151 5.744 -9.763 -1.953 1110 HG SER 151 HG SER 151 3.901 -10.093 -3.406 1111 HA PRO 152 HA PRO 152 5.223 -6.358 2.036 1112 HB2 PRO 152 2HB PRO 152 5.702 -9.120 3.182 1113 HB3 PRO 152 1HB PRO 152 4.940 -7.699 3.937 1114 HG2 PRO 152 2HG PRO 152 3.423 -9.689 3.099 1115 HG3 PRO 152 1HG PRO 152 2.915 -8.008 2.796 1116 HD2 PRO 152 2HD PRO 152 4.193 -9.967 0.883 1117 HD3 PRO 152 1HD PRO 152 2.841 -8.841 0.610 1118 H PHE 153 H PHE 153 7.245 -6.397 3.383 1119 HA PHE 153 HA PHE 153 9.582 -7.080 1.674 1120 HB2 PHE 153 2HB PHE 153 9.047 -4.513 3.225 1121 HB3 PHE 153 1HB PHE 153 10.640 -4.959 2.645 1122 HD1 PHE 153 HD2 PHE 153 11.169 -4.905 0.230 1123 HD2 PHE 153 HD1 PHE 153 7.350 -3.643 1.676 1124 HE1 PHE 153 HE2 PHE 153 10.771 -3.687 -1.871 1125 HE2 PHE 153 HE1 PHE 153 6.958 -2.426 -0.433 1126 HZ PHE 153 HZ PHE 153 8.672 -2.442 -2.200 1127 H CYS 154 H CYS 154 8.803 -5.842 4.970 1128 HA CYS 154 HA CYS 154 11.075 -7.097 6.173 1129 HB2 CYS 154 2HB CYS 154 10.230 -6.178 8.283 1130 HB3 CYS 154 1HB CYS 154 10.148 -4.964 7.010 1131 HG CYS 154 HG CYS 154 7.720 -4.382 7.380 1132 H ALA 155 H ALA 155 7.622 -7.838 6.050 1133 HA ALA 155 HA ALA 155 7.330 -9.847 7.912 1134 HB1 ALA 155 3HB ALA 155 5.477 -8.883 6.611 1135 HB2 ALA 155 1HB ALA 155 5.434 -10.647 6.578 1136 HB3 ALA 155 2HB ALA 155 6.023 -9.749 5.176 1137 H TYR 156 H TYR 156 8.661 -10.112 4.686 1138 HA TYR 156 HA TYR 156 9.121 -12.998 4.937 1139 HB2 TYR 156 2HB TYR 156 9.298 -11.057 2.614 1140 HB3 TYR 156 1HB TYR 156 9.910 -12.703 2.498 1141 HD1 TYR 156 HD1 TYR 156 6.806 -10.687 2.984 1142 HD2 TYR 156 HD2 TYR 156 8.397 -14.583 2.202 1143 HE1 TYR 156 HE1 TYR 156 4.560 -11.501 2.394 1144 HE2 TYR 156 HE2 TYR 156 6.149 -15.381 1.607 1145 HH TYR 156 HH TYR 156 3.864 -14.849 1.924 1146 H SER 157 H SER 157 10.955 -10.003 5.165 1147 HA SER 157 HA SER 157 13.375 -11.518 5.785 1148 HB2 SER 157 2HB SER 157 13.247 -9.608 3.426 1149 HB3 SER 157 1HB SER 157 14.763 -10.075 4.195 1150 HG SER 157 HG SER 157 12.915 -11.965 3.200 1151 H ASP 158 H ASP 158 14.394 -10.620 7.472 1152 HA ASP 158 HA ASP 158 13.500 -8.138 8.662 1153 HB2 ASP 158 2HB ASP 158 15.669 -10.114 9.506 1154 HB3 ASP 158 1HB ASP 158 15.228 -8.693 10.448 1155 H THR 159 H THR 159 15.905 -8.870 6.349 1156 HA THR 159 HA THR 159 17.788 -6.836 6.755 1157 HB THR 159 HB THR 159 18.092 -8.629 5.064 1158 HG1 THR 159 HG1 THR 159 18.126 -6.245 3.563 1159 HG21 THR 159 3HG2 THR 159 15.734 -8.612 4.169 1160 HG22 THR 159 1HG2 THR 159 16.977 -8.618 2.916 1161 HG23 THR 159 2HG2 THR 159 16.125 -7.126 3.312 1162 H PHE 160 H PHE 160 14.461 -6.669 5.722 1163 HA PHE 160 HA PHE 160 14.623 -3.756 5.273 1164 HB2 PHE 160 2HB PHE 160 12.283 -5.703 4.975 1165 HB3 PHE 160 1HB PHE 160 12.193 -3.970 4.685 1166 HD1 PHE 160 HD1 PHE 160 13.241 -2.974 2.668 1167 HD2 PHE 160 HD2 PHE 160 13.323 -7.204 3.334 1168 HE1 PHE 160 HE1 PHE 160 13.840 -3.341 0.305 1169 HE2 PHE 160 HE2 PHE 160 13.919 -7.555 0.971 1170 HZ PHE 160 HZ PHE 160 14.181 -5.631 -0.542 1171 H SER 161 H SER 161 13.859 -2.416 6.866 1172 HA SER 161 HA SER 161 13.703 -3.415 9.544 1173 HB2 SER 161 2HB SER 161 13.379 -0.938 10.085 1174 HB3 SER 161 1HB SER 161 14.837 -1.329 9.174 1175 HG SER 161 HG SER 161 12.485 -0.626 7.808 1176 H CYS 162 H CYS 162 11.965 -3.367 10.992 1177 HA CYS 162 HA CYS 162 9.311 -3.659 9.904 1178 HB2 CYS 162 2HB CYS 162 9.940 -5.011 11.844 1179 HB3 CYS 162 1HB CYS 162 10.310 -3.565 12.779 1180 HG CYS 162 HG CYS 162 7.480 -2.732 12.416 1181 HA PRO 163 HA PRO 163 8.688 0.856 10.187 1182 HB2 PRO 163 2HB PRO 163 6.199 0.963 9.070 1183 HB3 PRO 163 1HB PRO 163 7.646 0.664 8.086 1184 HG2 PRO 163 2HG PRO 163 5.626 -1.303 9.108 1185 HG3 PRO 163 1HG PRO 163 6.391 -1.203 7.505 1186 HD2 PRO 163 2HD PRO 163 7.232 -2.941 9.458 1187 HD3 PRO 163 1HD PRO 163 8.309 -2.290 8.203 1188 H LEU 164 H LEU 164 7.034 2.303 11.311 1189 HA LEU 164 HA LEU 164 5.789 0.946 13.618 1190 HB2 LEU 164 2HB LEU 164 7.283 2.830 14.183 1191 HB3 LEU 164 1HB LEU 164 6.385 3.897 13.116 1192 HG LEU 164 HG LEU 164 4.387 3.704 14.596 1193 HD11 LEU 164 1HD1 LEU 164 4.733 1.473 15.532 1194 HD12 LEU 164 2HD1 LEU 164 4.539 2.654 16.824 1195 HD13 LEU 164 3HD1 LEU 164 6.146 2.037 16.429 1196 HD21 LEU 164 3HD2 LEU 164 5.920 5.573 14.944 1197 HD22 LEU 164 1HD2 LEU 164 6.902 4.601 16.045 1198 HD23 LEU 164 2HD2 LEU 164 5.251 5.046 16.486 1199 HA PRO 165 HA PRO 165 2.208 1.507 10.802 1200 HB2 PRO 165 2HB PRO 165 0.780 -0.381 12.616 1201 HB3 PRO 165 1HB PRO 165 1.173 -0.561 10.893 1202 HG2 PRO 165 2HG PRO 165 2.400 -2.033 12.782 1203 HG3 PRO 165 1HG PRO 165 3.244 -1.505 11.306 1204 HD2 PRO 165 2HD PRO 165 3.357 -0.296 14.078 1205 HD3 PRO 165 1HD PRO 165 4.687 -0.652 12.950 1206 HA PRO 166 HA PRO 166 0.159 4.568 13.556 1207 HB2 PRO 166 2HB PRO 166 -1.646 5.460 11.656 1208 HB3 PRO 166 1HB PRO 166 0.038 6.014 11.690 1209 HG2 PRO 166 2HG PRO 166 -1.182 3.832 10.013 1210 HG3 PRO 166 1HG PRO 166 -0.109 5.160 9.512 1211 HD2 PRO 166 2HD PRO 166 0.898 2.717 9.930 1212 HD3 PRO 166 1HD PRO 166 1.801 4.158 10.455 1213 H GLU 167 H GLU 167 -1.290 3.711 15.014 1214 HA GLU 167 HA GLU 167 -2.358 1.189 14.839 1215 HB2 GLU 167 2HB GLU 167 -3.312 3.473 16.612 1216 HB3 GLU 167 1HB GLU 167 -3.701 1.773 16.874 1217 HG2 GLU 167 2HG GLU 167 -1.315 1.253 17.197 1218 HG3 GLU 167 1HG GLU 167 -0.896 2.940 16.891 1219 H SER 168 H SER 168 -3.838 4.027 13.556 1220 HA SER 168 HA SER 168 -6.560 3.212 13.400 1221 HB2 SER 168 2HB SER 168 -5.055 5.209 11.670 1222 HB3 SER 168 1HB SER 168 -6.796 5.145 11.909 1223 HG SER 168 HG SER 168 -5.500 5.283 14.293 1224 H ASN 169 H ASN 169 -3.858 2.028 11.654 1225 HA ASN 169 HA ASN 169 -5.240 1.730 9.075 1226 HB2 ASN 169 2HB ASN 169 -3.115 1.266 8.079 1227 HB3 ASN 169 1HB ASN 169 -2.832 2.604 9.177 1228 HD21 ASN 169 1HD2 ASN 169 -0.860 0.804 8.109 1229 HD22 ASN 169 2HD2 ASN 169 -0.114 0.015 9.451 1230 H TRP 170 H TRP 170 -4.902 0.100 11.915 1231 HA TRP 170 HA TRP 170 -4.681 -2.616 10.973 1232 HB2 TRP 170 2HB TRP 170 -5.515 -1.460 13.671 1233 HB3 TRP 170 1HB TRP 170 -5.299 -3.179 13.352 1234 HD1 TRP 170 HD1 TRP 170 -2.489 -2.327 11.541 1235 HE1 TRP 170 HE1 TRP 170 -0.357 -2.047 12.939 1236 HE3 TRP 170 HE3 TRP 170 -4.608 -1.706 16.163 1237 HZ2 TRP 170 HZ2 TRP 170 0.353 -1.637 15.626 1238 HZ3 TRP 170 HZ3 TRP 170 -3.121 -1.379 18.099 1239 HH2 TRP 170 HH2 TRP 170 -0.689 -1.345 17.837 1240 H LEU 171 H LEU 171 -6.322 -3.364 9.720 1241 HA LEU 171 HA LEU 171 -9.081 -2.461 10.093 1242 HB2 LEU 171 2HB LEU 171 -8.129 -4.539 8.080 1243 HB3 LEU 171 1HB LEU 171 -9.565 -3.538 8.010 1244 HG LEU 171 HG LEU 171 -6.694 -2.701 7.448 1245 HD11 LEU 171 1HD1 LEU 171 -9.154 -2.701 5.667 1246 HD12 LEU 171 2HD1 LEU 171 -7.820 -3.855 5.604 1247 HD13 LEU 171 3HD1 LEU 171 -7.536 -2.164 5.203 1248 HD21 LEU 171 3HD2 LEU 171 -7.732 -0.869 8.700 1249 HD22 LEU 171 1HD2 LEU 171 -9.101 -0.856 7.586 1250 HD23 LEU 171 2HD2 LEU 171 -7.490 -0.416 7.016 1251 H GLU 172 H GLU 172 -10.319 -3.595 11.564 1252 HA GLU 172 HA GLU 172 -9.499 -6.244 12.517 1253 HB2 GLU 172 2HB GLU 172 -10.173 -4.402 14.107 1254 HB3 GLU 172 1HB GLU 172 -11.779 -4.393 13.393 1255 HG2 GLU 172 2HG GLU 172 -11.782 -5.545 15.553 1256 HG3 GLU 172 1HG GLU 172 -12.198 -6.658 14.255 1257 H THR 173 H THR 173 -10.061 -6.523 9.970 1258 HA THR 173 HA THR 173 -12.500 -8.021 9.715 1259 HB THR 173 HB THR 173 -13.341 -5.736 9.252 1260 HG1 THR 173 HG1 THR 173 -14.384 -7.259 8.102 1261 HG21 THR 173 3HG2 THR 173 -12.616 -4.482 7.251 1262 HG22 THR 173 1HG2 THR 173 -11.340 -5.666 6.952 1263 HG23 THR 173 2HG2 THR 173 -11.287 -4.652 8.396 1264 H ALA 174 H ALA 174 -12.519 -9.281 7.780 1265 HA ALA 174 HA ALA 174 -9.828 -10.054 6.929 1266 HB1 ALA 174 3HB ALA 174 -11.394 -11.814 7.660 1267 HB2 ALA 174 1HB ALA 174 -10.967 -12.029 5.961 1268 HB3 ALA 174 2HB ALA 174 -12.534 -11.346 6.397 1269 H VAL 175 H VAL 175 -9.023 -8.990 5.214 1270 HA VAL 175 HA VAL 175 -10.737 -7.914 3.088 1271 HB VAL 175 HB VAL 175 -7.697 -7.772 3.456 1272 HG11 VAL 175 1HG1 VAL 175 -8.254 -7.721 1.053 1273 HG12 VAL 175 2HG1 VAL 175 -7.683 -6.141 1.587 1274 HG13 VAL 175 3HG1 VAL 175 -9.409 -6.413 1.329 1275 HG21 VAL 175 3HG2 VAL 175 -8.095 -5.374 3.974 1276 HG22 VAL 175 1HG2 VAL 175 -8.934 -6.432 5.112 1277 HG23 VAL 175 2HG2 VAL 175 -9.835 -5.631 3.824 1278 H THR 176 H THR 176 -11.558 -9.842 2.241 1279 HA THR 176 HA THR 176 -9.788 -11.827 1.058 1280 HB THR 176 HB THR 176 -11.963 -12.850 0.245 1281 HG1 THR 176 HG1 THR 176 -13.265 -10.987 0.159 1282 HG21 THR 176 3HG2 THR 176 -12.768 -13.559 2.473 1283 HG22 THR 176 1HG2 THR 176 -11.855 -12.249 3.225 1284 HG23 THR 176 2HG2 THR 176 -11.004 -13.563 2.408 1285 H ALA 177 H ALA 177 -8.622 -10.536 -0.361 1286 HA ALA 177 HA ALA 177 -9.957 -9.811 -2.886 1287 HB1 ALA 177 3HB ALA 177 -9.833 -7.712 -1.611 1288 HB2 ALA 177 1HB ALA 177 -8.723 -7.662 -2.983 1289 HB3 ALA 177 2HB ALA 177 -8.101 -7.943 -1.354 1290 H GLY 178 H GLY 178 -8.785 -10.430 -4.589 1291 HA2 GLY 178 2HA GLY 178 -7.287 -11.590 -5.825 1292 HA3 GLY 178 1HA GLY 178 -6.044 -10.915 -4.790 1293 H GLU 179 H GLU 179 -5.055 -12.997 -5.319 1294 HA GLU 179 HA GLU 179 -6.021 -15.448 -4.166 1295 HB2 GLU 179 2HB GLU 179 -4.284 -14.899 -6.191 1296 HB3 GLU 179 1HB GLU 179 -3.107 -15.093 -4.908 1297 HG2 GLU 179 2HG GLU 179 -5.128 -17.164 -5.813 1298 HG3 GLU 179 1HG GLU 179 -3.413 -17.159 -6.203 1299 H ARG 180 H ARG 180 -5.115 -16.523 -2.325 1300 HA ARG 180 HA ARG 180 -3.593 -14.907 -0.379 1301 HB2 ARG 180 2HB ARG 180 -6.337 -16.129 0.192 1302 HB3 ARG 180 1HB ARG 180 -5.260 -15.510 1.437 1303 HG2 ARG 180 2HG ARG 180 -6.386 -13.819 -0.813 1304 HG3 ARG 180 1HG ARG 180 -7.124 -13.953 0.783 1305 HD2 ARG 180 2HD ARG 180 -5.231 -12.906 1.840 1306 HD3 ARG 180 1HD ARG 180 -4.266 -13.013 0.363 1307 HE ARG 180 HE ARG 180 -6.165 -11.496 -0.561 1308 HH11 ARG 180 1HH1 ARG 180 -4.705 -11.230 2.625 1309 HH12 ARG 180 2HH1 ARG 180 -4.995 -9.528 2.739 1310 HH21 ARG 180 1HH2 ARG 180 -6.493 -9.271 -0.412 1311 HH22 ARG 180 2HH2 ARG 180 -6.009 -8.414 1.015 1312 H THR 181 H THR 181 -2.091 -16.203 0.621 1313 HA THR 181 HA THR 181 -1.699 -18.896 0.196 1314 HB THR 181 HB THR 181 -0.265 -18.838 2.322 1315 HG1 THR 181 HG1 THR 181 -1.625 -17.154 3.321 1316 HG21 THR 181 3HG2 THR 181 1.397 -17.247 1.431 1317 HG22 THR 181 1HG2 THR 181 0.178 -16.567 0.349 1318 HG23 THR 181 2HG2 THR 181 0.712 -18.236 0.140 1319 H ASP 182 H ASP 182 -3.132 -20.431 0.559 1320 HA ASP 182 HA ASP 182 -5.207 -20.546 2.461 1321 HB2 ASP 182 2HB ASP 182 -5.124 -21.882 0.359 1322 HB3 ASP 182 1HB ASP 182 -3.822 -22.858 1.026 1323 H LEU 183 H LEU 183 -5.462 -22.118 4.293 1324 HA LEU 183 HA LEU 183 -3.487 -21.691 6.249 1325 HB2 LEU 183 2HB LEU 183 -4.781 -23.026 7.786 1326 HB3 LEU 183 1HB LEU 183 -5.844 -21.986 6.870 1327 HG LEU 183 HG LEU 183 -5.509 -24.916 6.127 1328 HD11 LEU 183 1HD1 LEU 183 -7.496 -25.439 7.484 1329 HD12 LEU 183 2HD1 LEU 183 -7.512 -23.791 8.120 1330 HD13 LEU 183 3HD1 LEU 183 -6.165 -24.868 8.490 1331 HD21 LEU 183 3HD2 LEU 183 -7.794 -22.966 5.659 1332 HD22 LEU 183 1HD2 LEU 183 -7.742 -24.653 5.135 1333 HD23 LEU 183 2HD2 LEU 183 -6.615 -23.485 4.452 1334 H GLU 184 H GLU 184 -3.921 -24.380 4.054 1335 HA GLU 184 HA GLU 184 -1.289 -25.413 4.958 1336 HB2 GLU 184 2HB GLU 184 -1.917 -27.644 4.085 1337 HB3 GLU 184 1HB GLU 184 -2.976 -27.131 5.393 1338 HG2 GLU 184 2HG GLU 184 -4.705 -26.499 3.723 1339 HG3 GLU 184 1HG GLU 184 -3.647 -27.075 2.435 1340 H HIS 185 H HIS 185 -0.084 -26.446 3.149 1341 HA HIS 185 HA HIS 185 0.585 -24.652 1.194 1342 HB2 HIS 185 2HB HIS 185 1.912 -26.499 0.147 1343 HB3 HIS 185 1HB HIS 185 2.106 -26.407 1.895 1344 HD1 HIS 185 HD1 HIS 185 1.719 -28.830 -0.654 1345 HD2 HIS 185 HD2 HIS 185 0.175 -28.425 3.185 1346 HE1 HIS 185 HE1 HIS 185 0.982 -31.135 0.026 1347 HE2 HIS 185 HE2 HIS 185 -0.032 -30.844 2.307 Start of MODEL 5 1 H1 MET 1 1H MET 1 -20.646 -1.350 -17.129 2 H2 MET 1 2H MET 1 -20.210 -2.217 -18.509 3 H3 MET 1 3H MET 1 -21.540 -1.175 -18.554 4 HA MET 1 HA MET 1 -19.664 -0.227 -19.662 5 HB2 MET 1 2HB MET 1 -19.598 1.953 -18.437 6 HB3 MET 1 1HB MET 1 -21.220 1.337 -18.667 7 HG2 MET 1 2HG MET 1 -21.287 0.612 -16.316 8 HG3 MET 1 1HG MET 1 -19.644 1.219 -16.083 9 HE1 MET 1 3HE MET 1 -21.961 2.152 -14.145 10 HE2 MET 1 1HE MET 1 -21.700 3.897 -14.099 11 HE3 MET 1 2HE MET 1 -20.322 2.799 -14.059 12 H ASP 2 H ASP 2 -17.872 -1.482 -19.717 13 HA ASP 2 HA ASP 2 -16.002 -1.542 -17.421 14 HB2 ASP 2 2HB ASP 2 -16.137 -3.261 -19.947 15 HB3 ASP 2 1HB ASP 2 -14.880 -3.392 -18.717 16 H GLU 3 H GLU 3 -16.520 0.444 -19.935 17 HA GLU 3 HA GLU 3 -13.974 0.655 -21.223 18 HB2 GLU 3 2HB GLU 3 -16.244 2.684 -21.035 19 HB3 GLU 3 1HB GLU 3 -14.828 2.869 -22.065 20 HG2 GLU 3 2HG GLU 3 -16.664 2.152 -23.419 21 HG3 GLU 3 1HG GLU 3 -15.513 0.825 -23.317 22 H ASP 4 H ASP 4 -15.460 2.097 -18.407 23 HA ASP 4 HA ASP 4 -13.374 4.007 -17.809 24 HB2 ASP 4 2HB ASP 4 -15.742 4.284 -17.051 25 HB3 ASP 4 1HB ASP 4 -15.599 2.846 -16.046 26 H THR 5 H THR 5 -14.288 0.768 -16.747 27 HA THR 5 HA THR 5 -12.446 0.565 -14.575 28 HB THR 5 HB THR 5 -13.941 -1.719 -15.949 29 HG1 THR 5 HG1 THR 5 -14.850 0.325 -14.193 30 HG21 THR 5 3HG2 THR 5 -13.086 -1.351 -13.038 31 HG22 THR 5 1HG2 THR 5 -12.334 -2.450 -14.195 32 HG23 THR 5 2HG2 THR 5 -14.000 -2.716 -13.682 33 H GLU 6 H GLU 6 -12.288 -0.268 -18.001 34 HA GLU 6 HA GLU 6 -9.999 -1.972 -17.849 35 HB2 GLU 6 2HB GLU 6 -9.844 -1.811 -20.255 36 HB3 GLU 6 1HB GLU 6 -11.539 -1.966 -19.808 37 HG2 GLU 6 2HG GLU 6 -11.831 0.477 -20.134 38 HG3 GLU 6 1HG GLU 6 -10.136 0.595 -20.597 39 H ASP 7 H ASP 7 -10.406 1.507 -17.902 40 HA ASP 7 HA ASP 7 -7.696 2.175 -18.530 41 HB2 ASP 7 2HB ASP 7 -9.541 3.783 -18.852 42 HB3 ASP 7 1HB ASP 7 -9.845 3.813 -17.117 43 H TRP 8 H TRP 8 -9.488 1.822 -15.445 44 HA TRP 8 HA TRP 8 -7.349 1.951 -13.663 45 HB2 TRP 8 2HB TRP 8 -9.531 1.736 -12.736 46 HB3 TRP 8 1HB TRP 8 -9.879 0.273 -13.645 47 HD1 TRP 8 HD1 TRP 8 -7.568 1.375 -10.680 48 HE1 TRP 8 HE1 TRP 8 -7.324 -0.626 -9.090 49 HE3 TRP 8 HE3 TRP 8 -10.129 -2.151 -13.373 50 HZ2 TRP 8 HZ2 TRP 8 -8.076 -3.330 -8.983 51 HZ3 TRP 8 HZ3 TRP 8 -10.318 -4.422 -12.447 52 HH2 TRP 8 HH2 TRP 8 -9.313 -5.004 -10.298 53 H GLU 9 H GLU 9 -8.354 -0.791 -15.716 54 HA GLU 9 HA GLU 9 -6.299 -2.559 -14.726 55 HB2 GLU 9 2HB GLU 9 -8.566 -3.240 -15.716 56 HB3 GLU 9 1HB GLU 9 -7.893 -2.891 -17.304 57 HG2 GLU 9 2HG GLU 9 -6.219 -4.636 -17.022 58 HG3 GLU 9 1HG GLU 9 -6.739 -4.923 -15.363 59 H THR 10 H THR 10 -6.359 -0.007 -17.026 60 HA THR 10 HA THR 10 -4.065 -0.718 -18.610 61 HB THR 10 HB THR 10 -5.396 1.991 -18.149 62 HG1 THR 10 HG1 THR 10 -6.382 0.024 -19.417 63 HG21 THR 10 3HG2 THR 10 -3.355 1.243 -20.282 64 HG22 THR 10 1HG2 THR 10 -3.074 2.337 -18.922 65 HG23 THR 10 2HG2 THR 10 -4.227 2.773 -20.181 66 H GLN 11 H GLN 11 -4.563 1.685 -15.915 67 HA GLN 11 HA GLN 11 -1.841 2.189 -15.460 68 HB2 GLN 11 2HB GLN 11 -2.408 3.121 -13.315 69 HB3 GLN 11 1HB GLN 11 -3.705 3.545 -14.422 70 HG2 GLN 11 2HG GLN 11 -5.205 2.000 -13.432 71 HG3 GLN 11 1HG GLN 11 -3.917 1.166 -12.576 72 HE21 GLN 11 1HE2 GLN 11 -6.047 3.909 -12.539 73 HE22 GLN 11 2HE2 GLN 11 -5.693 4.421 -10.930 74 H LEU 12 H LEU 12 -3.918 -0.461 -14.384 75 HA LEU 12 HA LEU 12 -2.270 -1.593 -12.399 76 HB2 LEU 12 2HB LEU 12 -4.569 -2.217 -12.455 77 HB3 LEU 12 1HB LEU 12 -4.490 -2.665 -14.149 78 HG LEU 12 HG LEU 12 -3.127 -4.662 -13.549 79 HD11 LEU 12 1HD1 LEU 12 -2.045 -3.928 -11.516 80 HD12 LEU 12 2HD1 LEU 12 -2.950 -5.407 -11.208 81 HD13 LEU 12 3HD1 LEU 12 -3.592 -3.854 -10.667 82 HD21 LEU 12 3HD2 LEU 12 -4.973 -5.977 -12.611 83 HD22 LEU 12 1HD2 LEU 12 -5.551 -4.847 -13.832 84 HD23 LEU 12 2HD2 LEU 12 -5.802 -4.496 -12.120 85 H GLN 13 H GLN 13 -2.598 -2.441 -15.915 86 HA GLN 13 HA GLN 13 -0.704 -4.536 -15.851 87 HB2 GLN 13 2HB GLN 13 -0.710 -4.491 -18.280 88 HB3 GLN 13 1HB GLN 13 -2.350 -4.257 -17.691 89 HG2 GLN 13 2HG GLN 13 -2.092 -1.809 -18.088 90 HG3 GLN 13 1HG GLN 13 -0.505 -2.121 -18.784 91 HE21 GLN 13 1HE2 GLN 13 -1.407 -4.593 -20.166 92 HE22 GLN 13 2HE2 GLN 13 -2.360 -4.052 -21.499 93 H ALA 14 H ALA 14 -0.326 -1.075 -16.150 94 HA ALA 14 HA ALA 14 2.462 -1.053 -16.816 95 HB1 ALA 14 3HB ALA 14 0.997 0.850 -17.323 96 HB2 ALA 14 1HB ALA 14 2.352 1.350 -16.307 97 HB3 ALA 14 2HB ALA 14 0.746 1.140 -15.602 98 H ASN 15 H ASN 15 0.648 -0.640 -13.737 99 HA ASN 15 HA ASN 15 2.775 -0.225 -11.972 100 HB2 ASN 15 2HB ASN 15 -0.020 -1.334 -11.565 101 HB3 ASN 15 1HB ASN 15 1.115 -1.452 -10.233 102 HD21 ASN 15 1HD2 ASN 15 -1.077 0.614 -11.843 103 HD22 ASN 15 2HD2 ASN 15 -0.740 2.052 -10.957 104 H ARG 16 H ARG 16 1.143 -3.310 -12.710 105 HA ARG 16 HA ARG 16 2.744 -4.944 -11.064 106 HB2 ARG 16 2HB ARG 16 1.583 -6.815 -12.052 107 HB3 ARG 16 1HB ARG 16 0.430 -5.495 -11.915 108 HG2 ARG 16 2HG ARG 16 1.041 -4.992 -14.392 109 HG3 ARG 16 1HG ARG 16 1.734 -6.611 -14.393 110 HD2 ARG 16 2HD ARG 16 -1.156 -5.878 -13.823 111 HD3 ARG 16 1HD ARG 16 -0.538 -6.659 -15.277 112 HE ARG 16 HE ARG 16 0.174 -8.365 -13.266 113 HH11 ARG 16 1HH1 ARG 16 -2.911 -6.987 -14.316 114 HH12 ARG 16 2HH1 ARG 16 -3.838 -8.349 -13.771 115 HH21 ARG 16 1HH2 ARG 16 -1.062 -10.154 -12.589 116 HH22 ARG 16 2HH2 ARG 16 -2.786 -10.145 -12.789 117 H ASP 17 H ASP 17 3.221 -3.787 -14.316 118 HA ASP 17 HA ASP 17 5.303 -5.573 -15.127 119 HB2 ASP 17 2HB ASP 17 3.881 -4.323 -16.724 120 HB3 ASP 17 1HB ASP 17 4.521 -2.796 -16.130 121 H GLU 18 H GLU 18 5.362 -2.129 -14.079 122 HA GLU 18 HA GLU 18 8.200 -1.889 -14.116 123 HB2 GLU 18 2HB GLU 18 7.837 0.337 -13.128 124 HB3 GLU 18 1HB GLU 18 6.710 0.049 -14.449 125 HG2 GLU 18 2HG GLU 18 4.962 -0.564 -12.711 126 HG3 GLU 18 1HG GLU 18 6.106 -0.048 -11.477 127 H LYS 19 H LYS 19 5.904 -2.807 -11.642 128 HA LYS 19 HA LYS 19 7.865 -2.595 -9.477 129 HB2 LYS 19 2HB LYS 19 4.911 -3.341 -9.377 130 HB3 LYS 19 1HB LYS 19 5.958 -3.139 -7.971 131 HG2 LYS 19 2HG LYS 19 6.339 -0.768 -8.595 132 HG3 LYS 19 1HG LYS 19 5.281 -0.970 -9.989 133 HD2 LYS 19 2HD LYS 19 3.380 -1.457 -8.406 134 HD3 LYS 19 1HD LYS 19 4.472 -1.109 -7.058 135 HE2 LYS 19 2HE LYS 19 4.838 1.187 -8.004 136 HE3 LYS 19 1HE LYS 19 3.648 0.825 -9.256 137 HZ1 LYS 19 3HZ LYS 19 1.997 0.498 -7.478 138 HZ2 LYS 19 1HZ LYS 19 2.639 2.065 -7.495 139 HZ3 LYS 19 2HZ LYS 19 3.161 0.957 -6.333 140 H ASP 20 H ASP 20 6.793 -5.002 -11.681 141 HA ASP 20 HA ASP 20 7.562 -7.276 -10.075 142 HB2 ASP 20 2HB ASP 20 6.086 -7.489 -12.086 143 HB3 ASP 20 1HB ASP 20 7.455 -7.090 -13.118 144 H ARG 21 H ARG 21 9.180 -5.205 -12.448 145 HA ARG 21 HA ARG 21 11.736 -6.594 -12.233 146 HB2 ARG 21 2HB ARG 21 12.663 -4.932 -13.726 147 HB3 ARG 21 1HB ARG 21 11.120 -5.473 -14.376 148 HG2 ARG 21 2HG ARG 21 10.055 -3.431 -13.913 149 HG3 ARG 21 1HG ARG 21 11.248 -2.972 -12.698 150 HD2 ARG 21 2HD ARG 21 11.754 -3.102 -15.682 151 HD3 ARG 21 1HD ARG 21 11.472 -1.638 -14.746 152 HE ARG 21 HE ARG 21 13.555 -2.314 -13.464 153 HH11 ARG 21 1HH1 ARG 21 13.158 -3.079 -16.884 154 HH12 ARG 21 2HH1 ARG 21 14.865 -3.095 -17.196 155 HH21 ARG 21 1HH2 ARG 21 15.788 -2.341 -13.899 156 HH22 ARG 21 2HH2 ARG 21 16.361 -2.673 -15.508 157 H PHE 22 H PHE 22 10.073 -4.228 -10.454 158 HA PHE 22 HA PHE 22 12.285 -2.954 -9.195 159 HB2 PHE 22 2HB PHE 22 9.826 -2.209 -9.207 160 HB3 PHE 22 1HB PHE 22 9.531 -3.427 -7.973 161 HD1 PHE 22 HD2 PHE 22 10.523 -3.169 -5.706 162 HD2 PHE 22 HD1 PHE 22 10.977 -0.153 -8.697 163 HE1 PHE 22 HE2 PHE 22 11.222 -1.566 -3.992 164 HE2 PHE 22 HE1 PHE 22 11.675 1.447 -6.974 165 HZ PHE 22 HZ PHE 22 11.799 0.742 -4.619 166 H PHE 23 H PHE 23 10.578 -5.982 -8.704 167 HA PHE 23 HA PHE 23 12.099 -6.631 -6.266 168 HB2 PHE 23 2HB PHE 23 9.740 -7.975 -7.635 169 HB3 PHE 23 1HB PHE 23 10.616 -8.721 -6.304 170 HD1 PHE 23 HD2 PHE 23 9.321 -5.200 -6.861 171 HD2 PHE 23 HD1 PHE 23 9.282 -8.686 -4.391 172 HE1 PHE 23 HE2 PHE 23 7.844 -4.058 -5.258 173 HE2 PHE 23 HE1 PHE 23 7.810 -7.539 -2.792 174 HZ PHE 23 HZ PHE 23 7.093 -5.229 -3.216 175 H SER 24 H SER 24 12.434 -7.016 -9.612 176 HA SER 24 HA SER 24 14.078 -9.467 -9.346 177 HB2 SER 24 2HB SER 24 13.092 -8.104 -11.884 178 HB3 SER 24 1HB SER 24 13.905 -9.666 -11.782 179 HG SER 24 HG SER 24 11.965 -10.070 -10.230 180 H GLU 25 H GLU 25 14.259 -6.169 -10.810 181 HA GLU 25 HA GLU 25 17.120 -6.589 -11.390 182 HB2 GLU 25 2HB GLU 25 15.174 -4.565 -12.590 183 HB3 GLU 25 1HB GLU 25 16.853 -4.786 -13.065 184 HG2 GLU 25 2HG GLU 25 14.618 -6.798 -13.409 185 HG3 GLU 25 1HG GLU 25 15.342 -5.815 -14.677 186 H HIS 26 H HIS 26 14.825 -4.270 -9.936 187 HA HIS 26 HA HIS 26 16.857 -2.275 -9.410 188 HB2 HIS 26 2HB HIS 26 14.534 -1.598 -9.887 189 HB3 HIS 26 1HB HIS 26 13.963 -2.449 -8.456 190 HD2 HIS 26 HD2 HIS 26 16.086 0.751 -9.340 191 HE1 HIS 26 HE1 HIS 26 14.797 0.967 -5.320 192 HE2 HIS 26 HE2 HIS 26 16.188 2.076 -7.117 193 H ARG 27 H ARG 27 14.711 -4.153 -7.240 194 HA ARG 27 HA ARG 27 16.876 -4.393 -5.243 195 HB2 ARG 27 2HB ARG 27 13.880 -4.019 -4.731 196 HB3 ARG 27 1HB ARG 27 15.049 -4.452 -3.486 197 HG2 ARG 27 2HG ARG 27 15.033 -1.875 -5.078 198 HG3 ARG 27 1HG ARG 27 14.474 -2.056 -3.417 199 HD2 ARG 27 2HD ARG 27 16.672 -2.403 -2.597 200 HD3 ARG 27 1HD ARG 27 17.319 -2.758 -4.199 201 HE ARG 27 HE ARG 27 16.541 -0.073 -3.213 202 HH11 ARG 27 1HH1 ARG 27 18.403 -2.059 -5.434 203 HH12 ARG 27 2HH1 ARG 27 19.289 -0.716 -6.079 204 HH21 ARG 27 1HH2 ARG 27 17.721 1.678 -4.107 205 HH22 ARG 27 2HH2 ARG 27 18.908 1.374 -5.340 206 H GLN 28 H GLN 28 16.855 -6.437 -4.130 207 HA GLN 28 HA GLN 28 16.048 -8.685 -5.723 208 HB2 GLN 28 2HB GLN 28 17.145 -8.613 -2.877 209 HB3 GLN 28 1HB GLN 28 17.100 -10.026 -3.930 210 HG2 GLN 28 2HG GLN 28 18.713 -7.502 -4.416 211 HG3 GLN 28 1HG GLN 28 19.352 -9.025 -3.811 212 HE21 GLN 28 1HE2 GLN 28 18.072 -7.373 -6.622 213 HE22 GLN 28 2HE2 GLN 28 18.612 -8.525 -7.795 214 H SER 29 H SER 29 14.335 -10.088 -5.399 215 HA SER 29 HA SER 29 11.992 -9.254 -4.158 216 HB2 SER 29 2HB SER 29 11.188 -11.616 -4.597 217 HB3 SER 29 1HB SER 29 11.927 -10.835 -5.993 218 HG SER 29 HG SER 29 13.665 -12.285 -4.396 219 HA PRO 30 HA PRO 30 12.827 -10.122 0.205 220 HB2 PRO 30 2HB PRO 30 10.248 -9.866 1.146 221 HB3 PRO 30 1HB PRO 30 11.246 -8.471 0.688 222 HG2 PRO 30 2HG PRO 30 9.174 -9.899 -0.961 223 HG3 PRO 30 1HG PRO 30 9.374 -8.150 -0.670 224 HD2 PRO 30 2HD PRO 30 10.300 -9.231 -2.922 225 HD3 PRO 30 1HD PRO 30 11.252 -7.993 -2.071 226 H ILE 31 H ILE 31 10.645 -11.919 -1.806 227 HA ILE 31 HA ILE 31 10.083 -14.128 -0.135 228 HB ILE 31 HB ILE 31 10.559 -14.476 -3.133 229 HG12 ILE 31 2HG1 ILE 31 9.301 -12.330 -2.910 230 HG13 ILE 31 1HG1 ILE 31 8.366 -13.572 -3.719 231 HG21 ILE 31 1HG2 ILE 31 8.454 -15.641 -1.274 232 HG22 ILE 31 2HG2 ILE 31 9.905 -16.459 -1.849 233 HG23 ILE 31 3HG2 ILE 31 8.638 -16.021 -2.993 234 HD11 ILE 31 3HD1 ILE 31 7.106 -13.929 -1.617 235 HD12 ILE 31 1HD1 ILE 31 6.973 -12.285 -2.243 236 HD13 ILE 31 2HD1 ILE 31 8.032 -12.621 -0.876 237 HA PRO 32 HA PRO 32 14.562 -14.846 0.385 238 HB2 PRO 32 2HB PRO 32 14.386 -17.196 1.927 239 HB3 PRO 32 1HB PRO 32 14.294 -15.546 2.567 240 HG2 PRO 32 2HG PRO 32 12.088 -17.460 1.963 241 HG3 PRO 32 1HG PRO 32 12.239 -16.278 3.280 242 HD2 PRO 32 2HD PRO 32 10.649 -15.821 1.131 243 HD3 PRO 32 1HD PRO 32 11.498 -14.515 1.976 244 HA PRO 33 HA PRO 33 16.009 -17.354 -2.970 245 HB2 PRO 33 2HB PRO 33 18.064 -18.850 -1.578 246 HB3 PRO 33 1HB PRO 33 18.250 -17.374 -2.538 247 HG2 PRO 33 2HG PRO 33 17.986 -17.668 0.415 248 HG3 PRO 33 1HG PRO 33 18.856 -16.441 -0.536 249 HD2 PRO 33 2HD PRO 33 16.558 -15.829 0.687 250 HD3 PRO 33 1HD PRO 33 16.927 -15.178 -0.922 251 H GLU 34 H GLU 34 15.607 -19.268 0.022 252 HA GLU 34 HA GLU 34 15.164 -21.802 -1.232 253 HB2 GLU 34 2HB GLU 34 14.306 -20.788 1.517 254 HB3 GLU 34 1HB GLU 34 14.273 -22.477 1.010 255 HG2 GLU 34 2HG GLU 34 16.698 -22.507 0.799 256 HG3 GLU 34 1HG GLU 34 16.789 -20.788 1.174 257 H GLU 35 H GLU 35 12.964 -19.266 -0.023 258 HA GLU 35 HA GLU 35 10.546 -20.698 -0.427 259 HB2 GLU 35 2HB GLU 35 10.921 -18.739 1.167 260 HB3 GLU 35 1HB GLU 35 10.845 -17.680 -0.234 261 HG2 GLU 35 2HG GLU 35 8.711 -17.607 0.788 262 HG3 GLU 35 1HG GLU 35 8.514 -18.570 -0.673 263 H ARG 36 H ARG 36 12.271 -18.245 -2.418 264 HA ARG 36 HA ARG 36 10.122 -17.904 -4.268 265 HB2 ARG 36 2HB ARG 36 11.682 -16.438 -5.487 266 HB3 ARG 36 1HB ARG 36 11.640 -16.043 -3.774 267 HG2 ARG 36 2HG ARG 36 13.782 -17.142 -3.417 268 HG3 ARG 36 1HG ARG 36 13.814 -17.697 -5.091 269 HD2 ARG 36 2HD ARG 36 13.907 -14.799 -4.174 270 HD3 ARG 36 1HD ARG 36 15.267 -15.743 -4.795 271 HE ARG 36 HE ARG 36 12.940 -15.467 -6.535 272 HH11 ARG 36 1HH1 ARG 36 16.171 -14.280 -5.804 273 HH12 ARG 36 2HH1 ARG 36 16.365 -13.539 -7.359 274 HH21 ARG 36 1HH2 ARG 36 13.220 -14.524 -8.554 275 HH22 ARG 36 2HH2 ARG 36 14.689 -13.681 -8.923 276 H ASP 37 H ASP 37 12.506 -20.256 -3.916 277 HA ASP 37 HA ASP 37 12.780 -21.145 -6.609 278 HB2 ASP 37 2HB ASP 37 14.280 -21.911 -4.802 279 HB3 ASP 37 1HB ASP 37 12.931 -22.664 -3.960 280 H ASP 38 H ASP 38 10.430 -21.757 -4.015 281 HA ASP 38 HA ASP 38 8.735 -23.438 -5.701 282 HB2 ASP 38 2HB ASP 38 8.971 -24.036 -3.343 283 HB3 ASP 38 1HB ASP 38 8.397 -22.451 -2.840 284 H PHE 39 H PHE 39 8.686 -20.123 -4.379 285 HA PHE 39 HA PHE 39 6.258 -19.519 -5.990 286 HB2 PHE 39 2HB PHE 39 7.395 -17.952 -3.616 287 HB3 PHE 39 1HB PHE 39 5.943 -17.535 -4.517 288 HD1 PHE 39 HD2 PHE 39 4.011 -19.279 -4.483 289 HD2 PHE 39 HD1 PHE 39 7.208 -19.284 -1.654 290 HE1 PHE 39 HE2 PHE 39 2.622 -20.555 -2.910 291 HE2 PHE 39 HE1 PHE 39 5.807 -20.563 -0.082 292 HZ PHE 39 HZ PHE 39 3.515 -21.197 -0.708 293 H ASP 40 H ASP 40 7.149 -18.928 -7.960 294 HA ASP 40 HA ASP 40 9.326 -16.916 -7.969 295 HB2 ASP 40 2HB ASP 40 9.768 -18.999 -9.268 296 HB3 ASP 40 1HB ASP 40 8.355 -18.676 -10.269 297 H GLY 41 H GLY 41 8.025 -15.191 -7.449 298 HA2 GLY 41 2HA GLY 41 7.209 -13.416 -9.254 299 HA3 GLY 41 1HA GLY 41 5.772 -14.432 -9.143 300 H LEU 42 H LEU 42 5.601 -11.801 -8.512 301 HA LEU 42 HA LEU 42 5.712 -11.176 -5.764 302 HB2 LEU 42 2HB LEU 42 3.650 -10.120 -7.746 303 HB3 LEU 42 1HB LEU 42 4.190 -9.341 -6.266 304 HG LEU 42 HG LEU 42 5.782 -9.702 -8.827 305 HD11 LEU 42 1HD1 LEU 42 4.163 -7.893 -8.976 306 HD12 LEU 42 2HD1 LEU 42 5.795 -7.239 -8.911 307 HD13 LEU 42 3HD1 LEU 42 4.769 -7.179 -7.478 308 HD21 LEU 42 3HD2 LEU 42 7.610 -8.476 -7.723 309 HD22 LEU 42 1HD2 LEU 42 7.299 -10.042 -6.979 310 HD23 LEU 42 2HD2 LEU 42 6.740 -8.564 -6.191 311 H SER 43 H SER 43 4.855 -12.886 -4.426 312 HA SER 43 HA SER 43 2.215 -13.917 -4.743 313 HB2 SER 43 2HB SER 43 3.904 -15.112 -3.401 314 HB3 SER 43 1HB SER 43 4.023 -13.756 -2.282 315 HG SER 43 HG SER 43 2.284 -14.424 -1.298 316 H TYR 44 H TYR 44 0.450 -12.629 -4.677 317 HA TYR 44 HA TYR 44 -0.135 -10.915 -2.436 318 HB2 TYR 44 2HB TYR 44 -0.104 -8.762 -3.463 319 HB3 TYR 44 1HB TYR 44 1.434 -9.488 -3.892 320 HD1 TYR 44 HD2 TYR 44 0.913 -11.033 -6.313 321 HD2 TYR 44 HD1 TYR 44 -0.778 -7.277 -5.177 322 HE1 TYR 44 HE2 TYR 44 0.510 -10.495 -8.677 323 HE2 TYR 44 HE1 TYR 44 -1.185 -6.745 -7.543 324 HH TYR 44 HH TYR 44 -1.053 -9.018 -10.003 325 H PHE 45 H PHE 45 -2.121 -9.364 -3.377 326 HA PHE 45 HA PHE 45 -4.225 -11.341 -3.782 327 HB2 PHE 45 2HB PHE 45 -4.426 -8.325 -3.293 328 HB3 PHE 45 1HB PHE 45 -5.748 -9.488 -3.192 329 HD1 PHE 45 HD1 PHE 45 -5.390 -11.477 -1.473 330 HD2 PHE 45 HD2 PHE 45 -3.293 -7.751 -1.292 331 HE1 PHE 45 HE1 PHE 45 -4.858 -11.882 0.894 332 HE2 PHE 45 HE2 PHE 45 -2.774 -8.166 1.080 333 HZ PHE 45 HZ PHE 45 -3.550 -10.234 2.173 334 H ASP 46 H ASP 46 -5.619 -11.389 -5.568 335 HA ASP 46 HA ASP 46 -4.592 -10.319 -8.064 336 HB2 ASP 46 2HB ASP 46 -7.067 -11.994 -7.457 337 HB3 ASP 46 1HB ASP 46 -6.657 -11.441 -9.075 338 HA PRO 47 HA PRO 47 -7.079 -6.535 -8.360 339 HB2 PRO 47 2HB PRO 47 -7.831 -6.765 -11.078 340 HB3 PRO 47 1HB PRO 47 -6.325 -6.040 -10.488 341 HG2 PRO 47 2HG PRO 47 -6.803 -8.815 -11.514 342 HG3 PRO 47 1HG PRO 47 -5.430 -7.717 -11.803 343 HD2 PRO 47 2HD PRO 47 -5.186 -9.725 -10.064 344 HD3 PRO 47 1HD PRO 47 -4.485 -8.133 -9.693 345 H ASP 48 H ASP 48 -8.894 -6.796 -7.183 346 HA ASP 48 HA ASP 48 -11.159 -8.380 -8.238 347 HB2 ASP 48 2HB ASP 48 -9.748 -9.150 -6.081 348 HB3 ASP 48 1HB ASP 48 -10.753 -7.968 -5.269 349 HA PRO 49 HA PRO 49 -12.601 -3.960 -8.178 350 HB2 PRO 49 2HB PRO 49 -14.869 -5.317 -9.637 351 HB3 PRO 49 1HB PRO 49 -13.977 -3.836 -10.056 352 HG2 PRO 49 2HG PRO 49 -13.526 -6.095 -11.375 353 HG3 PRO 49 1HG PRO 49 -12.179 -5.007 -10.964 354 HD2 PRO 49 2HD PRO 49 -12.986 -7.597 -9.650 355 HD3 PRO 49 1HD PRO 49 -11.364 -6.958 -9.997 356 H ASP 50 H ASP 50 -14.251 -6.903 -7.131 357 HA ASP 50 HA ASP 50 -16.468 -5.765 -5.812 358 HB2 ASP 50 2HB ASP 50 -16.384 -8.144 -6.305 359 HB3 ASP 50 1HB ASP 50 -14.985 -8.365 -5.265 360 H TYR 51 H TYR 51 -13.114 -6.164 -4.747 361 HA TYR 51 HA TYR 51 -13.833 -5.309 -2.009 362 HB2 TYR 51 2HB TYR 51 -12.202 -7.323 -2.590 363 HB3 TYR 51 1HB TYR 51 -10.994 -6.058 -2.788 364 HD1 TYR 51 HD2 TYR 51 -10.323 -4.655 -0.784 365 HD2 TYR 51 HD1 TYR 51 -13.034 -7.933 -0.388 366 HE1 TYR 51 HE2 TYR 51 -10.060 -4.584 1.648 367 HE2 TYR 51 HE1 TYR 51 -12.763 -7.852 2.044 368 HH TYR 51 HH TYR 51 -11.176 -7.030 3.715 369 H ARG 52 H ARG 52 -12.974 -3.873 -4.884 370 HA ARG 52 HA ARG 52 -11.120 -1.864 -4.079 371 HB2 ARG 52 2HB ARG 52 -11.553 -2.543 -6.454 372 HB3 ARG 52 1HB ARG 52 -13.131 -1.772 -6.379 373 HG2 ARG 52 2HG ARG 52 -12.011 0.426 -6.009 374 HG3 ARG 52 1HG ARG 52 -10.447 -0.381 -6.102 375 HD2 ARG 52 2HD ARG 52 -11.198 -1.156 -8.473 376 HD3 ARG 52 1HD ARG 52 -12.446 0.089 -8.335 377 HE ARG 52 HE ARG 52 -9.566 0.691 -8.023 378 HH11 ARG 52 1HH1 ARG 52 -12.618 1.413 -9.622 379 HH12 ARG 52 2HH1 ARG 52 -11.980 2.805 -10.435 380 HH21 ARG 52 1HH2 ARG 52 -8.777 2.519 -9.066 381 HH22 ARG 52 2HH2 ARG 52 -9.808 3.433 -10.121 382 H VAL 53 H VAL 53 -11.450 -0.016 -2.917 383 HA VAL 53 HA VAL 53 -14.147 1.185 -2.760 384 HB VAL 53 HB VAL 53 -13.891 1.729 -0.389 385 HG11 VAL 53 1HG1 VAL 53 -15.032 -0.383 -0.893 386 HG12 VAL 53 2HG1 VAL 53 -14.173 -0.481 0.643 387 HG13 VAL 53 3HG1 VAL 53 -13.498 -1.257 -0.792 388 HG21 VAL 53 3HG2 VAL 53 -11.451 1.912 -0.240 389 HG22 VAL 53 1HG2 VAL 53 -11.283 0.163 -0.422 390 HG23 VAL 53 2HG2 VAL 53 -12.064 0.835 1.012 391 H GLU 54 H GLU 54 -13.831 3.469 -1.625 392 HA GLU 54 HA GLU 54 -11.321 4.768 -2.361 393 HB2 GLU 54 2HB GLU 54 -12.589 6.581 -3.592 394 HB3 GLU 54 1HB GLU 54 -12.545 5.024 -4.406 395 HG2 GLU 54 2HG GLU 54 -14.862 4.572 -3.503 396 HG3 GLU 54 1HG GLU 54 -14.881 6.229 -2.901 397 H ALA 55 H ALA 55 -11.005 6.830 -1.313 398 HA ALA 55 HA ALA 55 -12.606 7.215 1.130 399 HB1 ALA 55 3HB ALA 55 -9.575 7.208 0.909 400 HB2 ALA 55 1HB ALA 55 -10.560 5.917 1.601 401 HB3 ALA 55 2HB ALA 55 -10.511 7.500 2.377 402 H THR 56 H THR 56 -12.308 9.280 2.164 403 HA THR 56 HA THR 56 -11.745 11.544 0.361 404 HB THR 56 HB THR 56 -13.079 11.579 3.122 405 HG1 THR 56 HG1 THR 56 -14.070 10.509 0.949 406 HG21 THR 56 3HG2 THR 56 -12.177 13.776 2.348 407 HG22 THR 56 1HG2 THR 56 -13.940 13.773 2.428 408 HG23 THR 56 2HG2 THR 56 -13.132 13.632 0.869 409 H VAL 57 H VAL 57 -10.066 12.908 0.823 410 HA VAL 57 HA VAL 57 -7.969 11.919 2.560 411 HB VAL 57 HB VAL 57 -7.926 14.358 0.703 412 HG11 VAL 57 1HG1 VAL 57 -5.482 14.037 0.701 413 HG12 VAL 57 2HG1 VAL 57 -5.642 12.673 1.810 414 HG13 VAL 57 3HG1 VAL 57 -6.081 14.298 2.339 415 HG21 VAL 57 3HG2 VAL 57 -6.964 12.888 -1.022 416 HG22 VAL 57 1HG2 VAL 57 -8.575 12.337 -0.563 417 HG23 VAL 57 2HG2 VAL 57 -7.149 11.487 0.036 418 H THR 58 H THR 58 -7.247 12.847 4.382 419 HA THR 58 HA THR 58 -8.301 15.455 5.309 420 HB THR 58 HB THR 58 -7.803 12.945 6.989 421 HG1 THR 58 HG1 THR 58 -10.106 14.141 5.894 422 HG21 THR 58 3HG2 THR 58 -8.848 15.673 7.822 423 HG22 THR 58 1HG2 THR 58 -7.307 14.963 8.295 424 HG23 THR 58 2HG2 THR 58 -8.819 14.239 8.851 425 H VAL 59 H VAL 59 -6.501 16.672 4.817 426 HA VAL 59 HA VAL 59 -3.823 15.525 5.097 427 HB VAL 59 HB VAL 59 -4.806 18.084 3.747 428 HG11 VAL 59 1HG1 VAL 59 -2.466 18.609 3.127 429 HG12 VAL 59 2HG1 VAL 59 -1.889 17.286 4.144 430 HG13 VAL 59 3HG1 VAL 59 -2.693 18.675 4.873 431 HG21 VAL 59 3HG2 VAL 59 -3.814 17.042 1.728 432 HG22 VAL 59 1HG2 VAL 59 -5.041 16.008 2.456 433 HG23 VAL 59 2HG2 VAL 59 -3.331 15.639 2.686 434 H HIS 60 H HIS 60 -2.521 15.963 6.726 435 HA HIS 60 HA HIS 60 -3.222 17.949 8.763 436 HB2 HIS 60 2HB HIS 60 -1.048 15.791 8.684 437 HB3 HIS 60 1HB HIS 60 -1.342 16.878 10.047 438 HD1 HIS 60 HD1 HIS 60 -2.933 13.992 8.196 439 HD2 HIS 60 HD2 HIS 60 -3.567 16.244 11.635 440 HE1 HIS 60 HE1 HIS 60 -4.859 12.897 9.376 441 HE2 HIS 60 HE2 HIS 60 -5.104 14.168 11.532 442 H GLU 61 H GLU 61 -2.800 19.827 7.952 443 HA GLU 61 HA GLU 61 -0.769 20.605 6.149 444 HB2 GLU 61 2HB GLU 61 -1.410 22.923 6.615 445 HB3 GLU 61 1HB GLU 61 -2.832 21.900 6.461 446 HG2 GLU 61 2HG GLU 61 -2.959 21.826 8.980 447 HG3 GLU 61 1HG GLU 61 -1.653 23.003 9.020 448 H THR 62 H THR 62 -0.650 20.166 9.573 449 HA THR 62 HA THR 62 2.207 20.912 9.600 450 HB THR 62 HB THR 62 1.910 20.772 12.155 451 HG1 THR 62 HG1 THR 62 -0.241 20.929 12.915 452 HG21 THR 62 3HG2 THR 62 2.028 22.980 11.038 453 HG22 THR 62 1HG2 THR 62 0.895 23.012 12.394 454 HG23 THR 62 2HG2 THR 62 0.289 22.929 10.742 455 HA PRO 63 HA PRO 63 1.876 16.290 9.295 456 HB2 PRO 63 2HB PRO 63 4.032 15.830 7.703 457 HB3 PRO 63 1HB PRO 63 2.525 16.510 7.063 458 HG2 PRO 63 2HG PRO 63 5.077 17.908 7.763 459 HG3 PRO 63 1HG PRO 63 4.004 18.156 6.368 460 HD2 PRO 63 2HD PRO 63 3.992 19.753 8.630 461 HD3 PRO 63 1HD PRO 63 2.605 19.567 7.534 462 H GLU 64 H GLU 64 2.524 14.954 10.932 463 HA GLU 64 HA GLU 64 4.919 15.495 12.494 464 HB2 GLU 64 2HB GLU 64 4.191 13.645 13.940 465 HB3 GLU 64 1HB GLU 64 2.865 14.760 13.646 466 HG2 GLU 64 2HG GLU 64 1.812 13.231 12.105 467 HG3 GLU 64 1HG GLU 64 3.216 12.165 12.121 468 H SER 65 H SER 65 6.154 13.356 13.188 469 HA SER 65 HA SER 65 7.242 12.164 10.704 470 HB2 SER 65 2HB SER 65 8.549 12.623 13.421 471 HB3 SER 65 1HB SER 65 9.342 11.935 11.999 472 HG SER 65 HG SER 65 8.272 14.558 12.274 473 H VAL 66 H VAL 66 6.733 10.080 10.383 474 HA VAL 66 HA VAL 66 6.453 8.194 12.659 475 HB VAL 66 HB VAL 66 4.944 7.950 9.997 476 HG11 VAL 66 1HG1 VAL 66 4.503 6.533 12.659 477 HG12 VAL 66 2HG1 VAL 66 5.216 5.835 11.202 478 HG13 VAL 66 3HG1 VAL 66 3.525 6.327 11.202 479 HG21 VAL 66 3HG2 VAL 66 2.896 8.763 11.163 480 HG22 VAL 66 1HG2 VAL 66 4.145 10.003 11.009 481 HG23 VAL 66 2HG2 VAL 66 3.881 9.200 12.562 482 H ASP 67 H ASP 67 8.026 6.604 12.530 483 HA ASP 67 HA ASP 67 9.701 6.443 10.139 484 HB2 ASP 67 2HB ASP 67 9.943 5.104 12.868 485 HB3 ASP 67 1HB ASP 67 11.086 4.847 11.550 486 H LEU 68 H LEU 68 9.191 5.136 8.553 487 HA LEU 68 HA LEU 68 8.013 2.451 9.043 488 HB2 LEU 68 2HB LEU 68 7.391 4.168 6.602 489 HB3 LEU 68 1HB LEU 68 6.655 2.637 7.036 490 HG LEU 68 HG LEU 68 6.267 5.225 8.581 491 HD11 LEU 68 1HD1 LEU 68 4.396 3.916 6.592 492 HD12 LEU 68 2HD1 LEU 68 5.315 5.400 6.335 493 HD13 LEU 68 3HD1 LEU 68 4.055 5.352 7.563 494 HD21 LEU 68 3HD2 LEU 68 4.410 4.047 9.696 495 HD22 LEU 68 1HD2 LEU 68 5.946 3.231 9.991 496 HD23 LEU 68 2HD2 LEU 68 4.806 2.568 8.816 497 H GLU 69 H GLU 69 8.566 0.960 7.120 498 HA GLU 69 HA GLU 69 11.274 1.438 6.161 499 HB2 GLU 69 2HB GLU 69 11.166 -0.753 5.115 500 HB3 GLU 69 1HB GLU 69 10.603 -0.869 6.777 501 HG2 GLU 69 2HG GLU 69 8.298 -1.051 6.055 502 HG3 GLU 69 1HG GLU 69 8.742 -0.705 4.385 503 H THR 70 H THR 70 11.860 1.651 4.046 504 HA THR 70 HA THR 70 9.819 2.472 2.067 505 HB THR 70 HB THR 70 11.592 4.124 2.421 506 HG1 THR 70 HG1 THR 70 11.053 4.089 0.292 507 HG21 THR 70 3HG2 THR 70 13.343 2.633 3.321 508 HG22 THR 70 1HG2 THR 70 13.962 3.651 2.023 509 HG23 THR 70 2HG2 THR 70 13.596 1.956 1.711 510 H SER 71 H SER 71 10.677 1.809 -0.259 511 HA SER 71 HA SER 71 10.644 -1.114 -0.326 512 HB2 SER 71 2HB SER 71 10.427 0.920 -2.583 513 HB3 SER 71 1HB SER 71 10.033 -0.798 -2.674 514 HG SER 71 HG SER 71 8.186 -0.443 -1.661 515 H ASP 72 H ASP 72 13.118 0.285 0.456 516 HA ASP 72 HA ASP 72 14.975 -0.144 -1.809 517 HB2 ASP 72 2HB ASP 72 14.457 2.258 -1.552 518 HB3 ASP 72 1HB ASP 72 14.827 2.189 0.159 519 H ASP 73 H ASP 73 14.150 -1.613 0.792 520 HA ASP 73 HA ASP 73 15.004 -2.842 2.508 521 HB2 ASP 73 2HB ASP 73 17.611 -2.582 0.939 522 HB3 ASP 73 1HB ASP 73 17.351 -3.701 2.267 523 H ARG 74 H ARG 74 14.730 -0.138 3.052 524 HA ARG 74 HA ARG 74 16.915 0.371 4.977 525 HB2 ARG 74 2HB ARG 74 17.121 1.669 2.695 526 HB3 ARG 74 1HB ARG 74 15.765 2.625 3.270 527 HG2 ARG 74 2HG ARG 74 17.148 3.228 5.288 528 HG3 ARG 74 1HG ARG 74 18.508 2.390 4.542 529 HD2 ARG 74 2HD ARG 74 17.065 4.832 3.449 530 HD3 ARG 74 1HD ARG 74 18.683 4.784 4.150 531 HE ARG 74 HE ARG 74 18.354 3.075 1.843 532 HH11 ARG 74 1HH1 ARG 74 19.194 6.339 2.878 533 HH12 ARG 74 2HH1 ARG 74 20.059 6.704 1.420 534 HH21 ARG 74 1HH2 ARG 74 19.442 3.602 -0.089 535 HH22 ARG 74 2HH2 ARG 74 20.204 5.152 -0.264 536 H THR 75 H THR 75 16.173 2.327 6.425 537 HA THR 75 HA THR 75 13.290 2.157 7.101 538 HB THR 75 HB THR 75 15.559 2.412 9.144 539 HG1 THR 75 HG1 THR 75 15.293 0.299 8.014 540 HG21 THR 75 3HG2 THR 75 13.775 1.971 10.801 541 HG22 THR 75 1HG2 THR 75 12.574 1.901 9.510 542 HG23 THR 75 2HG2 THR 75 13.407 3.418 9.862 543 H VAL 76 H VAL 76 12.413 4.198 7.315 544 HA VAL 76 HA VAL 76 14.145 6.549 7.315 545 HB VAL 76 HB VAL 76 12.970 7.477 5.219 546 HG11 VAL 76 1HG1 VAL 76 15.334 6.813 5.160 547 HG12 VAL 76 2HG1 VAL 76 14.543 6.450 3.628 548 HG13 VAL 76 3HG1 VAL 76 14.880 5.150 4.777 549 HG21 VAL 76 3HG2 VAL 76 12.317 4.552 4.748 550 HG22 VAL 76 1HG2 VAL 76 12.099 5.859 3.580 551 HG23 VAL 76 2HG2 VAL 76 11.159 5.840 5.072 552 H ARG 77 H ARG 77 13.087 8.477 7.685 553 HA ARG 77 HA ARG 77 10.636 8.332 9.204 554 HB2 ARG 77 2HB ARG 77 12.521 9.771 9.896 555 HB3 ARG 77 1HB ARG 77 12.410 10.697 8.408 556 HG2 ARG 77 2HG ARG 77 10.003 10.588 10.211 557 HG3 ARG 77 1HG ARG 77 11.377 11.569 10.704 558 HD2 ARG 77 2HD ARG 77 9.874 11.867 8.082 559 HD3 ARG 77 1HD ARG 77 9.664 12.878 9.516 560 HE ARG 77 HE ARG 77 12.229 13.259 9.151 561 HH11 ARG 77 1HH1 ARG 77 9.772 13.149 6.625 562 HH12 ARG 77 2HH1 ARG 77 10.645 14.225 5.586 563 HH21 ARG 77 1HH2 ARG 77 13.336 14.665 7.767 564 HH22 ARG 77 2HH2 ARG 77 12.653 15.079 6.224 565 H TYR 78 H TYR 78 8.715 8.512 8.356 566 HA TYR 78 HA TYR 78 8.204 9.861 5.775 567 HB2 TYR 78 2HB TYR 78 6.584 7.880 7.434 568 HB3 TYR 78 1HB TYR 78 5.856 8.815 6.134 569 HD1 TYR 78 HD2 TYR 78 8.869 6.584 6.677 570 HD2 TYR 78 HD1 TYR 78 5.728 7.784 4.051 571 HE1 TYR 78 HE2 TYR 78 9.567 4.895 5.042 572 HE2 TYR 78 HE1 TYR 78 6.448 6.110 2.418 573 HH TYR 78 HH TYR 78 8.394 4.831 1.842 574 H LEU 79 H LEU 79 6.639 11.494 5.664 575 HA LEU 79 HA LEU 79 5.895 12.807 8.204 576 HB2 LEU 79 2HB LEU 79 5.900 13.823 5.328 577 HB3 LEU 79 1HB LEU 79 5.227 14.730 6.674 578 HG LEU 79 HG LEU 79 8.144 13.910 6.395 579 HD11 LEU 79 1HD1 LEU 79 6.889 16.661 6.113 580 HD12 LEU 79 2HD1 LEU 79 7.541 15.674 4.802 581 HD13 LEU 79 3HD1 LEU 79 8.616 16.289 6.051 582 HD21 LEU 79 3HD2 LEU 79 7.473 13.960 8.752 583 HD22 LEU 79 1HD2 LEU 79 6.819 15.590 8.555 584 HD23 LEU 79 2HD2 LEU 79 8.552 15.300 8.387 585 H HIS 80 H HIS 80 3.867 12.666 8.930 586 HA HIS 80 HA HIS 80 1.857 11.207 7.467 587 HB2 HIS 80 2HB HIS 80 2.062 11.000 9.933 588 HB3 HIS 80 1HB HIS 80 1.683 12.707 10.114 589 HD2 HIS 80 HD2 HIS 80 -0.417 10.351 7.797 590 HE1 HIS 80 HE1 HIS 80 -2.766 11.527 11.104 591 HE2 HIS 80 HE2 HIS 80 -2.708 10.162 8.977 592 H VAL 81 H VAL 81 1.301 12.288 5.713 593 HA VAL 81 HA VAL 81 0.752 15.168 5.798 594 HB VAL 81 HB VAL 81 0.739 15.075 3.336 595 HG11 VAL 81 1HG1 VAL 81 2.862 15.444 4.488 596 HG12 VAL 81 2HG1 VAL 81 3.126 14.526 3.007 597 HG13 VAL 81 3HG1 VAL 81 3.157 13.705 4.571 598 HG21 VAL 81 3HG2 VAL 81 1.290 12.089 3.620 599 HG22 VAL 81 1HG2 VAL 81 1.280 13.005 2.110 600 HG23 VAL 81 2HG2 VAL 81 -0.209 12.807 3.029 601 H ALA 82 H ALA 82 -0.966 12.122 5.475 602 HA ALA 82 HA ALA 82 -3.517 13.561 5.426 603 HB1 ALA 82 3HB ALA 82 -4.357 12.354 3.441 604 HB2 ALA 82 1HB ALA 82 -2.776 11.596 3.221 605 HB3 ALA 82 2HB ALA 82 -2.955 13.341 3.034 606 H THR 83 H THR 83 -5.350 12.226 5.848 607 HA THR 83 HA THR 83 -4.908 9.382 6.479 608 HB THR 83 HB THR 83 -6.671 11.286 8.113 609 HG1 THR 83 HG1 THR 83 -4.721 9.916 9.459 610 HG21 THR 83 3HG2 THR 83 -6.129 8.302 8.504 611 HG22 THR 83 1HG2 THR 83 -7.653 9.001 7.950 612 HG23 THR 83 2HG2 THR 83 -7.074 9.328 9.582 613 H LEU 84 H LEU 84 -6.298 8.161 5.402 614 HA LEU 84 HA LEU 84 -8.221 9.438 3.585 615 HB2 LEU 84 2HB LEU 84 -7.009 6.645 3.389 616 HB3 LEU 84 1HB LEU 84 -7.848 7.531 2.126 617 HG LEU 84 HG LEU 84 -5.086 8.146 3.252 618 HD11 LEU 84 1HD1 LEU 84 -5.097 6.245 1.715 619 HD12 LEU 84 2HD1 LEU 84 -4.251 7.617 1.007 620 HD13 LEU 84 3HD1 LEU 84 -5.888 7.224 0.475 621 HD21 LEU 84 3HD2 LEU 84 -4.916 9.975 1.607 622 HD22 LEU 84 1HD2 LEU 84 -6.195 10.273 2.783 623 HD23 LEU 84 2HD2 LEU 84 -6.604 9.734 1.154 624 H SER 85 H SER 85 -10.190 9.443 4.572 625 HA SER 85 HA SER 85 -11.059 7.216 6.277 626 HB2 SER 85 2HB SER 85 -12.856 8.854 6.950 627 HB3 SER 85 1HB SER 85 -11.215 9.424 7.259 628 HG SER 85 HG SER 85 -11.371 10.846 5.640 629 H PHE 86 H PHE 86 -12.464 5.766 5.536 630 HA PHE 86 HA PHE 86 -14.314 6.283 3.329 631 HB2 PHE 86 2HB PHE 86 -13.594 4.147 2.195 632 HB3 PHE 86 1HB PHE 86 -12.380 5.404 2.150 633 HD1 PHE 86 HD1 PHE 86 -10.415 5.277 3.791 634 HD2 PHE 86 HD2 PHE 86 -13.049 1.988 3.089 635 HE1 PHE 86 HE1 PHE 86 -8.735 3.736 4.698 636 HE2 PHE 86 HE2 PHE 86 -11.361 0.454 4.005 637 HZ PHE 86 HZ PHE 86 -9.206 1.323 4.812 638 H ASP 87 H ASP 87 -15.405 3.932 2.936 639 HA ASP 87 HA ASP 87 -16.141 2.721 5.534 640 HB2 ASP 87 2HB ASP 87 -18.078 3.884 4.572 641 HB3 ASP 87 1HB ASP 87 -17.840 3.091 3.017 642 H LEU 88 H LEU 88 -15.922 0.556 5.667 643 HA LEU 88 HA LEU 88 -15.663 -1.218 3.402 644 HB2 LEU 88 2HB LEU 88 -13.344 -0.311 3.502 645 HB3 LEU 88 1HB LEU 88 -13.238 -0.746 5.194 646 HG LEU 88 HG LEU 88 -13.520 -3.187 4.464 647 HD11 LEU 88 1HD1 LEU 88 -12.971 -3.763 2.141 648 HD12 LEU 88 2HD1 LEU 88 -12.970 -2.053 1.707 649 HD13 LEU 88 3HD1 LEU 88 -14.461 -2.828 2.243 650 HD21 LEU 88 3HD2 LEU 88 -11.152 -3.453 3.850 651 HD22 LEU 88 1HD2 LEU 88 -11.354 -2.301 5.169 652 HD23 LEU 88 2HD2 LEU 88 -11.032 -1.721 3.533 653 H ASP 89 H ASP 89 -16.043 -3.312 4.030 654 HA ASP 89 HA ASP 89 -16.625 -5.133 5.236 655 HB2 ASP 89 2HB ASP 89 -14.724 -4.767 6.727 656 HB3 ASP 89 1HB ASP 89 -15.615 -3.566 7.650 657 H GLY 90 H GLY 90 -17.500 -2.473 7.432 658 HA2 GLY 90 2HA GLY 90 -20.259 -2.384 6.706 659 HA3 GLY 90 1HA GLY 90 -20.037 -3.316 8.183 660 H GLU 91 H GLU 91 -17.680 -0.882 7.875 661 HA GLU 91 HA GLU 91 -19.171 1.214 9.204 662 HB2 GLU 91 2HB GLU 91 -17.757 1.240 11.226 663 HB3 GLU 91 1HB GLU 91 -18.611 -0.292 11.085 664 HG2 GLU 91 2HG GLU 91 -16.596 -1.412 10.297 665 HG3 GLU 91 1HG GLU 91 -15.725 0.121 10.267 666 H SER 92 H SER 92 -17.675 3.047 9.773 667 HA SER 92 HA SER 92 -16.155 3.753 7.438 668 HB2 SER 92 2HB SER 92 -17.531 5.427 8.694 669 HB3 SER 92 1HB SER 92 -16.420 5.298 10.059 670 HG SER 92 HG SER 92 -15.346 5.879 7.532 671 H ARG 93 H ARG 93 -14.154 3.116 7.105 672 HA ARG 93 HA ARG 93 -12.301 2.489 9.334 673 HB2 ARG 93 2HB ARG 93 -12.168 1.661 6.398 674 HB3 ARG 93 1HB ARG 93 -11.089 1.119 7.671 675 HG2 ARG 93 2HG ARG 93 -14.052 0.470 7.519 676 HG3 ARG 93 1HG ARG 93 -12.757 -0.584 6.963 677 HD2 ARG 93 2HD ARG 93 -11.872 -0.639 9.305 678 HD3 ARG 93 1HD ARG 93 -13.289 0.282 9.822 679 HE ARG 93 HE ARG 93 -14.296 -1.896 8.463 680 HH11 ARG 93 1HH1 ARG 93 -12.351 -1.418 11.360 681 HH12 ARG 93 2HH1 ARG 93 -12.892 -2.890 12.103 682 HH21 ARG 93 1HH2 ARG 93 -14.960 -3.853 9.464 683 HH22 ARG 93 2HH2 ARG 93 -14.355 -4.259 11.036 684 H ASP 94 H ASP 94 -10.071 3.309 9.070 685 HA ASP 94 HA ASP 94 -9.641 5.361 7.005 686 HB2 ASP 94 2HB ASP 94 -8.797 7.013 8.566 687 HB3 ASP 94 1HB ASP 94 -10.424 6.565 9.051 688 H LEU 95 H LEU 95 -7.657 5.446 6.229 689 HA LEU 95 HA LEU 95 -5.429 3.973 7.531 690 HB2 LEU 95 2HB LEU 95 -6.065 4.026 4.549 691 HB3 LEU 95 1HB LEU 95 -4.611 3.334 5.253 692 HG LEU 95 HG LEU 95 -7.446 2.321 5.639 693 HD11 LEU 95 1HD1 LEU 95 -6.530 1.843 3.424 694 HD12 LEU 95 2HD1 LEU 95 -6.699 0.371 4.378 695 HD13 LEU 95 3HD1 LEU 95 -5.105 1.097 4.159 696 HD21 LEU 95 3HD2 LEU 95 -4.858 1.262 6.814 697 HD22 LEU 95 1HD2 LEU 95 -6.421 0.441 6.879 698 HD23 LEU 95 2HD2 LEU 95 -6.205 1.983 7.698 699 H HIS 96 H HIS 96 -3.537 5.149 7.606 700 HA HIS 96 HA HIS 96 -3.830 7.977 6.888 701 HB2 HIS 96 2HB HIS 96 -1.716 6.552 8.573 702 HB3 HIS 96 1HB HIS 96 -1.864 8.294 8.370 703 HD2 HIS 96 HD2 HIS 96 -4.480 5.547 9.628 704 HE1 HIS 96 HE1 HIS 96 -4.428 8.846 12.271 705 HE2 HIS 96 HE2 HIS 96 -5.637 6.717 11.624 706 H ALA 97 H ALA 97 -2.611 8.955 5.347 707 HA ALA 97 HA ALA 97 -0.890 7.279 3.640 708 HB1 ALA 97 3HB ALA 97 -2.289 9.908 3.022 709 HB2 ALA 97 1HB ALA 97 -2.808 8.304 2.507 710 HB3 ALA 97 2HB ALA 97 -1.299 8.976 1.892 711 H PHE 98 H PHE 98 1.211 7.665 3.563 712 HA PHE 98 HA PHE 98 2.336 10.182 4.678 713 HB2 PHE 98 2HB PHE 98 3.686 7.439 4.824 714 HB3 PHE 98 1HB PHE 98 4.145 8.922 5.652 715 HD1 PHE 98 HD2 PHE 98 1.876 6.033 5.669 716 HD2 PHE 98 HD1 PHE 98 3.022 9.590 7.720 717 HE1 PHE 98 HE2 PHE 98 0.653 5.278 7.661 718 HE2 PHE 98 HE1 PHE 98 1.797 8.830 9.708 719 HZ PHE 98 HZ PHE 98 0.609 6.679 9.676 720 H ARG 99 H ARG 99 4.615 10.440 3.941 721 HA ARG 99 HA ARG 99 5.672 8.997 1.714 722 HB2 ARG 99 2HB ARG 99 5.813 10.911 0.132 723 HB3 ARG 99 1HB ARG 99 4.159 10.410 0.425 724 HG2 ARG 99 2HG ARG 99 4.455 12.414 2.295 725 HG3 ARG 99 1HG ARG 99 5.480 13.000 0.987 726 HD2 ARG 99 2HD ARG 99 2.549 12.246 0.787 727 HD3 ARG 99 1HD ARG 99 3.212 13.875 0.773 728 HE ARG 99 HE ARG 99 4.235 12.199 -1.341 729 HH11 ARG 99 1HH1 ARG 99 1.579 14.323 -0.455 730 HH12 ARG 99 2HH1 ARG 99 1.162 14.681 -2.099 731 HH21 ARG 99 1HH2 ARG 99 3.658 12.645 -3.478 732 HH22 ARG 99 2HH2 ARG 99 2.337 13.732 -3.818 733 H GLN 100 H GLN 100 7.943 9.482 1.486 734 HA GLN 100 HA GLN 100 9.075 9.486 3.982 735 HB2 GLN 100 2HB GLN 100 10.461 10.011 1.336 736 HB3 GLN 100 1HB GLN 100 11.297 9.598 2.827 737 HG2 GLN 100 2HG GLN 100 10.005 7.431 2.872 738 HG3 GLN 100 1HG GLN 100 9.358 7.848 1.286 739 HE21 GLN 100 1HE2 GLN 100 12.689 8.394 2.424 740 HE22 GLN 100 2HE2 GLN 100 13.433 7.309 1.305 741 H ALA 101 H ALA 101 10.131 12.065 1.696 742 HA ALA 101 HA ALA 101 10.072 13.966 3.977 743 HB1 ALA 101 3HB ALA 101 11.979 15.129 2.957 744 HB2 ALA 101 1HB ALA 101 12.012 13.957 1.636 745 HB3 ALA 101 2HB ALA 101 12.365 13.440 3.285 746 H ALA 102 H ALA 102 10.426 14.433 0.420 747 HA ALA 102 HA ALA 102 8.164 16.357 0.489 748 HB1 ALA 102 3HB ALA 102 9.568 17.879 -0.855 749 HB2 ALA 102 1HB ALA 102 10.897 16.720 -0.806 750 HB3 ALA 102 2HB ALA 102 10.354 17.505 0.679 751 H ASP 103 H ASP 103 7.895 13.691 -0.445 752 HA ASP 103 HA ASP 103 8.498 13.179 -3.119 753 HB2 ASP 103 2HB ASP 103 7.824 11.335 -1.773 754 HB3 ASP 103 1HB ASP 103 6.346 12.131 -1.256 755 H GLU 104 H GLU 104 7.836 14.068 -4.926 756 HA GLU 104 HA GLU 104 5.148 15.326 -5.164 757 HB2 GLU 104 2HB GLU 104 6.131 16.664 -7.044 758 HB3 GLU 104 1HB GLU 104 6.911 16.983 -5.500 759 HG2 GLU 104 2HG GLU 104 8.783 15.466 -6.164 760 HG3 GLU 104 1HG GLU 104 8.003 15.243 -7.727 761 H SER 105 H SER 105 6.814 12.563 -5.819 762 HA SER 105 HA SER 105 5.897 12.050 -8.535 763 HB2 SER 105 2HB SER 105 8.199 11.396 -7.639 764 HB3 SER 105 1HB SER 105 7.396 10.171 -6.657 765 HG SER 105 HG SER 105 6.619 9.240 -8.604 766 H ARG 106 H ARG 106 4.207 12.194 -5.892 767 HA ARG 106 HA ARG 106 2.054 11.616 -5.405 768 HB2 ARG 106 2HB ARG 106 2.130 9.800 -7.856 769 HB3 ARG 106 1HB ARG 106 0.692 10.338 -7.002 770 HG2 ARG 106 2HG ARG 106 2.570 12.101 -8.599 771 HG3 ARG 106 1HG ARG 106 0.984 11.534 -9.110 772 HD2 ARG 106 2HD ARG 106 -0.038 12.799 -7.215 773 HD3 ARG 106 1HD ARG 106 1.568 13.434 -6.815 774 HE ARG 106 HE ARG 106 0.244 13.889 -9.432 775 HH11 ARG 106 1HH1 ARG 106 2.043 15.194 -6.696 776 HH12 ARG 106 2HH1 ARG 106 2.158 16.779 -7.388 777 HH21 ARG 106 1HH2 ARG 106 0.375 15.981 -10.301 778 HH22 ARG 106 2HH2 ARG 106 1.215 17.223 -9.423 779 H THR 107 H THR 107 4.555 9.780 -4.784 780 HA THR 107 HA THR 107 3.434 7.116 -4.598 781 HB THR 107 HB THR 107 6.124 8.163 -3.591 782 HG1 THR 107 HG1 THR 107 5.231 8.019 -6.078 783 HG21 THR 107 3HG2 THR 107 5.518 5.915 -2.695 784 HG22 THR 107 1HG2 THR 107 6.876 5.825 -3.820 785 HG23 THR 107 2HG2 THR 107 5.265 5.339 -4.345 786 H LEU 108 H LEU 108 1.747 7.376 -3.184 787 HA LEU 108 HA LEU 108 2.119 8.332 -0.443 788 HB2 LEU 108 2HB LEU 108 -0.341 7.285 -1.898 789 HB3 LEU 108 1HB LEU 108 -0.340 8.017 -0.299 790 HG LEU 108 HG LEU 108 0.518 9.494 -2.813 791 HD11 LEU 108 1HD1 LEU 108 -2.181 9.548 -1.439 792 HD12 LEU 108 2HD1 LEU 108 -1.827 8.838 -3.015 793 HD13 LEU 108 3HD1 LEU 108 -1.676 10.577 -2.783 794 HD21 LEU 108 3HD2 LEU 108 -0.141 10.510 -0.024 795 HD22 LEU 108 1HD2 LEU 108 0.256 11.517 -1.424 796 HD23 LEU 108 2HD2 LEU 108 1.466 10.426 -0.752 797 H PHE 109 H PHE 109 2.675 6.946 1.103 798 HA PHE 109 HA PHE 109 2.446 4.040 0.651 799 HB2 PHE 109 2HB PHE 109 4.709 5.110 1.087 800 HB3 PHE 109 1HB PHE 109 4.134 5.563 2.685 801 HD1 PHE 109 HD1 PHE 109 4.730 2.582 0.485 802 HD2 PHE 109 HD2 PHE 109 4.409 4.047 4.493 803 HE1 PHE 109 HE1 PHE 109 5.546 0.423 1.355 804 HE2 PHE 109 HE2 PHE 109 5.216 1.890 5.355 805 HZ PHE 109 HZ PHE 109 5.790 0.075 3.786 806 H VAL 110 H VAL 110 0.506 3.390 1.441 807 HA VAL 110 HA VAL 110 -0.340 4.274 4.139 808 HB VAL 110 HB VAL 110 -2.633 3.431 3.586 809 HG11 VAL 110 1HG1 VAL 110 -2.164 5.808 3.318 810 HG12 VAL 110 2HG1 VAL 110 -3.299 5.274 2.081 811 HG13 VAL 110 3HG1 VAL 110 -1.605 5.548 1.662 812 HG21 VAL 110 3HG2 VAL 110 -2.135 1.776 1.832 813 HG22 VAL 110 1HG2 VAL 110 -1.598 3.054 0.739 814 HG23 VAL 110 2HG2 VAL 110 -3.289 2.963 1.235 815 HA PRO 111 HA PRO 111 0.645 -0.068 5.303 816 HB2 PRO 111 2HB PRO 111 0.780 0.560 8.008 817 HB3 PRO 111 1HB PRO 111 2.177 0.625 6.917 818 HG2 PRO 111 2HG PRO 111 0.442 2.863 7.881 819 HG3 PRO 111 1HG PRO 111 2.208 2.806 7.680 820 HD2 PRO 111 2HD PRO 111 0.600 4.012 5.860 821 HD3 PRO 111 1HD PRO 111 2.103 3.187 5.393 822 H PHE 112 H PHE 112 -0.990 -1.462 5.879 823 HA PHE 112 HA PHE 112 -3.192 -0.509 7.517 824 HB2 PHE 112 2HB PHE 112 -4.941 -1.416 6.131 825 HB3 PHE 112 1HB PHE 112 -4.005 -0.274 5.193 826 HD1 PHE 112 HD1 PHE 112 -2.299 -1.206 3.490 827 HD2 PHE 112 HD2 PHE 112 -5.336 -3.601 5.315 828 HE1 PHE 112 HE1 PHE 112 -2.136 -2.835 1.655 829 HE2 PHE 112 HE2 PHE 112 -5.152 -5.222 3.481 830 HZ PHE 112 HZ PHE 112 -3.562 -4.840 1.648 831 H ARG 113 H ARG 113 -3.790 -1.981 9.044 832 HA ARG 113 HA ARG 113 -2.475 -4.647 8.907 833 HB2 ARG 113 2HB ARG 113 -1.901 -2.998 10.835 834 HB3 ARG 113 1HB ARG 113 -3.532 -3.293 11.435 835 HG2 ARG 113 2HG ARG 113 -2.868 -5.816 11.360 836 HG3 ARG 113 1HG ARG 113 -1.212 -5.224 11.227 837 HD2 ARG 113 2HD ARG 113 -1.575 -5.650 13.532 838 HD3 ARG 113 1HD ARG 113 -1.666 -3.891 13.374 839 HE ARG 113 HE ARG 113 -4.240 -4.567 13.124 840 HH11 ARG 113 1HH1 ARG 113 -1.875 -5.630 15.495 841 HH12 ARG 113 2HH1 ARG 113 -3.056 -5.884 16.741 842 HH21 ARG 113 1HH2 ARG 113 -5.782 -4.858 14.773 843 HH22 ARG 113 2HH2 ARG 113 -5.281 -5.442 16.327 844 H ASP 114 H ASP 114 -3.936 -6.266 8.367 845 HA ASP 114 HA ASP 114 -6.798 -5.817 8.922 846 HB2 ASP 114 2HB ASP 114 -7.374 -6.574 6.720 847 HB3 ASP 114 1HB ASP 114 -6.119 -5.367 6.491 848 H LYS 115 H LYS 115 -7.621 -8.430 7.983 849 HA LYS 115 HA LYS 115 -6.531 -10.010 10.212 850 HB2 LYS 115 2HB LYS 115 -8.965 -10.575 8.499 851 HB3 LYS 115 1HB LYS 115 -8.473 -11.504 9.901 852 HG2 LYS 115 2HG LYS 115 -9.451 -8.634 9.888 853 HG3 LYS 115 1HG LYS 115 -10.348 -10.048 10.418 854 HD2 LYS 115 2HD LYS 115 -9.674 -9.370 12.496 855 HD3 LYS 115 1HD LYS 115 -8.197 -10.238 12.088 856 HE2 LYS 115 2HE LYS 115 -7.156 -8.128 11.358 857 HE3 LYS 115 1HE LYS 115 -8.652 -7.258 11.707 858 HZ1 LYS 115 3HZ LYS 115 -6.962 -8.677 13.700 859 HZ2 LYS 115 1HZ LYS 115 -8.410 -7.867 14.037 860 HZ3 LYS 115 2HZ LYS 115 -7.063 -7.004 13.493 861 H THR 116 H THR 116 -5.840 -9.844 6.877 862 HA THR 116 HA THR 116 -4.900 -12.607 6.782 863 HB THR 116 HB THR 116 -3.772 -12.104 4.701 864 HG1 THR 116 HG1 THR 116 -4.537 -9.398 4.667 865 HG21 THR 116 3HG2 THR 116 -5.650 -11.389 3.300 866 HG22 THR 116 1HG2 THR 116 -6.477 -10.716 4.707 867 HG23 THR 116 2HG2 THR 116 -6.218 -12.460 4.585 868 H THR 117 H THR 117 -3.818 -9.486 7.830 869 HA THR 117 HA THR 117 -1.149 -10.351 8.597 870 HB THR 117 HB THR 117 -2.785 -7.851 9.280 871 HG1 THR 117 HG1 THR 117 -2.262 -7.815 7.125 872 HG21 THR 117 3HG2 THR 117 -1.070 -8.238 11.005 873 HG22 THR 117 1HG2 THR 117 -0.650 -6.846 10.005 874 HG23 THR 117 2HG2 THR 117 0.171 -8.387 9.757 875 H GLY 118 H GLY 118 -0.582 -10.974 10.720 876 HA2 GLY 118 2HA GLY 118 -0.804 -11.529 12.951 877 HA3 GLY 118 1HA GLY 118 -2.427 -10.848 12.954 878 H GLN 119 H GLN 119 -3.393 -12.571 10.726 879 HA GLN 119 HA GLN 119 -3.776 -15.060 12.271 880 HB2 GLN 119 2HB GLN 119 -5.500 -13.827 10.077 881 HB3 GLN 119 1HB GLN 119 -5.855 -15.343 10.897 882 HG2 GLN 119 2HG GLN 119 -5.709 -12.626 12.245 883 HG3 GLN 119 1HG GLN 119 -7.191 -13.445 11.756 884 HE21 GLN 119 1HE2 GLN 119 -6.137 -12.614 14.441 885 HE22 GLN 119 2HE2 GLN 119 -6.205 -14.035 15.414 886 H GLN 120 H GLN 120 -4.004 -14.270 8.766 887 HA GLN 120 HA GLN 120 -3.407 -16.953 8.026 888 HB2 GLN 120 2HB GLN 120 -3.315 -14.546 6.162 889 HB3 GLN 120 1HB GLN 120 -3.608 -16.224 5.725 890 HG2 GLN 120 2HG GLN 120 -5.466 -14.384 7.251 891 HG3 GLN 120 1HG GLN 120 -5.686 -15.000 5.617 892 HE21 GLN 120 1HE2 GLN 120 -7.450 -15.177 7.902 893 HE22 GLN 120 2HE2 GLN 120 -7.732 -16.854 8.193 894 H SER 121 H SER 121 -1.354 -14.071 6.926 895 HA SER 121 HA SER 121 0.996 -15.425 7.875 896 HB2 SER 121 2HB SER 121 2.082 -13.192 7.489 897 HB3 SER 121 1HB SER 121 1.187 -13.753 6.081 898 HG SER 121 HG SER 121 -0.317 -12.224 7.798 899 H TYR 122 H TYR 122 1.697 -15.449 9.953 900 HA TYR 122 HA TYR 122 -0.058 -14.550 12.031 901 HB2 TYR 122 2HB TYR 122 2.673 -15.891 12.139 902 HB3 TYR 122 1HB TYR 122 1.645 -15.625 13.550 903 HD1 TYR 122 HD1 TYR 122 -0.499 -16.847 13.787 904 HD2 TYR 122 HD2 TYR 122 2.128 -17.687 10.521 905 HE1 TYR 122 HE1 TYR 122 -1.737 -18.911 13.331 906 HE2 TYR 122 HE2 TYR 122 0.886 -19.769 10.062 907 HH TYR 122 HH TYR 122 -0.608 -21.372 11.362 908 H ASP 123 H ASP 123 3.065 -13.424 10.818 909 HA ASP 123 HA ASP 123 2.520 -10.807 12.045 910 HB2 ASP 123 2HB ASP 123 4.776 -10.596 12.976 911 HB3 ASP 123 1HB ASP 123 3.962 -11.998 13.662 912 H GLY 124 H GLY 124 4.493 -9.259 11.397 913 HA2 GLY 124 2HA GLY 124 5.512 -8.090 9.681 914 HA3 GLY 124 1HA GLY 124 5.370 -9.516 8.656 915 H GLY 125 H GLY 125 3.870 -6.539 9.655 916 HA2 GLY 125 2HA GLY 125 1.253 -7.024 8.844 917 HA3 GLY 125 1HA GLY 125 1.961 -5.450 9.112 918 H ARG 126 H ARG 126 0.310 -4.963 7.390 919 HA ARG 126 HA ARG 126 1.158 -5.756 4.664 920 HB2 ARG 126 2HB ARG 126 -1.310 -6.356 5.820 921 HB3 ARG 126 1HB ARG 126 -1.680 -4.824 5.045 922 HG2 ARG 126 2HG ARG 126 -2.184 -6.178 3.272 923 HG3 ARG 126 1HG ARG 126 -0.455 -6.070 2.959 924 HD2 ARG 126 2HD ARG 126 -2.003 -8.331 4.253 925 HD3 ARG 126 1HD ARG 126 -1.017 -8.370 2.785 926 HE ARG 126 HE ARG 126 0.831 -7.741 4.609 927 HH11 ARG 126 1HH1 ARG 126 -1.669 -10.223 4.721 928 HH12 ARG 126 2HH1 ARG 126 -0.737 -11.269 5.745 929 HH21 ARG 126 1HH2 ARG 126 2.007 -9.115 6.004 930 HH22 ARG 126 2HH2 ARG 126 1.333 -10.645 6.469 931 H TYR 127 H TYR 127 1.171 -4.114 3.126 932 HA TYR 127 HA TYR 127 0.308 -1.431 3.755 933 HB2 TYR 127 2HB TYR 127 2.694 -0.544 3.008 934 HB3 TYR 127 1HB TYR 127 2.377 -0.959 4.681 935 HD1 TYR 127 HD2 TYR 127 3.288 -3.075 5.645 936 HD2 TYR 127 HD1 TYR 127 4.404 -1.758 1.736 937 HE1 TYR 127 HE2 TYR 127 5.264 -4.503 5.729 938 HE2 TYR 127 HE1 TYR 127 6.388 -3.200 1.831 939 HH TYR 127 HH TYR 127 7.830 -4.211 3.709 940 H MET 128 H MET 128 0.704 0.039 1.881 941 HA MET 128 HA MET 128 0.357 -1.279 -0.689 942 HB2 MET 128 2HB MET 128 -1.872 -1.245 0.899 943 HB3 MET 128 1HB MET 128 -1.996 0.388 0.258 944 HG2 MET 128 2HG MET 128 -1.713 -2.001 -1.570 945 HG3 MET 128 1HG MET 128 -3.276 -1.450 -0.975 946 HE1 MET 128 3HE MET 128 -4.530 0.591 -1.782 947 HE2 MET 128 1HE MET 128 -3.818 1.926 -2.690 948 HE3 MET 128 2HE MET 128 -3.305 1.619 -1.031 949 H GLU 129 H GLU 129 0.201 0.364 -2.412 950 HA GLU 129 HA GLU 129 1.209 3.037 -1.646 951 HB2 GLU 129 2HB GLU 129 3.137 1.538 -2.082 952 HB3 GLU 129 1HB GLU 129 2.480 1.112 -3.655 953 HG2 GLU 129 2HG GLU 129 2.729 3.550 -4.300 954 HG3 GLU 129 1HG GLU 129 3.588 3.798 -2.784 955 H LEU 130 H LEU 130 0.198 4.611 -2.757 956 HA LEU 130 HA LEU 130 -1.322 3.977 -5.229 957 HB2 LEU 130 2HB LEU 130 -1.944 6.419 -3.528 958 HB3 LEU 130 1HB LEU 130 -2.970 5.556 -4.656 959 HG LEU 130 HG LEU 130 -2.872 3.618 -2.842 960 HD11 LEU 130 1HD1 LEU 130 -2.707 4.442 -0.533 961 HD12 LEU 130 2HD1 LEU 130 -2.214 6.029 -1.125 962 HD13 LEU 130 3HD1 LEU 130 -1.182 4.622 -1.397 963 HD21 LEU 130 3HD2 LEU 130 -4.910 4.816 -3.507 964 HD22 LEU 130 1HD2 LEU 130 -4.525 6.115 -2.375 965 HD23 LEU 130 2HD2 LEU 130 -4.885 4.495 -1.776 966 H GLU 131 H GLU 131 -1.143 5.465 -6.956 967 HA GLU 131 HA GLU 131 0.453 7.913 -6.596 968 HB2 GLU 131 2HB GLU 131 0.851 5.836 -8.795 969 HB3 GLU 131 1HB GLU 131 1.488 7.475 -8.898 970 HG2 GLU 131 2HG GLU 131 3.045 7.121 -7.141 971 HG3 GLU 131 1HG GLU 131 2.188 5.705 -6.549 972 HA PRO 132 HA PRO 132 -3.699 8.890 -8.544 973 HB2 PRO 132 2HB PRO 132 -3.892 11.383 -7.362 974 HB3 PRO 132 1HB PRO 132 -4.380 9.892 -6.539 975 HG2 PRO 132 2HG PRO 132 -1.778 11.382 -6.324 976 HG3 PRO 132 1HG PRO 132 -2.809 10.747 -5.023 977 HD2 PRO 132 2HD PRO 132 -0.641 9.398 -5.806 978 HD3 PRO 132 1HD PRO 132 -2.136 8.531 -5.387 979 H ASP 133 H ASP 133 -4.324 10.752 -9.939 980 HA ASP 133 HA ASP 133 -2.310 11.532 -11.793 981 HB2 ASP 133 2HB ASP 133 -4.701 11.277 -12.403 982 HB3 ASP 133 1HB ASP 133 -5.135 12.616 -11.347 983 H ARG 134 H ARG 134 -4.278 13.493 -9.586 984 HA ARG 134 HA ARG 134 -2.396 15.700 -9.540 985 HB2 ARG 134 2HB ARG 134 -4.182 16.663 -7.894 986 HB3 ARG 134 1HB ARG 134 -4.598 16.514 -9.589 987 HG2 ARG 134 2HG ARG 134 -6.458 15.887 -8.088 988 HG3 ARG 134 1HG ARG 134 -5.995 14.569 -9.157 989 HD2 ARG 134 2HD ARG 134 -4.824 13.467 -7.297 990 HD3 ARG 134 1HD ARG 134 -5.203 14.813 -6.233 991 HE ARG 134 HE ARG 134 -7.270 13.945 -5.902 992 HH11 ARG 134 1HH1 ARG 134 -6.009 12.368 -8.783 993 HH12 ARG 134 2HH1 ARG 134 -7.332 11.254 -8.893 994 HH21 ARG 134 1HH2 ARG 134 -8.981 12.504 -6.061 995 HH22 ARG 134 2HH2 ARG 134 -9.020 11.329 -7.344 996 H ASP 135 H ASP 135 -1.892 16.676 -7.306 997 HA ASP 135 HA ASP 135 -1.200 14.618 -5.347 998 HB2 ASP 135 2HB ASP 135 0.210 16.801 -5.994 999 HB3 ASP 135 1HB ASP 135 -0.837 17.588 -4.818 1000 H LEU 136 H LEU 136 -2.117 14.608 -3.207 1001 HA LEU 136 HA LEU 136 -4.962 15.193 -3.312 1002 HB2 LEU 136 2HB LEU 136 -3.323 13.817 -1.155 1003 HB3 LEU 136 1HB LEU 136 -5.075 13.944 -1.167 1004 HG LEU 136 HG LEU 136 -3.376 12.397 -3.155 1005 HD11 LEU 136 1HD1 LEU 136 -5.307 11.421 -1.027 1006 HD12 LEU 136 2HD1 LEU 136 -3.548 11.305 -0.978 1007 HD13 LEU 136 3HD1 LEU 136 -4.451 10.407 -2.193 1008 HD21 LEU 136 3HD2 LEU 136 -5.298 13.337 -4.341 1009 HD22 LEU 136 1HD2 LEU 136 -6.402 12.723 -3.106 1010 HD23 LEU 136 2HD2 LEU 136 -5.507 11.602 -4.137 1011 H SER 137 H SER 137 -6.007 16.776 -2.295 1012 HA SER 137 HA SER 137 -4.622 18.505 -0.337 1013 HB2 SER 137 2HB SER 137 -6.438 20.173 -0.935 1014 HB3 SER 137 1HB SER 137 -5.398 19.756 -2.298 1015 HG SER 137 HG SER 137 -7.018 18.800 -3.265 1016 H ASP 138 H ASP 138 -6.152 19.349 1.408 1017 HA ASP 138 HA ASP 138 -7.497 17.203 2.742 1018 HB2 ASP 138 2HB ASP 138 -6.351 18.982 3.995 1019 HB3 ASP 138 1HB ASP 138 -7.457 20.190 3.353 1020 H GLY 139 H GLY 139 -9.330 16.438 1.872 1021 HA2 GLY 139 2HA GLY 139 -11.738 16.667 1.697 1022 HA3 GLY 139 1HA GLY 139 -11.515 18.315 1.123 1023 H ASP 140 H ASP 140 -9.160 16.455 -0.325 1024 HA ASP 140 HA ASP 140 -10.546 16.152 -2.856 1025 HB2 ASP 140 2HB ASP 140 -7.989 16.665 -2.387 1026 HB3 ASP 140 1HB ASP 140 -7.815 14.929 -2.222 1027 H GLU 141 H GLU 141 -10.680 13.936 -3.905 1028 HA GLU 141 HA GLU 141 -11.024 11.746 -1.946 1029 HB2 GLU 141 2HB GLU 141 -12.090 12.152 -4.774 1030 HB3 GLU 141 1HB GLU 141 -12.321 10.685 -3.830 1031 HG2 GLU 141 2HG GLU 141 -13.543 11.962 -2.106 1032 HG3 GLU 141 1HG GLU 141 -13.293 13.440 -3.034 1033 H ILE 142 H ILE 142 -10.465 9.536 -2.795 1034 HA ILE 142 HA ILE 142 -8.347 9.218 -4.731 1035 HB ILE 142 HB ILE 142 -6.988 10.137 -2.888 1036 HG12 ILE 142 2HG1 ILE 142 -5.357 8.253 -2.534 1037 HG13 ILE 142 1HG1 ILE 142 -6.547 7.122 -3.166 1038 HG21 ILE 142 1HG2 ILE 142 -8.096 7.926 -1.124 1039 HG22 ILE 142 2HG2 ILE 142 -8.446 9.649 -0.992 1040 HG23 ILE 142 3HG2 ILE 142 -6.815 9.058 -0.677 1041 HD11 ILE 142 3HD1 ILE 142 -4.831 7.682 -4.803 1042 HD12 ILE 142 1HD1 ILE 142 -5.281 9.384 -4.718 1043 HD13 ILE 142 2HD1 ILE 142 -6.422 8.197 -5.355 1044 H THR 143 H THR 143 -8.128 6.951 -5.277 1045 HA THR 143 HA THR 143 -10.202 5.210 -4.097 1046 HB THR 143 HB THR 143 -8.519 4.718 -6.597 1047 HG1 THR 143 HG1 THR 143 -11.172 5.776 -6.347 1048 HG21 THR 143 3HG2 THR 143 -11.072 3.405 -5.578 1049 HG22 THR 143 1HG2 THR 143 -9.481 2.653 -5.676 1050 HG23 THR 143 2HG2 THR 143 -10.334 3.106 -7.152 1051 H LEU 144 H LEU 144 -9.706 3.424 -2.862 1052 HA LEU 144 HA LEU 144 -6.879 2.886 -2.206 1053 HB2 LEU 144 2HB LEU 144 -9.440 2.904 -0.594 1054 HB3 LEU 144 1HB LEU 144 -8.187 1.781 -0.121 1055 HG LEU 144 HG LEU 144 -8.153 3.855 1.229 1056 HD11 LEU 144 1HD1 LEU 144 -5.738 4.314 1.102 1057 HD12 LEU 144 2HD1 LEU 144 -5.661 3.509 -0.467 1058 HD13 LEU 144 3HD1 LEU 144 -6.079 2.588 0.977 1059 HD21 LEU 144 3HD2 LEU 144 -7.447 6.001 0.287 1060 HD22 LEU 144 1HD2 LEU 144 -8.952 5.459 -0.454 1061 HD23 LEU 144 2HD2 LEU 144 -7.431 5.313 -1.338 1062 H ASP 145 H ASP 145 -6.527 1.363 -3.845 1063 HA ASP 145 HA ASP 145 -8.162 -1.041 -4.061 1064 HB2 ASP 145 2HB ASP 145 -5.724 0.023 -5.519 1065 HB3 ASP 145 1HB ASP 145 -6.206 -1.658 -5.714 1066 H PHE 146 H PHE 146 -7.943 -2.124 -2.104 1067 HA PHE 146 HA PHE 146 -5.335 -2.942 -1.062 1068 HB2 PHE 146 2HB PHE 146 -8.010 -4.163 -0.281 1069 HB3 PHE 146 1HB PHE 146 -6.539 -4.048 0.681 1070 HD1 PHE 146 HD2 PHE 146 -5.771 -1.280 0.631 1071 HD2 PHE 146 HD1 PHE 146 -9.688 -2.975 0.730 1072 HE1 PHE 146 HE2 PHE 146 -6.646 0.762 1.665 1073 HE2 PHE 146 HE1 PHE 146 -10.550 -0.939 1.759 1074 HZ PHE 146 HZ PHE 146 -9.037 0.938 2.229 1075 H ASN 147 H ASN 147 -7.695 -4.009 -3.273 1076 HA ASN 147 HA ASN 147 -6.957 -6.737 -3.568 1077 HB2 ASN 147 2HB ASN 147 -8.205 -6.528 -5.753 1078 HB3 ASN 147 1HB ASN 147 -9.119 -6.005 -4.342 1079 HD21 ASN 147 1HD2 ASN 147 -7.605 -4.978 -7.307 1080 HD22 ASN 147 2HD2 ASN 147 -8.212 -3.356 -7.286 1081 H LEU 148 H LEU 148 -5.403 -3.802 -4.521 1082 HA LEU 148 HA LEU 148 -3.538 -5.270 -6.306 1083 HB2 LEU 148 2HB LEU 148 -3.931 -2.257 -6.009 1084 HB3 LEU 148 1HB LEU 148 -2.855 -3.047 -7.148 1085 HG LEU 148 HG LEU 148 -5.891 -2.985 -7.205 1086 HD11 LEU 148 1HD1 LEU 148 -4.779 -1.002 -8.132 1087 HD12 LEU 148 2HD1 LEU 148 -5.614 -1.912 -9.388 1088 HD13 LEU 148 3HD1 LEU 148 -3.859 -2.021 -9.243 1089 HD21 LEU 148 3HD2 LEU 148 -5.806 -4.419 -9.218 1090 HD22 LEU 148 1HD2 LEU 148 -5.270 -5.259 -7.764 1091 HD23 LEU 148 2HD2 LEU 148 -4.084 -4.688 -8.941 1092 H ALA 149 H ALA 149 -3.675 -5.181 -3.251 1093 HA ALA 149 HA ALA 149 -1.473 -3.640 -2.305 1094 HB1 ALA 149 3HB ALA 149 -1.658 -4.938 -0.224 1095 HB2 ALA 149 1HB ALA 149 -2.753 -6.073 -1.019 1096 HB3 ALA 149 2HB ALA 149 -3.244 -4.398 -0.777 1097 H TYR 150 H TYR 150 0.637 -4.112 -2.142 1098 HA TYR 150 HA TYR 150 1.602 -6.177 -3.974 1099 HB2 TYR 150 2HB TYR 150 3.229 -4.013 -2.571 1100 HB3 TYR 150 1HB TYR 150 3.635 -4.869 -4.060 1101 HD1 TYR 150 HD1 TYR 150 2.093 -4.455 -6.126 1102 HD2 TYR 150 HD2 TYR 150 2.033 -1.941 -2.670 1103 HE1 TYR 150 HE1 TYR 150 0.979 -2.688 -7.420 1104 HE2 TYR 150 HE2 TYR 150 0.931 -0.176 -3.974 1105 HH TYR 150 HH TYR 150 0.346 0.518 -6.069 1106 H SER 151 H SER 151 3.182 -7.741 -3.416 1107 HA SER 151 HA SER 151 3.222 -9.150 -1.164 1108 HB2 SER 151 2HB SER 151 5.763 -8.612 -2.771 1109 HB3 SER 151 1HB SER 151 5.366 -10.076 -1.867 1110 HG SER 151 HG SER 151 3.435 -10.068 -3.379 1111 HA PRO 152 HA PRO 152 4.934 -6.050 1.773 1112 HB2 PRO 152 2HB PRO 152 4.447 -7.499 4.089 1113 HB3 PRO 152 1HB PRO 152 3.205 -6.540 3.259 1114 HG2 PRO 152 2HG PRO 152 3.688 -9.488 3.168 1115 HG3 PRO 152 1HG PRO 152 2.151 -8.594 3.231 1116 HD2 PRO 152 2HD PRO 152 3.140 -9.660 0.918 1117 HD3 PRO 152 1HD PRO 152 2.133 -8.202 0.953 1118 H PHE 153 H PHE 153 7.075 -5.893 1.776 1119 HA PHE 153 HA PHE 153 8.971 -7.791 1.443 1120 HB2 PHE 153 2HB PHE 153 9.256 -5.144 2.903 1121 HB3 PHE 153 1HB PHE 153 10.595 -6.085 2.273 1122 HD1 PHE 153 HD2 PHE 153 10.934 -6.273 -0.212 1123 HD2 PHE 153 HD1 PHE 153 7.967 -3.678 1.446 1124 HE1 PHE 153 HE2 PHE 153 10.845 -5.018 -2.324 1125 HE2 PHE 153 HE1 PHE 153 7.887 -2.427 -0.674 1126 HZ PHE 153 HZ PHE 153 9.326 -3.095 -2.559 1127 H CYS 154 H CYS 154 7.969 -6.409 4.593 1128 HA CYS 154 HA CYS 154 9.979 -7.658 6.142 1129 HB2 CYS 154 2HB CYS 154 8.598 -6.875 8.096 1130 HB3 CYS 154 1HB CYS 154 8.973 -5.618 6.925 1131 HG CYS 154 HG CYS 154 6.595 -4.867 6.570 1132 H ALA 155 H ALA 155 6.554 -8.490 5.587 1133 HA ALA 155 HA ALA 155 6.242 -10.648 7.281 1134 HB1 ALA 155 3HB ALA 155 4.403 -9.670 5.978 1135 HB2 ALA 155 1HB ALA 155 4.463 -11.421 5.767 1136 HB3 ALA 155 2HB ALA 155 5.069 -10.354 4.497 1137 H TYR 156 H TYR 156 7.422 -10.717 3.933 1138 HA TYR 156 HA TYR 156 8.037 -13.560 4.051 1139 HB2 TYR 156 2HB TYR 156 8.279 -11.473 1.859 1140 HB3 TYR 156 1HB TYR 156 8.869 -13.120 1.649 1141 HD1 TYR 156 HD2 TYR 156 7.262 -15.045 1.682 1142 HD2 TYR 156 HD1 TYR 156 5.852 -11.008 1.752 1143 HE1 TYR 156 HE2 TYR 156 5.016 -15.817 1.063 1144 HE2 TYR 156 HE1 TYR 156 3.599 -11.792 1.138 1145 HH TYR 156 HH TYR 156 2.721 -15.122 1.200 1146 H SER 157 H SER 157 9.802 -10.710 4.846 1147 HA SER 157 HA SER 157 12.290 -12.243 5.040 1148 HB2 SER 157 2HB SER 157 12.184 -11.124 2.740 1149 HB3 SER 157 1HB SER 157 12.283 -9.574 3.569 1150 HG SER 157 HG SER 157 14.178 -11.673 3.511 1151 H ASP 158 H ASP 158 13.176 -11.852 6.976 1152 HA ASP 158 HA ASP 158 12.125 -9.824 8.730 1153 HB2 ASP 158 2HB ASP 158 13.593 -10.796 10.442 1154 HB3 ASP 158 1HB ASP 158 12.743 -12.064 9.571 1155 H THR 159 H THR 159 14.742 -9.864 6.518 1156 HA THR 159 HA THR 159 16.648 -8.203 7.752 1157 HB THR 159 HB THR 159 17.115 -9.564 5.727 1158 HG1 THR 159 HG1 THR 159 18.368 -7.608 6.298 1159 HG21 THR 159 3HG2 THR 159 16.462 -8.795 3.505 1160 HG22 THR 159 1HG2 THR 159 15.590 -7.428 4.198 1161 HG23 THR 159 2HG2 THR 159 15.016 -9.072 4.476 1162 H PHE 160 H PHE 160 13.558 -7.395 6.413 1163 HA PHE 160 HA PHE 160 14.146 -4.533 6.117 1164 HB2 PHE 160 2HB PHE 160 11.555 -6.117 5.755 1165 HB3 PHE 160 1HB PHE 160 11.709 -4.383 5.492 1166 HD1 PHE 160 HD2 PHE 160 12.682 -7.727 4.195 1167 HD2 PHE 160 HD1 PHE 160 12.674 -3.515 3.443 1168 HE1 PHE 160 HE2 PHE 160 13.298 -8.140 1.849 1169 HE2 PHE 160 HE1 PHE 160 13.292 -3.941 1.100 1170 HZ PHE 160 HZ PHE 160 13.606 -6.252 0.301 1171 H SER 161 H SER 161 13.394 -3.010 7.615 1172 HA SER 161 HA SER 161 12.556 -3.893 10.250 1173 HB2 SER 161 2HB SER 161 14.077 -1.934 9.910 1174 HB3 SER 161 1HB SER 161 12.795 -1.090 9.051 1175 HG SER 161 HG SER 161 13.242 -1.272 11.707 1176 H CYS 162 H CYS 162 10.366 -4.289 10.760 1177 HA CYS 162 HA CYS 162 8.353 -3.976 8.784 1178 HB2 CYS 162 2HB CYS 162 8.292 -5.846 10.389 1179 HB3 CYS 162 1HB CYS 162 8.141 -4.719 11.734 1180 HG CYS 162 HG CYS 162 5.637 -3.722 10.628 1181 HA PRO 163 HA PRO 163 7.446 0.287 9.814 1182 HB2 PRO 163 2HB PRO 163 5.235 0.682 8.246 1183 HB3 PRO 163 1HB PRO 163 6.860 0.497 7.553 1184 HG2 PRO 163 2HG PRO 163 4.659 -1.521 7.767 1185 HG3 PRO 163 1HG PRO 163 5.759 -1.192 6.408 1186 HD2 PRO 163 2HD PRO 163 6.127 -3.263 8.176 1187 HD3 PRO 163 1HD PRO 163 7.456 -2.475 7.305 1188 H LEU 164 H LEU 164 6.643 0.809 11.800 1189 HA LEU 164 HA LEU 164 4.508 -0.455 13.127 1190 HB2 LEU 164 2HB LEU 164 5.946 2.173 13.586 1191 HB3 LEU 164 1HB LEU 164 4.556 1.743 14.565 1192 HG LEU 164 HG LEU 164 5.744 -0.318 15.324 1193 HD11 LEU 164 1HD1 LEU 164 8.153 -0.591 14.972 1194 HD12 LEU 164 2HD1 LEU 164 8.158 0.781 13.861 1195 HD13 LEU 164 3HD1 LEU 164 7.259 -0.682 13.456 1196 HD21 LEU 164 3HD2 LEU 164 7.206 2.289 15.895 1197 HD22 LEU 164 1HD2 LEU 164 7.301 0.819 16.873 1198 HD23 LEU 164 2HD2 LEU 164 5.773 1.679 16.727 1199 HA PRO 165 HA PRO 165 1.327 1.696 10.668 1200 HB2 PRO 165 2HB PRO 165 -0.648 -0.185 11.806 1201 HB3 PRO 165 1HB PRO 165 -0.044 -0.083 10.142 1202 HG2 PRO 165 2HG PRO 165 0.529 -2.173 11.788 1203 HG3 PRO 165 1HG PRO 165 1.625 -1.636 10.491 1204 HD2 PRO 165 2HD PRO 165 1.740 -1.009 13.444 1205 HD3 PRO 165 1HD PRO 165 3.053 -1.484 12.338 1206 HA PRO 166 HA PRO 166 -0.113 4.441 14.030 1207 HB2 PRO 166 2HB PRO 166 -2.067 5.753 12.516 1208 HB3 PRO 166 1HB PRO 166 -0.344 6.176 12.472 1209 HG2 PRO 166 2HG PRO 166 -1.893 4.403 10.607 1210 HG3 PRO 166 1HG PRO 166 -0.730 5.693 10.221 1211 HD2 PRO 166 2HD PRO 166 0.053 3.157 10.120 1212 HD3 PRO 166 1HD PRO 166 1.130 4.377 10.841 1213 H GLU 167 H GLU 167 -1.495 3.667 15.607 1214 HA GLU 167 HA GLU 167 -2.761 1.228 15.285 1215 HB2 GLU 167 2HB GLU 167 -3.218 3.266 17.496 1216 HB3 GLU 167 1HB GLU 167 -3.671 1.561 17.584 1217 HG2 GLU 167 2HG GLU 167 -1.284 0.930 17.324 1218 HG3 GLU 167 1HG GLU 167 -0.852 2.639 17.287 1219 H SER 168 H SER 168 -4.231 4.293 14.649 1220 HA SER 168 HA SER 168 -6.988 3.487 14.829 1221 HB2 SER 168 2HB SER 168 -6.220 5.863 15.036 1222 HB3 SER 168 1HB SER 168 -5.788 5.854 13.328 1223 HG SER 168 HG SER 168 -7.977 5.502 12.832 1224 H ASN 169 H ASN 169 -4.670 2.467 12.663 1225 HA ASN 169 HA ASN 169 -6.459 2.377 10.312 1226 HB2 ASN 169 2HB ASN 169 -4.558 2.262 8.912 1227 HB3 ASN 169 1HB ASN 169 -4.074 3.405 10.151 1228 HD21 ASN 169 1HD2 ASN 169 -2.369 1.883 8.425 1229 HD22 ASN 169 2HD2 ASN 169 -1.353 0.922 9.426 1230 H TRP 170 H TRP 170 -5.887 0.574 12.900 1231 HA TRP 170 HA TRP 170 -5.352 -2.029 11.839 1232 HB2 TRP 170 2HB TRP 170 -6.470 -1.073 14.508 1233 HB3 TRP 170 1HB TRP 170 -6.176 -2.769 14.146 1234 HD1 TRP 170 HD1 TRP 170 -3.322 -1.023 12.643 1235 HE1 TRP 170 HE1 TRP 170 -1.288 -1.052 14.213 1236 HE3 TRP 170 HE3 TRP 170 -5.650 -2.361 17.014 1237 HZ2 TRP 170 HZ2 TRP 170 -0.725 -1.573 16.923 1238 HZ3 TRP 170 HZ3 TRP 170 -4.284 -2.602 19.050 1239 HH2 TRP 170 HH2 TRP 170 -1.869 -2.215 19.006 1240 H LEU 171 H LEU 171 -6.790 -2.786 10.334 1241 HA LEU 171 HA LEU 171 -9.625 -2.071 10.412 1242 HB2 LEU 171 2HB LEU 171 -8.111 -3.706 8.316 1243 HB3 LEU 171 1HB LEU 171 -9.729 -3.048 8.162 1244 HG LEU 171 HG LEU 171 -7.136 -1.466 8.200 1245 HD11 LEU 171 1HD1 LEU 171 -7.527 -2.656 6.080 1246 HD12 LEU 171 2HD1 LEU 171 -7.680 -0.917 5.858 1247 HD13 LEU 171 3HD1 LEU 171 -9.128 -1.921 5.943 1248 HD21 LEU 171 3HD2 LEU 171 -8.525 0.533 7.782 1249 HD22 LEU 171 1HD2 LEU 171 -8.860 -0.187 9.355 1250 HD23 LEU 171 2HD2 LEU 171 -9.983 -0.432 8.016 1251 H GLU 172 H GLU 172 -10.950 -3.464 11.516 1252 HA GLU 172 HA GLU 172 -10.118 -6.211 12.044 1253 HB2 GLU 172 2HB GLU 172 -11.314 -4.568 13.709 1254 HB3 GLU 172 1HB GLU 172 -12.787 -5.010 12.860 1255 HG2 GLU 172 2HG GLU 172 -12.575 -6.334 14.872 1256 HG3 GLU 172 1HG GLU 172 -12.396 -7.385 13.467 1257 H THR 173 H THR 173 -10.166 -6.246 9.534 1258 HA THR 173 HA THR 173 -12.292 -8.021 8.754 1259 HB THR 173 HB THR 173 -13.333 -5.883 8.140 1260 HG1 THR 173 HG1 THR 173 -13.732 -7.560 6.720 1261 HG21 THR 173 3HG2 THR 173 -11.318 -4.469 7.876 1262 HG22 THR 173 1HG2 THR 173 -12.375 -4.367 6.470 1263 HG23 THR 173 2HG2 THR 173 -10.904 -5.340 6.396 1264 H ALA 174 H ALA 174 -11.663 -9.295 6.917 1265 HA ALA 174 HA ALA 174 -8.755 -9.405 6.477 1266 HB1 ALA 174 3HB ALA 174 -9.214 -11.635 5.500 1267 HB2 ALA 174 1HB ALA 174 -10.949 -11.381 5.725 1268 HB3 ALA 174 2HB ALA 174 -9.883 -11.497 7.126 1269 H VAL 175 H VAL 175 -7.877 -8.681 4.632 1270 HA VAL 175 HA VAL 175 -9.511 -7.877 2.351 1271 HB VAL 175 HB VAL 175 -6.485 -7.691 2.791 1272 HG11 VAL 175 1HG1 VAL 175 -8.168 -6.519 0.538 1273 HG12 VAL 175 2HG1 VAL 175 -7.014 -7.849 0.388 1274 HG13 VAL 175 3HG1 VAL 175 -6.442 -6.231 0.791 1275 HG21 VAL 175 3HG2 VAL 175 -6.923 -5.250 3.094 1276 HG22 VAL 175 1HG2 VAL 175 -7.743 -6.228 4.311 1277 HG23 VAL 175 2HG2 VAL 175 -8.655 -5.553 2.962 1278 H THR 176 H THR 176 -10.305 -9.937 1.800 1279 HA THR 176 HA THR 176 -8.408 -11.818 0.566 1280 HB THR 176 HB THR 176 -10.499 -13.300 0.458 1281 HG1 THR 176 HG1 THR 176 -12.155 -11.837 0.695 1282 HG21 THR 176 3HG2 THR 176 -8.801 -13.590 2.241 1283 HG22 THR 176 1HG2 THR 176 -10.427 -13.909 2.852 1284 HG23 THR 176 2HG2 THR 176 -9.627 -12.382 3.228 1285 H ALA 177 H ALA 177 -7.957 -11.123 -1.407 1286 HA ALA 177 HA ALA 177 -10.116 -10.525 -3.338 1287 HB1 ALA 177 3HB ALA 177 -9.156 -8.382 -2.629 1288 HB2 ALA 177 1HB ALA 177 -8.665 -8.735 -4.286 1289 HB3 ALA 177 2HB ALA 177 -7.524 -8.970 -2.959 1290 H GLY 178 H GLY 178 -9.920 -11.948 -5.032 1291 HA2 GLY 178 2HA GLY 178 -9.145 -13.836 -6.131 1292 HA3 GLY 178 1HA GLY 178 -7.610 -12.978 -6.198 1293 H GLU 179 H GLU 179 -6.340 -14.878 -5.849 1294 HA GLU 179 HA GLU 179 -6.455 -16.514 -3.560 1295 HB2 GLU 179 2HB GLU 179 -4.079 -17.000 -3.942 1296 HB3 GLU 179 1HB GLU 179 -4.945 -16.987 -5.473 1297 HG2 GLU 179 2HG GLU 179 -4.047 -14.805 -6.038 1298 HG3 GLU 179 1HG GLU 179 -3.301 -14.652 -4.449 1299 H ARG 180 H ARG 180 -5.173 -16.382 -1.596 1300 HA ARG 180 HA ARG 180 -4.447 -13.680 -0.710 1301 HB2 ARG 180 2HB ARG 180 -5.851 -14.299 1.506 1302 HB3 ARG 180 1HB ARG 180 -6.561 -13.438 0.157 1303 HG2 ARG 180 2HG ARG 180 -8.110 -15.113 0.992 1304 HG3 ARG 180 1HG ARG 180 -7.616 -15.513 -0.651 1305 HD2 ARG 180 2HD ARG 180 -7.752 -17.511 0.796 1306 HD3 ARG 180 1HD ARG 180 -6.114 -17.252 0.194 1307 HE ARG 180 HE ARG 180 -6.079 -16.026 2.612 1308 HH11 ARG 180 1HH1 ARG 180 -6.973 -19.305 1.663 1309 HH12 ARG 180 2HH1 ARG 180 -6.510 -19.982 3.188 1310 HH21 ARG 180 1HH2 ARG 180 -5.420 -16.985 4.573 1311 HH22 ARG 180 2HH2 ARG 180 -5.637 -18.688 4.816 1312 H THR 181 H THR 181 -2.693 -13.656 0.583 1313 HA THR 181 HA THR 181 -1.025 -15.531 1.408 1314 HB THR 181 HB THR 181 -0.550 -14.147 3.487 1315 HG1 THR 181 HG1 THR 181 -3.046 -13.419 3.214 1316 HG21 THR 181 3HG2 THR 181 -0.893 -12.570 0.900 1317 HG22 THR 181 1HG2 THR 181 0.507 -13.562 1.327 1318 HG23 THR 181 2HG2 THR 181 0.139 -12.110 2.254 1319 H ASP 182 H ASP 182 -0.753 -17.066 3.044 1320 HA ASP 182 HA ASP 182 -3.013 -17.896 4.694 1321 HB2 ASP 182 2HB ASP 182 -3.612 -18.715 2.441 1322 HB3 ASP 182 1HB ASP 182 -2.017 -19.423 2.237 1323 H LEU 183 H LEU 183 -2.288 -20.168 5.758 1324 HA LEU 183 HA LEU 183 0.089 -19.553 7.177 1325 HB2 LEU 183 2HB LEU 183 -0.377 -21.337 8.610 1326 HB3 LEU 183 1HB LEU 183 -1.958 -20.814 8.073 1327 HG LEU 183 HG LEU 183 -0.513 -23.251 6.949 1328 HD11 LEU 183 1HD1 LEU 183 -0.976 -23.595 9.333 1329 HD12 LEU 183 2HD1 LEU 183 -1.982 -24.641 8.338 1330 HD13 LEU 183 3HD1 LEU 183 -2.678 -23.197 9.079 1331 HD21 LEU 183 3HD2 LEU 183 -2.688 -23.920 6.036 1332 HD22 LEU 183 1HD2 LEU 183 -2.207 -22.345 5.404 1333 HD23 LEU 183 2HD2 LEU 183 -3.432 -22.448 6.670 1334 H GLU 184 H GLU 184 -0.252 -21.163 4.196 1335 HA GLU 184 HA GLU 184 2.538 -22.172 4.370 1336 HB2 GLU 184 2HB GLU 184 1.928 -23.874 2.652 1337 HB3 GLU 184 1HB GLU 184 1.018 -24.069 4.147 1338 HG2 GLU 184 2HG GLU 184 -0.961 -23.091 3.154 1339 HG3 GLU 184 1HG GLU 184 -0.065 -22.645 1.703 1340 H HIS 185 H HIS 185 0.732 -19.723 3.097 1341 HA HIS 185 HA HIS 185 2.240 -19.553 0.548 1342 HB2 HIS 185 2HB HIS 185 -0.110 -20.060 0.094 1343 HB3 HIS 185 1HB HIS 185 -0.646 -18.717 1.099 1344 HD1 HIS 185 HD1 HIS 185 1.628 -19.098 -1.950 1345 HD2 HIS 185 HD2 HIS 185 -1.365 -16.621 -0.492 1346 HE1 HIS 185 HE1 HIS 185 1.285 -17.359 -3.719 1347 HE2 HIS 185 HE2 HIS 185 -0.683 -16.018 -2.915 Start of MODEL 6 1 H1 MET 1 1H MET 1 -17.779 4.864 -24.031 2 H2 MET 1 2H MET 1 -18.493 6.377 -24.252 3 H3 MET 1 3H MET 1 -19.146 5.305 -23.129 4 HA MET 1 HA MET 1 -16.459 6.553 -22.994 5 HB2 MET 1 2HB MET 1 -18.464 8.102 -22.663 6 HB3 MET 1 1HB MET 1 -18.896 7.149 -21.255 7 HG2 MET 1 2HG MET 1 -16.801 7.796 -20.159 8 HG3 MET 1 1HG MET 1 -16.311 8.692 -21.596 9 HE1 MET 1 3HE MET 1 -15.863 10.938 -20.267 10 HE2 MET 1 1HE MET 1 -16.215 10.065 -18.773 11 HE3 MET 1 2HE MET 1 -16.994 11.613 -19.093 12 H ASP 2 H ASP 2 -15.594 4.479 -22.680 13 HA ASP 2 HA ASP 2 -16.362 2.977 -20.246 14 HB2 ASP 2 2HB ASP 2 -14.760 2.095 -22.691 15 HB3 ASP 2 1HB ASP 2 -15.081 1.090 -21.282 16 H GLU 3 H GLU 3 -14.115 5.165 -21.335 17 HA GLU 3 HA GLU 3 -11.604 4.372 -20.839 18 HB2 GLU 3 2HB GLU 3 -12.784 7.127 -20.253 19 HB3 GLU 3 1HB GLU 3 -11.056 6.784 -20.312 20 HG2 GLU 3 2HG GLU 3 -11.589 7.744 -22.409 21 HG3 GLU 3 1HG GLU 3 -11.371 6.024 -22.704 22 H ASP 4 H ASP 4 -13.549 6.061 -18.349 23 HA ASP 4 HA ASP 4 -11.551 5.996 -16.363 24 HB2 ASP 4 2HB ASP 4 -13.432 7.624 -16.374 25 HB3 ASP 4 1HB ASP 4 -14.566 6.328 -16.012 26 H THR 5 H THR 5 -13.976 3.668 -17.262 27 HA THR 5 HA THR 5 -13.937 2.171 -14.782 28 HB THR 5 HB THR 5 -15.108 1.326 -17.469 29 HG1 THR 5 HG1 THR 5 -16.447 2.909 -17.107 30 HG21 THR 5 3HG2 THR 5 -14.952 -0.520 -15.792 31 HG22 THR 5 1HG2 THR 5 -16.626 -0.074 -16.121 32 HG23 THR 5 2HG2 THR 5 -15.845 0.469 -14.635 33 H GLU 6 H GLU 6 -12.473 1.883 -18.022 34 HA GLU 6 HA GLU 6 -11.147 -0.640 -17.381 35 HB2 GLU 6 2HB GLU 6 -10.312 -0.609 -19.652 36 HB3 GLU 6 1HB GLU 6 -12.023 -0.201 -19.666 37 HG2 GLU 6 2HG GLU 6 -11.398 2.216 -19.896 38 HG3 GLU 6 1HG GLU 6 -9.708 1.735 -19.990 39 H ASP 7 H ASP 7 -10.466 2.700 -17.103 40 HA ASP 7 HA ASP 7 -7.662 2.767 -17.432 41 HB2 ASP 7 2HB ASP 7 -9.526 4.554 -15.869 42 HB3 ASP 7 1HB ASP 7 -7.784 4.794 -15.753 43 H TRP 8 H TRP 8 -9.650 1.857 -14.723 44 HA TRP 8 HA TRP 8 -7.905 1.522 -12.644 45 HB2 TRP 8 2HB TRP 8 -10.332 1.078 -12.526 46 HB3 TRP 8 1HB TRP 8 -10.145 -0.331 -13.563 47 HD1 TRP 8 HD1 TRP 8 -8.828 0.867 -10.112 48 HE1 TRP 8 HE1 TRP 8 -8.700 -1.165 -8.582 49 HE3 TRP 8 HE3 TRP 8 -10.284 -2.777 -13.402 50 HZ2 TRP 8 HZ2 TRP 8 -9.160 -3.918 -8.681 51 HZ3 TRP 8 HZ3 TRP 8 -10.421 -5.099 -12.587 52 HH2 TRP 8 HH2 TRP 8 -9.870 -5.652 -10.274 53 H GLU 9 H GLU 9 -8.618 -0.976 -15.148 54 HA GLU 9 HA GLU 9 -6.459 -2.684 -14.233 55 HB2 GLU 9 2HB GLU 9 -7.223 -4.257 -15.988 56 HB3 GLU 9 1HB GLU 9 -8.560 -3.706 -14.986 57 HG2 GLU 9 2HG GLU 9 -9.269 -2.149 -16.753 58 HG3 GLU 9 1HG GLU 9 -7.895 -2.636 -17.739 59 H THR 10 H THR 10 -6.835 -0.240 -16.660 60 HA THR 10 HA THR 10 -4.802 -1.061 -18.488 61 HB THR 10 HB THR 10 -6.023 1.700 -18.034 62 HG1 THR 10 HG1 THR 10 -6.901 0.524 -20.250 63 HG21 THR 10 3HG2 THR 10 -4.531 0.629 -20.473 64 HG22 THR 10 1HG2 THR 10 -3.904 1.834 -19.343 65 HG23 THR 10 2HG2 THR 10 -5.306 2.211 -20.344 66 H GLN 11 H GLN 11 -4.850 1.551 -15.990 67 HA GLN 11 HA GLN 11 -2.086 2.050 -16.016 68 HB2 GLN 11 2HB GLN 11 -2.383 3.264 -13.953 69 HB3 GLN 11 1HB GLN 11 -3.788 3.558 -14.965 70 HG2 GLN 11 2HG GLN 11 -5.106 1.986 -13.627 71 HG3 GLN 11 1HG GLN 11 -3.704 1.627 -12.635 72 HE21 GLN 11 1HE2 GLN 11 -6.343 2.743 -11.918 73 HE22 GLN 11 2HE2 GLN 11 -6.005 4.225 -11.094 74 H LEU 12 H LEU 12 -4.017 -0.373 -14.371 75 HA LEU 12 HA LEU 12 -2.233 -1.095 -12.328 76 HB2 LEU 12 2HB LEU 12 -4.598 -1.572 -12.212 77 HB3 LEU 12 1HB LEU 12 -4.515 -2.600 -13.632 78 HG LEU 12 HG LEU 12 -3.284 -4.310 -12.393 79 HD11 LEU 12 1HD1 LEU 12 -3.323 -2.431 -10.010 80 HD12 LEU 12 2HD1 LEU 12 -1.903 -2.933 -10.935 81 HD13 LEU 12 3HD1 LEU 12 -2.798 -4.119 -9.990 82 HD21 LEU 12 3HD2 LEU 12 -5.726 -4.380 -12.261 83 HD22 LEU 12 1HD2 LEU 12 -5.706 -3.332 -10.838 84 HD23 LEU 12 2HD2 LEU 12 -5.016 -4.954 -10.757 85 H GLN 13 H GLN 13 -2.785 -2.562 -15.573 86 HA GLN 13 HA GLN 13 -1.107 -4.792 -15.228 87 HB2 GLN 13 2HB GLN 13 -1.097 -4.989 -17.692 88 HB3 GLN 13 1HB GLN 13 -2.710 -4.677 -17.065 89 HG2 GLN 13 2HG GLN 13 -2.537 -2.326 -17.720 90 HG3 GLN 13 1HG GLN 13 -0.897 -2.592 -18.301 91 HE21 GLN 13 1HE2 GLN 13 -3.573 -4.863 -18.843 92 HE22 GLN 13 2HE2 GLN 13 -3.667 -4.595 -20.548 93 H ALA 14 H ALA 14 -0.303 -1.468 -15.968 94 HA ALA 14 HA ALA 14 2.475 -1.968 -16.655 95 HB1 ALA 14 3HB ALA 14 1.032 0.624 -16.006 96 HB2 ALA 14 1HB ALA 14 1.269 -0.058 -17.615 97 HB3 ALA 14 2HB ALA 14 2.661 0.490 -16.680 98 H ASN 15 H ASN 15 0.662 -0.747 -13.840 99 HA ASN 15 HA ASN 15 2.771 -0.121 -12.105 100 HB2 ASN 15 2HB ASN 15 -0.093 -0.998 -11.537 101 HB3 ASN 15 1HB ASN 15 1.018 -0.508 -10.258 102 HD21 ASN 15 1HD2 ASN 15 -0.658 1.105 -9.840 103 HD22 ASN 15 2HD2 ASN 15 -0.649 2.582 -10.735 104 H ARG 16 H ARG 16 0.787 -3.113 -12.108 105 HA ARG 16 HA ARG 16 2.410 -4.556 -10.301 106 HB2 ARG 16 2HB ARG 16 1.161 -6.584 -11.038 107 HB3 ARG 16 1HB ARG 16 0.106 -5.242 -10.624 108 HG2 ARG 16 2HG ARG 16 -0.510 -4.855 -12.860 109 HG3 ARG 16 1HG ARG 16 0.867 -5.742 -13.503 110 HD2 ARG 16 2HD ARG 16 -1.477 -6.827 -13.652 111 HD3 ARG 16 1HD ARG 16 -0.129 -7.822 -13.104 112 HE ARG 16 HE ARG 16 -1.630 -6.570 -10.971 113 HH11 ARG 16 1HH1 ARG 16 -1.431 -9.424 -13.026 114 HH12 ARG 16 2HH1 ARG 16 -2.299 -10.427 -11.910 115 HH21 ARG 16 1HH2 ARG 16 -2.688 -7.926 -9.501 116 HH22 ARG 16 2HH2 ARG 16 -3.011 -9.582 -9.913 117 H ASP 17 H ASP 17 2.816 -3.968 -13.729 118 HA ASP 17 HA ASP 17 4.423 -6.257 -14.328 119 HB2 ASP 17 2HB ASP 17 3.363 -4.912 -16.106 120 HB3 ASP 17 1HB ASP 17 4.360 -3.522 -15.684 121 H GLU 18 H GLU 18 5.300 -2.850 -13.737 122 HA GLU 18 HA GLU 18 8.102 -3.307 -13.526 123 HB2 GLU 18 2HB GLU 18 8.208 -0.946 -12.746 124 HB3 GLU 18 1HB GLU 18 7.229 -1.128 -14.198 125 HG2 GLU 18 2HG GLU 18 5.172 -1.076 -12.753 126 HG3 GLU 18 1HG GLU 18 6.213 -0.760 -11.368 127 H LYS 19 H LYS 19 5.494 -3.411 -11.187 128 HA LYS 19 HA LYS 19 7.287 -3.219 -8.904 129 HB2 LYS 19 2HB LYS 19 4.865 -2.268 -9.103 130 HB3 LYS 19 1HB LYS 19 4.338 -3.900 -8.724 131 HG2 LYS 19 2HG LYS 19 4.381 -2.408 -6.742 132 HG3 LYS 19 1HG LYS 19 5.442 -3.803 -6.552 133 HD2 LYS 19 2HD LYS 19 6.458 -1.682 -5.706 134 HD3 LYS 19 1HD LYS 19 7.413 -2.439 -6.978 135 HE2 LYS 19 2HE LYS 19 7.347 -0.013 -7.308 136 HE3 LYS 19 1HE LYS 19 6.490 -0.816 -8.619 137 HZ1 LYS 19 3HZ LYS 19 5.299 1.124 -7.854 138 HZ2 LYS 19 1HZ LYS 19 5.229 0.519 -6.277 139 HZ3 LYS 19 2HZ LYS 19 4.394 -0.262 -7.526 140 H ASP 20 H ASP 20 5.664 -5.757 -10.720 141 HA ASP 20 HA ASP 20 6.325 -7.960 -9.026 142 HB2 ASP 20 2HB ASP 20 4.703 -8.414 -10.691 143 HB3 ASP 20 1HB ASP 20 5.664 -7.691 -11.970 144 H ARG 21 H ARG 21 7.900 -6.518 -11.842 145 HA ARG 21 HA ARG 21 10.192 -8.286 -11.749 146 HB2 ARG 21 2HB ARG 21 10.994 -7.189 -13.692 147 HB3 ARG 21 1HB ARG 21 9.251 -7.275 -13.884 148 HG2 ARG 21 2HG ARG 21 9.059 -4.902 -13.239 149 HG3 ARG 21 1HG ARG 21 10.810 -4.810 -13.034 150 HD2 ARG 21 2HD ARG 21 10.135 -3.873 -15.200 151 HD3 ARG 21 1HD ARG 21 11.125 -5.317 -15.426 152 HE ARG 21 HE ARG 21 8.169 -5.256 -15.690 153 HH11 ARG 21 1HH1 ARG 21 11.285 -6.509 -16.788 154 HH12 ARG 21 2HH1 ARG 21 10.567 -7.493 -18.026 155 HH21 ARG 21 1HH2 ARG 21 7.274 -6.538 -17.298 156 HH22 ARG 21 2HH2 ARG 21 8.292 -7.508 -18.318 157 H PHE 22 H PHE 22 9.293 -5.488 -10.093 158 HA PHE 22 HA PHE 22 11.600 -4.129 -9.523 159 HB2 PHE 22 2HB PHE 22 9.208 -3.719 -8.723 160 HB3 PHE 22 1HB PHE 22 9.492 -4.911 -7.467 161 HD1 PHE 22 HD1 PHE 22 10.407 -1.544 -8.712 162 HD2 PHE 22 HD2 PHE 22 10.769 -4.330 -5.497 163 HE1 PHE 22 HE1 PHE 22 11.239 0.248 -7.245 164 HE2 PHE 22 HE2 PHE 22 11.599 -2.538 -4.045 165 HZ PHE 22 HZ PHE 22 11.834 -0.247 -4.907 166 H PHE 23 H PHE 23 10.467 -7.161 -7.988 167 HA PHE 23 HA PHE 23 12.826 -7.444 -6.311 168 HB2 PHE 23 2HB PHE 23 10.435 -9.240 -6.847 169 HB3 PHE 23 1HB PHE 23 11.792 -9.777 -5.865 170 HD1 PHE 23 HD2 PHE 23 10.618 -6.249 -5.675 171 HD2 PHE 23 HD1 PHE 23 10.369 -10.155 -3.933 172 HE1 PHE 23 HE2 PHE 23 9.532 -5.302 -3.679 173 HE2 PHE 23 HE1 PHE 23 9.289 -9.190 -1.948 174 HZ PHE 23 HZ PHE 23 8.865 -6.768 -1.819 175 H SER 24 H SER 24 12.178 -8.205 -9.577 176 HA SER 24 HA SER 24 14.039 -10.493 -9.655 177 HB2 SER 24 2HB SER 24 11.796 -10.851 -10.621 178 HB3 SER 24 1HB SER 24 12.026 -9.487 -11.712 179 HG SER 24 HG SER 24 13.063 -10.764 -13.010 180 H GLU 25 H GLU 25 13.813 -7.123 -10.558 181 HA GLU 25 HA GLU 25 16.052 -7.336 -12.484 182 HB2 GLU 25 2HB GLU 25 13.494 -5.687 -12.728 183 HB3 GLU 25 1HB GLU 25 14.895 -5.463 -13.766 184 HG2 GLU 25 2HG GLU 25 13.325 -8.046 -13.567 185 HG3 GLU 25 1HG GLU 25 13.015 -6.794 -14.771 186 H HIS 26 H HIS 26 14.096 -5.077 -10.509 187 HA HIS 26 HA HIS 26 15.995 -2.931 -10.756 188 HB2 HIS 26 2HB HIS 26 13.594 -2.462 -10.704 189 HB3 HIS 26 1HB HIS 26 13.424 -3.240 -9.132 190 HD2 HIS 26 HD2 HIS 26 14.300 0.217 -10.635 191 HE1 HIS 26 HE1 HIS 26 14.712 0.415 -6.429 192 HE2 HIS 26 HE2 HIS 26 14.384 1.761 -8.553 193 H ARG 27 H ARG 27 14.604 -4.357 -7.801 194 HA ARG 27 HA ARG 27 17.066 -3.918 -6.284 195 HB2 ARG 27 2HB ARG 27 14.284 -4.854 -5.456 196 HB3 ARG 27 1HB ARG 27 15.639 -4.776 -4.338 197 HG2 ARG 27 2HG ARG 27 14.334 -2.455 -5.765 198 HG3 ARG 27 1HG ARG 27 14.201 -2.860 -4.052 199 HD2 ARG 27 2HD ARG 27 16.641 -2.463 -3.803 200 HD3 ARG 27 1HD ARG 27 16.712 -1.974 -5.499 201 HE ARG 27 HE ARG 27 14.929 -0.257 -4.709 202 HH11 ARG 27 1HH1 ARG 27 17.756 -1.265 -2.858 203 HH12 ARG 27 2HH1 ARG 27 17.872 0.248 -2.014 204 HH21 ARG 27 1HH2 ARG 27 15.110 1.699 -3.602 205 HH22 ARG 27 2HH2 ARG 27 16.378 1.920 -2.432 206 H GLN 28 H GLN 28 18.236 -5.571 -5.318 207 HA GLN 28 HA GLN 28 18.121 -8.291 -6.101 208 HB2 GLN 28 2HB GLN 28 19.532 -8.681 -4.031 209 HB3 GLN 28 1HB GLN 28 20.145 -7.389 -5.056 210 HG2 GLN 28 2HG GLN 28 19.071 -5.723 -3.528 211 HG3 GLN 28 1HG GLN 28 18.577 -7.057 -2.487 212 HE21 GLN 28 1HE2 GLN 28 19.735 -6.088 -0.780 213 HE22 GLN 28 2HE2 GLN 28 21.460 -6.195 -0.682 214 H SER 29 H SER 29 16.610 -9.811 -5.575 215 HA SER 29 HA SER 29 14.254 -9.304 -4.228 216 HB2 SER 29 2HB SER 29 13.932 -11.817 -4.226 217 HB3 SER 29 1HB SER 29 14.431 -11.167 -5.787 218 HG SER 29 HG SER 29 16.541 -11.894 -4.186 219 HA PRO 30 HA PRO 30 15.675 -9.463 0.105 220 HB2 PRO 30 2HB PRO 30 13.245 -8.992 1.295 221 HB3 PRO 30 1HB PRO 30 14.220 -7.710 0.551 222 HG2 PRO 30 2HG PRO 30 11.869 -9.182 -0.589 223 HG3 PRO 30 1HG PRO 30 12.242 -7.445 -0.640 224 HD2 PRO 30 2HD PRO 30 12.727 -9.074 -2.753 225 HD3 PRO 30 1HD PRO 30 13.758 -7.675 -2.381 226 H ILE 31 H ILE 31 13.524 -11.551 -1.521 227 HA ILE 31 HA ILE 31 12.993 -13.497 0.445 228 HB ILE 31 HB ILE 31 13.570 -14.132 -2.488 229 HG12 ILE 31 2HG1 ILE 31 11.991 -12.183 -2.382 230 HG13 ILE 31 1HG1 ILE 31 11.265 -13.611 -3.102 231 HG21 ILE 31 1HG2 ILE 31 11.896 -15.925 -2.167 232 HG22 ILE 31 2HG2 ILE 31 11.693 -15.432 -0.485 233 HG23 ILE 31 3HG2 ILE 31 13.241 -16.077 -1.034 234 HD11 ILE 31 3HD1 ILE 31 10.063 -14.032 -0.998 235 HD12 ILE 31 1HD1 ILE 31 9.698 -12.447 -1.677 236 HD13 ILE 31 2HD1 ILE 31 10.791 -12.583 -0.302 237 HA PRO 32 HA PRO 32 17.403 -14.199 1.416 238 HB2 PRO 32 2HB PRO 32 16.219 -16.671 2.716 239 HB3 PRO 32 1HB PRO 32 17.358 -15.484 3.391 240 HG2 PRO 32 2HG PRO 32 14.839 -15.354 4.130 241 HG3 PRO 32 1HG PRO 32 15.686 -13.849 3.691 242 HD2 PRO 32 2HD PRO 32 13.729 -15.456 2.053 243 HD3 PRO 32 1HD PRO 32 13.836 -13.692 2.271 244 HA PRO 33 HA PRO 33 19.451 -16.448 -1.653 245 HB2 PRO 33 2HB PRO 33 21.274 -18.141 -0.291 246 HB3 PRO 33 1HB PRO 33 21.527 -16.429 -0.676 247 HG2 PRO 33 2HG PRO 33 20.519 -17.655 1.873 248 HG3 PRO 33 1HG PRO 33 21.687 -16.329 1.641 249 HD2 PRO 33 2HD PRO 33 19.210 -15.743 2.343 250 HD3 PRO 33 1HD PRO 33 20.005 -14.773 1.081 251 H GLU 34 H GLU 34 18.613 -18.819 0.853 252 HA GLU 34 HA GLU 34 18.392 -20.975 -1.097 253 HB2 GLU 34 2HB GLU 34 17.989 -22.474 0.788 254 HB3 GLU 34 1HB GLU 34 19.419 -21.500 1.070 255 HG2 GLU 34 2HG GLU 34 16.709 -20.988 2.320 256 HG3 GLU 34 1HG GLU 34 18.023 -21.863 3.093 257 H GLU 35 H GLU 35 16.255 -18.892 0.809 258 HA GLU 35 HA GLU 35 13.821 -20.248 0.314 259 HB2 GLU 35 2HB GLU 35 14.252 -17.276 0.819 260 HB3 GLU 35 1HB GLU 35 12.713 -18.123 0.947 261 HG2 GLU 35 2HG GLU 35 15.153 -18.483 2.701 262 HG3 GLU 35 1HG GLU 35 13.611 -17.762 3.156 263 H ARG 36 H ARG 36 15.642 -17.910 -1.663 264 HA ARG 36 HA ARG 36 13.504 -17.357 -3.468 265 HB2 ARG 36 2HB ARG 36 15.111 -15.996 -4.672 266 HB3 ARG 36 1HB ARG 36 15.325 -15.729 -2.944 267 HG2 ARG 36 2HG ARG 36 17.225 -17.394 -3.023 268 HG3 ARG 36 1HG ARG 36 17.075 -17.381 -4.780 269 HD2 ARG 36 2HD ARG 36 17.789 -15.043 -2.990 270 HD3 ARG 36 1HD ARG 36 18.868 -15.898 -4.089 271 HE ARG 36 HE ARG 36 16.541 -14.352 -5.073 272 HH11 ARG 36 1HH1 ARG 36 20.017 -14.983 -5.177 273 HH12 ARG 36 2HH1 ARG 36 20.276 -13.906 -6.515 274 HH21 ARG 36 1HH2 ARG 36 16.923 -12.932 -6.779 275 HH22 ARG 36 2HH2 ARG 36 18.525 -12.745 -7.420 276 H ASP 37 H ASP 37 15.367 -20.096 -3.134 277 HA ASP 37 HA ASP 37 16.029 -20.941 -5.695 278 HB2 ASP 37 2HB ASP 37 16.691 -22.239 -3.756 279 HB3 ASP 37 1HB ASP 37 15.014 -22.558 -3.327 280 H ASP 38 H ASP 38 12.911 -21.196 -4.041 281 HA ASP 38 HA ASP 38 11.585 -22.067 -6.545 282 HB2 ASP 38 2HB ASP 38 11.580 -23.601 -4.521 283 HB3 ASP 38 1HB ASP 38 10.640 -22.388 -3.668 284 H PHE 39 H PHE 39 12.157 -19.169 -5.245 285 HA PHE 39 HA PHE 39 9.628 -18.132 -4.542 286 HB2 PHE 39 2HB PHE 39 10.664 -16.125 -4.170 287 HB3 PHE 39 1HB PHE 39 12.123 -17.055 -4.364 288 HD1 PHE 39 HD1 PHE 39 13.337 -16.978 -6.637 289 HD2 PHE 39 HD2 PHE 39 10.172 -14.275 -5.627 290 HE1 PHE 39 HE1 PHE 39 14.046 -15.457 -8.447 291 HE2 PHE 39 HE2 PHE 39 10.887 -12.766 -7.440 292 HZ PHE 39 HZ PHE 39 12.819 -13.359 -8.852 293 H ASP 40 H ASP 40 7.938 -17.557 -5.682 294 HA ASP 40 HA ASP 40 8.017 -17.400 -8.627 295 HB2 ASP 40 2HB ASP 40 6.340 -18.913 -7.650 296 HB3 ASP 40 1HB ASP 40 5.720 -17.622 -6.628 297 H GLY 41 H GLY 41 6.777 -15.580 -9.632 298 HA2 GLY 41 2HA GLY 41 7.623 -13.028 -8.854 299 HA3 GLY 41 1HA GLY 41 6.326 -13.368 -9.989 300 H LEU 42 H LEU 42 5.812 -11.158 -8.718 301 HA LEU 42 HA LEU 42 4.827 -11.576 -5.999 302 HB2 LEU 42 2HB LEU 42 5.095 -9.015 -7.618 303 HB3 LEU 42 1HB LEU 42 4.479 -9.097 -5.972 304 HG LEU 42 HG LEU 42 7.305 -9.775 -6.867 305 HD11 LEU 42 1HD1 LEU 42 6.273 -7.533 -5.110 306 HD12 LEU 42 2HD1 LEU 42 6.829 -7.376 -6.777 307 HD13 LEU 42 3HD1 LEU 42 7.963 -7.849 -5.518 308 HD21 LEU 42 3HD2 LEU 42 7.824 -10.163 -4.491 309 HD22 LEU 42 1HD2 LEU 42 6.620 -11.312 -5.070 310 HD23 LEU 42 2HD2 LEU 42 6.124 -9.947 -4.067 311 H SER 43 H SER 43 3.105 -12.922 -6.530 312 HA SER 43 HA SER 43 0.734 -11.697 -7.718 313 HB2 SER 43 2HB SER 43 -0.312 -13.935 -7.142 314 HB3 SER 43 1HB SER 43 1.057 -14.045 -8.246 315 HG SER 43 HG SER 43 1.637 -15.510 -6.838 316 H TYR 44 H TYR 44 -1.157 -11.423 -6.419 317 HA TYR 44 HA TYR 44 -0.918 -11.379 -3.516 318 HB2 TYR 44 2HB TYR 44 -1.556 -8.900 -3.466 319 HB3 TYR 44 1HB TYR 44 0.100 -9.256 -3.926 320 HD1 TYR 44 HD1 TYR 44 -3.189 -8.107 -5.191 321 HD2 TYR 44 HD2 TYR 44 0.939 -8.633 -6.145 322 HE1 TYR 44 HE1 TYR 44 -3.474 -6.712 -7.181 323 HE2 TYR 44 HE2 TYR 44 0.647 -7.228 -8.145 324 HH TYR 44 HH TYR 44 -1.971 -5.246 -8.640 325 H PHE 45 H PHE 45 -3.145 -9.904 -2.901 326 HA PHE 45 HA PHE 45 -5.319 -11.613 -3.444 327 HB2 PHE 45 2HB PHE 45 -5.374 -8.674 -2.596 328 HB3 PHE 45 1HB PHE 45 -6.769 -9.748 -2.558 329 HD1 PHE 45 HD1 PHE 45 -6.750 -11.739 -0.991 330 HD2 PHE 45 HD2 PHE 45 -3.788 -8.657 -0.791 331 HE1 PHE 45 HE1 PHE 45 -6.143 -12.461 1.280 332 HE2 PHE 45 HE2 PHE 45 -3.189 -9.393 1.474 333 HZ PHE 45 HZ PHE 45 -4.358 -11.295 2.514 334 H ASP 46 H ASP 46 -6.665 -11.756 -5.251 335 HA ASP 46 HA ASP 46 -5.486 -10.660 -7.623 336 HB2 ASP 46 2HB ASP 46 -6.373 -12.978 -7.495 337 HB3 ASP 46 1HB ASP 46 -7.999 -12.344 -7.318 338 HA PRO 47 HA PRO 47 -7.421 -6.693 -7.786 339 HB2 PRO 47 2HB PRO 47 -7.663 -7.360 -10.739 340 HB3 PRO 47 1HB PRO 47 -7.098 -5.855 -9.974 341 HG2 PRO 47 2HG PRO 47 -5.319 -7.562 -10.918 342 HG3 PRO 47 1HG PRO 47 -5.041 -6.786 -9.338 343 HD2 PRO 47 2HD PRO 47 -5.891 -9.600 -9.935 344 HD3 PRO 47 1HD PRO 47 -4.876 -8.978 -8.614 345 H ASP 48 H ASP 48 -9.375 -6.642 -6.856 346 HA ASP 48 HA ASP 48 -11.757 -7.600 -8.337 347 HB2 ASP 48 2HB ASP 48 -11.196 -9.025 -6.360 348 HB3 ASP 48 1HB ASP 48 -11.325 -7.610 -5.320 349 HA PRO 49 HA PRO 49 -12.582 -3.134 -7.842 350 HB2 PRO 49 2HB PRO 49 -14.434 -2.861 -9.785 351 HB3 PRO 49 1HB PRO 49 -12.728 -3.168 -10.184 352 HG2 PRO 49 2HG PRO 49 -15.012 -5.117 -10.088 353 HG3 PRO 49 1HG PRO 49 -13.746 -4.932 -11.324 354 HD2 PRO 49 2HD PRO 49 -13.638 -6.821 -9.322 355 HD3 PRO 49 1HD PRO 49 -12.194 -6.142 -10.105 356 H ASP 50 H ASP 50 -14.646 -5.782 -7.118 357 HA ASP 50 HA ASP 50 -16.952 -4.172 -6.312 358 HB2 ASP 50 2HB ASP 50 -16.450 -7.168 -6.116 359 HB3 ASP 50 1HB ASP 50 -17.957 -6.375 -5.664 360 H TYR 51 H TYR 51 -14.088 -5.444 -4.864 361 HA TYR 51 HA TYR 51 -15.112 -5.046 -2.130 362 HB2 TYR 51 2HB TYR 51 -13.559 -7.007 -2.763 363 HB3 TYR 51 1HB TYR 51 -12.266 -5.830 -2.929 364 HD1 TYR 51 HD2 TYR 51 -11.386 -4.647 -0.879 365 HD2 TYR 51 HD1 TYR 51 -14.368 -7.698 -0.568 366 HE1 TYR 51 HE2 TYR 51 -10.972 -4.813 1.532 367 HE2 TYR 51 HE1 TYR 51 -13.947 -7.852 1.850 368 HH TYR 51 HH TYR 51 -12.122 -7.328 3.463 369 H ARG 52 H ARG 52 -13.255 -3.564 -4.607 370 HA ARG 52 HA ARG 52 -11.784 -1.561 -3.421 371 HB2 ARG 52 2HB ARG 52 -11.668 -2.016 -5.803 372 HB3 ARG 52 1HB ARG 52 -13.359 -1.595 -6.025 373 HG2 ARG 52 2HG ARG 52 -12.808 0.779 -5.465 374 HG3 ARG 52 1HG ARG 52 -11.104 0.322 -5.337 375 HD2 ARG 52 2HD ARG 52 -11.498 1.287 -7.527 376 HD3 ARG 52 1HD ARG 52 -11.166 -0.435 -7.720 377 HE ARG 52 HE ARG 52 -13.934 -0.125 -7.544 378 HH11 ARG 52 1HH1 ARG 52 -11.357 0.762 -9.765 379 HH12 ARG 52 2HH1 ARG 52 -12.396 0.766 -11.155 380 HH21 ARG 52 1HH2 ARG 52 -15.298 -0.040 -9.349 381 HH22 ARG 52 2HH2 ARG 52 -14.640 0.313 -10.917 382 H VAL 53 H VAL 53 -12.228 0.345 -2.468 383 HA VAL 53 HA VAL 53 -14.984 1.432 -2.452 384 HB VAL 53 HB VAL 53 -14.725 2.180 -0.151 385 HG11 VAL 53 1HG1 VAL 53 -13.946 -0.757 -0.321 386 HG12 VAL 53 2HG1 VAL 53 -15.583 -0.097 -0.392 387 HG13 VAL 53 3HG1 VAL 53 -14.644 0.049 1.093 388 HG21 VAL 53 3HG2 VAL 53 -12.329 2.699 -0.133 389 HG22 VAL 53 1HG2 VAL 53 -11.928 0.979 -0.169 390 HG23 VAL 53 2HG2 VAL 53 -12.740 1.672 1.238 391 H GLU 54 H GLU 54 -14.686 3.827 -1.505 392 HA GLU 54 HA GLU 54 -12.219 5.112 -2.463 393 HB2 GLU 54 2HB GLU 54 -13.600 6.987 -3.437 394 HB3 GLU 54 1HB GLU 54 -13.746 5.463 -4.304 395 HG2 GLU 54 2HG GLU 54 -15.904 5.079 -2.955 396 HG3 GLU 54 1HG GLU 54 -15.771 6.771 -2.478 397 H ALA 55 H ALA 55 -11.855 7.209 -1.405 398 HA ALA 55 HA ALA 55 -13.129 7.419 1.247 399 HB1 ALA 55 3HB ALA 55 -11.166 5.947 1.483 400 HB2 ALA 55 1HB ALA 55 -10.913 7.479 2.321 401 HB3 ALA 55 2HB ALA 55 -10.138 7.187 0.761 402 H THR 56 H THR 56 -13.047 9.484 2.168 403 HA THR 56 HA THR 56 -12.276 11.701 0.428 404 HB THR 56 HB THR 56 -13.534 11.762 3.212 405 HG1 THR 56 HG1 THR 56 -14.671 10.839 1.125 406 HG21 THR 56 3HG2 THR 56 -12.431 13.901 2.599 407 HG22 THR 56 1HG2 THR 56 -14.187 14.077 2.632 408 HG23 THR 56 2HG2 THR 56 -13.345 13.939 1.089 409 H VAL 57 H VAL 57 -10.405 12.734 0.659 410 HA VAL 57 HA VAL 57 -8.313 11.789 2.353 411 HB VAL 57 HB VAL 57 -8.261 14.235 0.514 412 HG11 VAL 57 1HG1 VAL 57 -6.030 12.375 1.406 413 HG12 VAL 57 2HG1 VAL 57 -6.327 13.996 2.032 414 HG13 VAL 57 3HG1 VAL 57 -5.858 13.780 0.347 415 HG21 VAL 57 3HG2 VAL 57 -9.126 12.305 -0.753 416 HG22 VAL 57 1HG2 VAL 57 -7.729 11.344 -0.263 417 HG23 VAL 57 2HG2 VAL 57 -7.512 12.755 -1.303 418 H THR 58 H THR 58 -7.338 12.827 4.033 419 HA THR 58 HA THR 58 -8.357 15.435 5.005 420 HB THR 58 HB THR 58 -7.576 13.003 6.701 421 HG1 THR 58 HG1 THR 58 -9.873 13.463 5.447 422 HG21 THR 58 3HG2 THR 58 -7.160 15.127 7.878 423 HG22 THR 58 1HG2 THR 58 -8.518 14.262 8.603 424 HG23 THR 58 2HG2 THR 58 -8.817 15.647 7.549 425 H VAL 59 H VAL 59 -6.577 16.641 4.253 426 HA VAL 59 HA VAL 59 -3.852 15.554 4.559 427 HB VAL 59 HB VAL 59 -4.770 18.062 3.051 428 HG11 VAL 59 1HG1 VAL 59 -2.005 16.784 3.206 429 HG12 VAL 59 2HG1 VAL 59 -2.469 18.337 3.905 430 HG13 VAL 59 3HG1 VAL 59 -2.453 18.131 2.153 431 HG21 VAL 59 3HG2 VAL 59 -4.201 16.760 1.025 432 HG22 VAL 59 1HG2 VAL 59 -5.483 15.981 1.955 433 HG23 VAL 59 2HG2 VAL 59 -3.833 15.356 2.030 434 H HIS 60 H HIS 60 -2.489 16.298 6.035 435 HA HIS 60 HA HIS 60 -3.503 18.084 8.118 436 HB2 HIS 60 2HB HIS 60 -1.154 16.135 8.045 437 HB3 HIS 60 1HB HIS 60 -1.648 17.066 9.463 438 HD1 HIS 60 HD1 HIS 60 -2.631 14.104 7.386 439 HD2 HIS 60 HD2 HIS 60 -4.049 16.167 10.702 440 HE1 HIS 60 HE1 HIS 60 -4.501 12.712 8.306 441 HE2 HIS 60 HE2 HIS 60 -5.247 13.903 10.382 442 H GLU 61 H GLU 61 -2.680 20.033 8.481 443 HA GLU 61 HA GLU 61 -0.883 21.327 6.680 444 HB2 GLU 61 2HB GLU 61 -1.102 23.303 8.158 445 HB3 GLU 61 1HB GLU 61 -2.667 22.590 7.797 446 HG2 GLU 61 2HG GLU 61 -2.790 21.592 10.011 447 HG3 GLU 61 1HG GLU 61 -1.149 22.119 10.378 448 H THR 62 H THR 62 -0.371 19.511 9.572 449 HA THR 62 HA THR 62 2.512 20.163 9.517 450 HB THR 62 HB THR 62 2.525 19.617 11.992 451 HG1 THR 62 HG1 THR 62 0.668 18.559 12.409 452 HG21 THR 62 3HG2 THR 62 2.515 21.993 11.278 453 HG22 THR 62 1HG2 THR 62 1.603 21.770 12.773 454 HG23 THR 62 2HG2 THR 62 0.750 21.976 11.243 455 HA PRO 63 HA PRO 63 2.392 15.574 8.810 456 HB2 PRO 63 2HB PRO 63 4.480 15.440 7.091 457 HB3 PRO 63 1HB PRO 63 2.886 16.009 6.550 458 HG2 PRO 63 2HG PRO 63 5.312 17.621 7.279 459 HG3 PRO 63 1HG PRO 63 4.201 17.824 5.906 460 HD2 PRO 63 2HD PRO 63 4.042 19.311 8.224 461 HD3 PRO 63 1HD PRO 63 2.653 18.990 7.162 462 H GLU 64 H GLU 64 3.643 13.983 9.908 463 HA GLU 64 HA GLU 64 6.189 14.857 11.156 464 HB2 GLU 64 2HB GLU 64 5.525 13.743 13.271 465 HB3 GLU 64 1HB GLU 64 4.444 15.061 12.840 466 HG2 GLU 64 2HG GLU 64 2.753 13.465 12.059 467 HG3 GLU 64 1HG GLU 64 3.841 12.120 12.415 468 H SER 65 H SER 65 7.394 13.008 12.175 469 HA SER 65 HA SER 65 8.127 11.257 10.042 470 HB2 SER 65 2HB SER 65 9.926 10.537 11.690 471 HB3 SER 65 1HB SER 65 9.870 12.266 11.360 472 HG SER 65 HG SER 65 8.409 11.278 13.544 473 H VAL 66 H VAL 66 7.251 9.337 9.637 474 HA VAL 66 HA VAL 66 6.379 7.493 11.777 475 HB VAL 66 HB VAL 66 5.133 7.707 8.974 476 HG11 VAL 66 1HG1 VAL 66 3.389 6.195 9.877 477 HG12 VAL 66 2HG1 VAL 66 4.263 6.100 11.407 478 HG13 VAL 66 3HG1 VAL 66 4.989 5.452 9.936 479 HG21 VAL 66 3HG2 VAL 66 3.993 8.730 11.607 480 HG22 VAL 66 1HG2 VAL 66 3.139 8.701 10.059 481 HG23 VAL 66 2HG2 VAL 66 4.564 9.722 10.263 482 H ASP 67 H ASP 67 7.666 5.690 11.745 483 HA ASP 67 HA ASP 67 9.681 5.413 9.639 484 HB2 ASP 67 2HB ASP 67 10.272 5.357 12.064 485 HB3 ASP 67 1HB ASP 67 9.300 3.906 12.259 486 H LEU 68 H LEU 68 9.142 4.207 7.877 487 HA LEU 68 HA LEU 68 7.545 1.719 8.199 488 HB2 LEU 68 2HB LEU 68 7.515 3.529 5.747 489 HB3 LEU 68 1HB LEU 68 6.495 2.130 6.040 490 HG LEU 68 HG LEU 68 6.353 4.780 7.540 491 HD11 LEU 68 1HD1 LEU 68 4.424 3.586 5.537 492 HD12 LEU 68 2HD1 LEU 68 5.529 4.929 5.235 493 HD13 LEU 68 3HD1 LEU 68 4.226 5.111 6.406 494 HD21 LEU 68 3HD2 LEU 68 4.299 3.898 8.586 495 HD22 LEU 68 1HD2 LEU 68 5.710 2.936 9.028 496 HD23 LEU 68 2HD2 LEU 68 4.575 2.332 7.818 497 H GLU 69 H GLU 69 8.259 -0.085 7.018 498 HA GLU 69 HA GLU 69 11.016 -0.225 6.350 499 HB2 GLU 69 2HB GLU 69 10.583 -2.566 5.725 500 HB3 GLU 69 1HB GLU 69 9.795 -2.170 7.247 501 HG2 GLU 69 2HG GLU 69 7.629 -1.906 5.979 502 HG3 GLU 69 1HG GLU 69 8.472 -2.473 4.539 503 H THR 70 H THR 70 12.047 -0.416 4.395 504 HA THR 70 HA THR 70 10.544 0.282 1.929 505 HB THR 70 HB THR 70 11.799 2.220 2.810 506 HG1 THR 70 HG1 THR 70 13.078 2.617 0.895 507 HG21 THR 70 3HG2 THR 70 14.297 0.492 2.551 508 HG22 THR 70 1HG2 THR 70 13.582 1.070 4.059 509 HG23 THR 70 2HG2 THR 70 14.278 2.219 2.915 510 H SER 71 H SER 71 12.420 -0.010 0.029 511 HA SER 71 HA SER 71 13.006 -2.889 0.043 512 HB2 SER 71 2HB SER 71 13.089 -0.934 -2.286 513 HB3 SER 71 1HB SER 71 13.054 -2.696 -2.370 514 HG SER 71 HG SER 71 10.963 -1.790 -0.929 515 H ASP 72 H ASP 72 14.720 -0.803 1.404 516 HA ASP 72 HA ASP 72 17.221 -0.828 -0.194 517 HB2 ASP 72 2HB ASP 72 16.283 1.016 2.047 518 HB3 ASP 72 1HB ASP 72 17.950 0.993 1.479 519 H ASP 73 H ASP 73 16.005 -3.013 1.515 520 HA ASP 73 HA ASP 73 16.585 -4.618 2.993 521 HB2 ASP 73 2HB ASP 73 19.447 -3.594 2.781 522 HB3 ASP 73 1HB ASP 73 18.928 -5.213 3.241 523 H ARG 74 H ARG 74 15.712 -2.064 3.950 524 HA ARG 74 HA ARG 74 16.718 -1.803 6.639 525 HB2 ARG 74 2HB ARG 74 18.401 -0.663 4.960 526 HB3 ARG 74 1HB ARG 74 17.170 0.578 4.792 527 HG2 ARG 74 2HG ARG 74 17.339 0.981 7.268 528 HG3 ARG 74 1HG ARG 74 18.648 -0.190 7.330 529 HD2 ARG 74 2HD ARG 74 20.085 1.204 6.046 530 HD3 ARG 74 1HD ARG 74 18.758 2.255 5.540 531 HE ARG 74 HE ARG 74 19.772 2.099 8.328 532 HH11 ARG 74 1HH1 ARG 74 18.601 4.023 5.615 533 HH12 ARG 74 2HH1 ARG 74 18.696 5.526 6.485 534 HH21 ARG 74 1HH2 ARG 74 19.828 4.052 9.488 535 HH22 ARG 74 2HH2 ARG 74 19.396 5.537 8.689 536 H THR 75 H THR 75 15.762 0.910 6.967 537 HA THR 75 HA THR 75 12.909 0.817 6.458 538 HB THR 75 HB THR 75 13.979 0.939 9.332 539 HG1 THR 75 HG1 THR 75 12.475 -1.267 8.576 540 HG21 THR 75 3HG2 THR 75 11.641 0.608 9.996 541 HG22 THR 75 1HG2 THR 75 11.145 0.520 8.304 542 HG23 THR 75 2HG2 THR 75 11.767 2.035 8.968 543 H VAL 76 H VAL 76 12.016 3.010 6.866 544 HA VAL 76 HA VAL 76 13.974 5.172 7.133 545 HB VAL 76 HB VAL 76 13.384 6.266 4.945 546 HG11 VAL 76 1HG1 VAL 76 15.533 5.116 5.196 547 HG12 VAL 76 2HG1 VAL 76 14.929 4.979 3.544 548 HG13 VAL 76 3HG1 VAL 76 14.806 3.603 4.646 549 HG21 VAL 76 3HG2 VAL 76 11.310 5.068 4.448 550 HG22 VAL 76 1HG2 VAL 76 12.208 3.567 4.208 551 HG23 VAL 76 2HG2 VAL 76 12.447 4.930 3.108 552 H ARG 77 H ARG 77 13.059 7.315 6.893 553 HA ARG 77 HA ARG 77 10.632 7.603 8.428 554 HB2 ARG 77 2HB ARG 77 12.768 8.908 8.768 555 HB3 ARG 77 1HB ARG 77 12.537 9.665 7.212 556 HG2 ARG 77 2HG ARG 77 10.597 10.018 9.516 557 HG3 ARG 77 1HG ARG 77 12.002 11.049 9.266 558 HD2 ARG 77 2HD ARG 77 9.482 10.852 7.631 559 HD3 ARG 77 1HD ARG 77 10.277 12.284 8.284 560 HE ARG 77 HE ARG 77 10.833 10.926 5.785 561 HH11 ARG 77 1HH1 ARG 77 12.062 13.314 8.071 562 HH12 ARG 77 2HH1 ARG 77 13.141 14.027 6.915 563 HH21 ARG 77 1HH2 ARG 77 12.305 11.795 4.335 564 HH22 ARG 77 2HH2 ARG 77 13.279 13.158 4.787 565 H TYR 78 H TYR 78 8.681 7.918 7.585 566 HA TYR 78 HA TYR 78 8.298 9.258 4.964 567 HB2 TYR 78 2HB TYR 78 6.670 7.135 6.418 568 HB3 TYR 78 1HB TYR 78 5.923 8.178 5.218 569 HD1 TYR 78 HD2 TYR 78 8.984 5.969 5.505 570 HD2 TYR 78 HD1 TYR 78 5.750 7.310 3.061 571 HE1 TYR 78 HE2 TYR 78 9.669 4.409 3.736 572 HE2 TYR 78 HE1 TYR 78 6.429 5.750 1.292 573 HH TYR 78 HH TYR 78 8.615 3.230 1.794 574 H LEU 79 H LEU 79 6.979 11.071 4.961 575 HA LEU 79 HA LEU 79 6.173 12.194 7.555 576 HB2 LEU 79 2HB LEU 79 6.333 13.425 4.783 577 HB3 LEU 79 1HB LEU 79 5.610 14.257 6.152 578 HG LEU 79 HG LEU 79 8.525 13.410 5.899 579 HD11 LEU 79 1HD1 LEU 79 7.279 16.178 6.014 580 HD12 LEU 79 2HD1 LEU 79 7.942 15.400 4.576 581 HD13 LEU 79 3HD1 LEU 79 9.006 15.814 5.917 582 HD21 LEU 79 3HD2 LEU 79 8.892 14.511 8.071 583 HD22 LEU 79 1HD2 LEU 79 7.795 13.140 8.228 584 HD23 LEU 79 2HD2 LEU 79 7.156 14.787 8.240 585 H HIS 80 H HIS 80 4.131 12.162 8.253 586 HA HIS 80 HA HIS 80 2.056 10.881 6.722 587 HB2 HIS 80 2HB HIS 80 2.244 10.508 9.147 588 HB3 HIS 80 1HB HIS 80 2.021 12.227 9.460 589 HD2 HIS 80 HD2 HIS 80 -0.269 9.942 7.186 590 HE1 HIS 80 HE1 HIS 80 -2.543 11.588 10.342 591 HE2 HIS 80 HE2 HIS 80 -2.561 10.004 8.369 592 H VAL 81 H VAL 81 1.463 12.111 5.010 593 HA VAL 81 HA VAL 81 0.970 14.981 5.294 594 HB VAL 81 HB VAL 81 0.756 15.034 2.844 595 HG11 VAL 81 1HG1 VAL 81 3.085 14.407 2.302 596 HG12 VAL 81 2HG1 VAL 81 3.194 13.499 3.812 597 HG13 VAL 81 3HG1 VAL 81 2.974 15.251 3.847 598 HG21 VAL 81 3HG2 VAL 81 1.144 13.022 1.463 599 HG22 VAL 81 1HG2 VAL 81 -0.296 12.825 2.464 600 HG23 VAL 81 2HG2 VAL 81 1.207 12.019 2.917 601 H ALA 82 H ALA 82 -0.884 12.009 4.858 602 HA ALA 82 HA ALA 82 -3.381 13.533 5.126 603 HB1 ALA 82 3HB ALA 82 -2.867 11.792 2.688 604 HB2 ALA 82 1HB ALA 82 -2.982 13.554 2.695 605 HB3 ALA 82 2HB ALA 82 -4.398 12.576 3.093 606 H THR 83 H THR 83 -5.245 12.206 5.484 607 HA THR 83 HA THR 83 -4.817 9.321 5.923 608 HB THR 83 HB THR 83 -6.493 11.134 7.749 609 HG1 THR 83 HG1 THR 83 -4.534 9.835 9.032 610 HG21 THR 83 3HG2 THR 83 -6.734 9.115 9.150 611 HG22 THR 83 1HG2 THR 83 -5.836 8.165 7.964 612 HG23 THR 83 2HG2 THR 83 -7.414 8.840 7.547 613 H LEU 84 H LEU 84 -6.394 8.125 4.986 614 HA LEU 84 HA LEU 84 -8.387 9.530 3.328 615 HB2 LEU 84 2HB LEU 84 -7.380 6.667 3.001 616 HB3 LEU 84 1HB LEU 84 -8.263 7.636 1.831 617 HG LEU 84 HG LEU 84 -5.373 8.037 2.702 618 HD11 LEU 84 1HD1 LEU 84 -5.644 6.156 1.183 619 HD12 LEU 84 2HD1 LEU 84 -4.806 7.477 0.370 620 HD13 LEU 84 3HD1 LEU 84 -6.513 7.172 0.031 621 HD21 LEU 84 3HD2 LEU 84 -6.366 10.232 2.317 622 HD22 LEU 84 1HD2 LEU 84 -6.972 9.714 0.741 623 HD23 LEU 84 2HD2 LEU 84 -5.234 9.844 1.025 624 H SER 85 H SER 85 -10.251 9.627 4.516 625 HA SER 85 HA SER 85 -10.977 7.449 6.344 626 HB2 SER 85 2HB SER 85 -10.914 9.780 7.188 627 HB3 SER 85 1HB SER 85 -12.177 10.229 6.040 628 HG SER 85 HG SER 85 -12.491 9.262 8.463 629 H PHE 86 H PHE 86 -12.832 6.269 6.180 630 HA PHE 86 HA PHE 86 -14.846 6.550 4.161 631 HB2 PHE 86 2HB PHE 86 -14.229 4.532 2.823 632 HB3 PHE 86 1HB PHE 86 -13.012 5.786 2.680 633 HD1 PHE 86 HD1 PHE 86 -10.810 5.524 3.881 634 HD2 PHE 86 HD2 PHE 86 -13.664 2.357 3.722 635 HE1 PHE 86 HE1 PHE 86 -9.067 3.915 4.522 636 HE2 PHE 86 HE2 PHE 86 -11.922 0.756 4.368 637 HZ PHE 86 HZ PHE 86 -9.623 1.531 4.767 638 H ASP 87 H ASP 87 -15.855 4.081 3.989 639 HA ASP 87 HA ASP 87 -15.698 2.785 6.657 640 HB2 ASP 87 2HB ASP 87 -17.991 2.412 6.818 641 HB3 ASP 87 1HB ASP 87 -17.989 3.985 6.036 642 H LEU 88 H LEU 88 -15.811 0.538 6.652 643 HA LEU 88 HA LEU 88 -15.919 -0.989 4.177 644 HB2 LEU 88 2HB LEU 88 -13.489 -0.369 4.362 645 HB3 LEU 88 1HB LEU 88 -13.442 -1.086 5.964 646 HG LEU 88 HG LEU 88 -14.009 -3.325 4.900 647 HD11 LEU 88 1HD1 LEU 88 -15.035 -2.539 2.824 648 HD12 LEU 88 2HD1 LEU 88 -13.681 -3.611 2.477 649 HD13 LEU 88 3HD1 LEU 88 -13.492 -1.866 2.288 650 HD21 LEU 88 3HD2 LEU 88 -11.734 -3.759 4.071 651 HD22 LEU 88 1HD2 LEU 88 -11.705 -2.779 5.537 652 HD23 LEU 88 2HD2 LEU 88 -11.430 -2.023 3.967 653 H ASP 89 H ASP 89 -17.057 -2.801 4.642 654 HA ASP 89 HA ASP 89 -18.163 -4.462 5.748 655 HB2 ASP 89 2HB ASP 89 -15.796 -4.964 6.606 656 HB3 ASP 89 1HB ASP 89 -16.210 -4.068 8.063 657 H GLY 90 H GLY 90 -18.770 -1.547 6.110 658 HA2 GLY 90 2HA GLY 90 -20.319 -0.240 7.166 659 HA3 GLY 90 1HA GLY 90 -20.855 -1.665 8.035 660 H GLU 91 H GLU 91 -17.509 -0.764 8.378 661 HA GLU 91 HA GLU 91 -18.044 0.738 10.869 662 HB2 GLU 91 2HB GLU 91 -15.950 -0.213 11.860 663 HB3 GLU 91 1HB GLU 91 -17.175 -1.437 11.565 664 HG2 GLU 91 2HG GLU 91 -15.962 -2.149 9.533 665 HG3 GLU 91 1HG GLU 91 -14.736 -0.928 9.856 666 H SER 92 H SER 92 -17.014 2.668 11.026 667 HA SER 92 HA SER 92 -15.990 3.858 8.651 668 HB2 SER 92 2HB SER 92 -17.337 5.084 10.350 669 HB3 SER 92 1HB SER 92 -16.001 4.972 11.496 670 HG SER 92 HG SER 92 -14.754 6.240 10.062 671 H ARG 93 H ARG 93 -14.086 3.252 7.902 672 HA ARG 93 HA ARG 93 -11.765 2.814 9.698 673 HB2 ARG 93 2HB ARG 93 -12.315 1.770 6.884 674 HB3 ARG 93 1HB ARG 93 -10.838 1.471 7.786 675 HG2 ARG 93 2HG ARG 93 -13.607 0.477 8.503 676 HG3 ARG 93 1HG ARG 93 -12.298 -0.477 7.808 677 HD2 ARG 93 2HD ARG 93 -12.177 -1.046 10.063 678 HD3 ARG 93 1HD ARG 93 -10.968 0.238 9.954 679 HE ARG 93 HE ARG 93 -13.517 1.280 10.634 680 HH11 ARG 93 1HH1 ARG 93 -10.896 -0.561 12.081 681 HH12 ARG 93 2HH1 ARG 93 -11.247 -0.018 13.692 682 HH21 ARG 93 1HH2 ARG 93 -13.957 2.013 12.749 683 HH22 ARG 93 2HH2 ARG 93 -12.979 1.441 14.070 684 H ASP 94 H ASP 94 -9.776 3.792 9.207 685 HA ASP 94 HA ASP 94 -9.607 5.509 6.816 686 HB2 ASP 94 2HB ASP 94 -8.616 7.357 8.111 687 HB3 ASP 94 1HB ASP 94 -10.254 7.013 8.636 688 H LEU 95 H LEU 95 -7.739 5.441 5.771 689 HA LEU 95 HA LEU 95 -5.445 3.983 6.979 690 HB2 LEU 95 2HB LEU 95 -6.201 4.101 4.026 691 HB3 LEU 95 1HB LEU 95 -4.857 3.208 4.728 692 HG LEU 95 HG LEU 95 -7.812 2.623 5.094 693 HD11 LEU 95 1HD1 LEU 95 -7.285 0.524 3.938 694 HD12 LEU 95 2HD1 LEU 95 -5.618 1.062 3.722 695 HD13 LEU 95 3HD1 LEU 95 -6.939 1.935 2.939 696 HD21 LEU 95 3HD2 LEU 95 -7.080 0.625 6.393 697 HD22 LEU 95 1HD2 LEU 95 -6.757 2.151 7.212 698 HD23 LEU 95 2HD2 LEU 95 -5.443 1.278 6.422 699 H HIS 96 H HIS 96 -3.489 5.012 6.922 700 HA HIS 96 HA HIS 96 -3.681 7.871 6.315 701 HB2 HIS 96 2HB HIS 96 -1.628 6.257 7.903 702 HB3 HIS 96 1HB HIS 96 -1.636 8.013 7.746 703 HD2 HIS 96 HD2 HIS 96 -4.498 5.490 8.931 704 HE1 HIS 96 HE1 HIS 96 -4.090 8.648 11.704 705 HE2 HIS 96 HE2 HIS 96 -5.532 6.711 10.957 706 H ALA 97 H ALA 97 -2.527 8.830 4.750 707 HA ALA 97 HA ALA 97 -0.929 7.185 2.898 708 HB1 ALA 97 3HB ALA 97 -2.275 9.890 2.497 709 HB2 ALA 97 1HB ALA 97 -2.883 8.330 1.935 710 HB3 ALA 97 2HB ALA 97 -1.391 8.985 1.261 711 H PHE 98 H PHE 98 1.225 7.511 2.795 712 HA PHE 98 HA PHE 98 2.416 9.927 4.039 713 HB2 PHE 98 2HB PHE 98 3.746 7.187 4.068 714 HB3 PHE 98 1HB PHE 98 4.137 8.604 5.026 715 HD1 PHE 98 HD1 PHE 98 2.861 9.117 7.075 716 HD2 PHE 98 HD2 PHE 98 1.989 5.639 4.757 717 HE1 PHE 98 HE1 PHE 98 1.631 8.150 8.972 718 HE2 PHE 98 HE2 PHE 98 0.760 4.682 6.661 719 HZ PHE 98 HZ PHE 98 0.583 5.932 8.767 720 H ARG 99 H ARG 99 4.696 10.191 3.312 721 HA ARG 99 HA ARG 99 5.753 8.809 1.036 722 HB2 ARG 99 2HB ARG 99 5.960 10.735 -0.474 723 HB3 ARG 99 1HB ARG 99 4.272 10.380 -0.156 724 HG2 ARG 99 2HG ARG 99 4.903 12.310 1.775 725 HG3 ARG 99 1HG ARG 99 5.796 12.844 0.353 726 HD2 ARG 99 2HD ARG 99 2.827 12.250 0.480 727 HD3 ARG 99 1HD ARG 99 3.557 13.849 0.471 728 HE ARG 99 HE ARG 99 4.264 12.240 -1.823 729 HH11 ARG 99 1HH1 ARG 99 1.852 14.486 -0.540 730 HH12 ARG 99 2HH1 ARG 99 1.279 14.940 -2.114 731 HH21 ARG 99 1HH2 ARG 99 3.439 12.773 -3.843 732 HH22 ARG 99 2HH2 ARG 99 2.174 13.971 -3.989 733 H GLN 100 H GLN 100 8.038 9.271 0.830 734 HA GLN 100 HA GLN 100 9.211 9.120 3.294 735 HB2 GLN 100 2HB GLN 100 10.622 9.944 0.736 736 HB3 GLN 100 1HB GLN 100 11.392 9.265 2.169 737 HG2 GLN 100 2HG GLN 100 10.145 7.160 1.847 738 HG3 GLN 100 1HG GLN 100 9.367 7.842 0.419 739 HE21 GLN 100 1HE2 GLN 100 12.788 8.149 1.379 740 HE22 GLN 100 2HE2 GLN 100 13.417 7.317 0.003 741 H ALA 101 H ALA 101 10.169 11.906 1.196 742 HA ALA 101 HA ALA 101 10.021 13.631 3.612 743 HB1 ALA 101 3HB ALA 101 11.869 13.950 1.215 744 HB2 ALA 101 1HB ALA 101 12.328 13.347 2.809 745 HB3 ALA 101 2HB ALA 101 11.790 15.017 2.620 746 H ALA 102 H ALA 102 10.228 14.376 0.103 747 HA ALA 102 HA ALA 102 7.838 16.110 0.362 748 HB1 ALA 102 3HB ALA 102 10.514 16.876 -0.867 749 HB2 ALA 102 1HB ALA 102 9.927 17.404 0.712 750 HB3 ALA 102 2HB ALA 102 9.085 17.908 -0.754 751 H ASP 103 H ASP 103 7.665 13.602 -0.858 752 HA ASP 103 HA ASP 103 8.379 13.352 -3.547 753 HB2 ASP 103 2HB ASP 103 7.687 11.388 -2.368 754 HB3 ASP 103 1HB ASP 103 6.145 12.103 -1.920 755 H GLU 104 H GLU 104 7.594 14.091 -5.407 756 HA GLU 104 HA GLU 104 5.001 15.527 -5.525 757 HB2 GLU 104 2HB GLU 104 7.534 15.974 -7.170 758 HB3 GLU 104 1HB GLU 104 6.033 16.880 -7.349 759 HG2 GLU 104 2HG GLU 104 6.303 17.805 -5.089 760 HG3 GLU 104 1HG GLU 104 7.763 16.849 -4.856 761 H SER 105 H SER 105 6.366 12.629 -6.351 762 HA SER 105 HA SER 105 5.442 12.420 -9.102 763 HB2 SER 105 2HB SER 105 6.695 10.350 -7.253 764 HB3 SER 105 1HB SER 105 6.399 10.122 -8.980 765 HG SER 105 HG SER 105 8.315 10.965 -9.198 766 H ARG 106 H ARG 106 3.549 12.685 -6.656 767 HA ARG 106 HA ARG 106 1.448 12.081 -6.051 768 HB2 ARG 106 2HB ARG 106 1.372 10.275 -8.508 769 HB3 ARG 106 1HB ARG 106 -0.011 10.863 -7.598 770 HG2 ARG 106 2HG ARG 106 1.846 12.549 -9.304 771 HG3 ARG 106 1HG ARG 106 0.222 12.022 -9.740 772 HD2 ARG 106 2HD ARG 106 -0.677 13.351 -7.814 773 HD3 ARG 106 1HD ARG 106 0.961 13.936 -7.500 774 HE ARG 106 HE ARG 106 -0.278 14.375 -10.136 775 HH11 ARG 106 1HH1 ARG 106 1.007 15.791 -7.180 776 HH12 ARG 106 2HH1 ARG 106 1.017 17.404 -7.819 777 HH21 ARG 106 1HH2 ARG 106 -0.283 16.498 -10.948 778 HH22 ARG 106 2HH2 ARG 106 0.282 17.808 -9.957 779 H THR 107 H THR 107 3.979 10.254 -5.575 780 HA THR 107 HA THR 107 2.889 7.575 -5.497 781 HB THR 107 HB THR 107 5.630 8.581 -4.590 782 HG1 THR 107 HG1 THR 107 4.553 8.018 -7.101 783 HG21 THR 107 3HG2 THR 107 4.708 5.779 -5.344 784 HG22 THR 107 1HG2 THR 107 5.069 6.330 -3.703 785 HG23 THR 107 2HG2 THR 107 6.354 6.240 -4.908 786 H LEU 108 H LEU 108 1.293 7.695 -3.950 787 HA LEU 108 HA LEU 108 1.994 8.403 -1.172 788 HB2 LEU 108 2HB LEU 108 -0.734 7.729 -2.332 789 HB3 LEU 108 1HB LEU 108 -0.401 8.418 -0.749 790 HG LEU 108 HG LEU 108 -0.086 9.775 -3.448 791 HD11 LEU 108 1HD1 LEU 108 -1.915 10.395 -1.120 792 HD12 LEU 108 2HD1 LEU 108 -2.382 9.656 -2.653 793 HD13 LEU 108 3HD1 LEU 108 -1.793 11.316 -2.623 794 HD21 LEU 108 3HD2 LEU 108 0.656 10.853 -0.705 795 HD22 LEU 108 1HD2 LEU 108 0.607 11.798 -2.198 796 HD23 LEU 108 2HD2 LEU 108 1.767 10.485 -2.026 797 H PHE 109 H PHE 109 2.231 6.893 0.313 798 HA PHE 109 HA PHE 109 1.882 4.050 -0.423 799 HB2 PHE 109 2HB PHE 109 4.213 4.856 0.044 800 HB3 PHE 109 1HB PHE 109 3.707 5.359 1.652 801 HD1 PHE 109 HD1 PHE 109 3.428 2.234 -0.456 802 HD2 PHE 109 HD2 PHE 109 4.431 3.921 3.348 803 HE1 PHE 109 HE1 PHE 109 4.033 -0.000 0.387 804 HE2 PHE 109 HE2 PHE 109 5.034 1.684 4.177 805 HZ PHE 109 HZ PHE 109 4.836 -0.274 2.698 806 H VAL 110 H VAL 110 0.051 3.285 0.433 807 HA VAL 110 HA VAL 110 -0.803 4.117 3.146 808 HB VAL 110 HB VAL 110 -3.143 3.312 2.449 809 HG11 VAL 110 1HG1 VAL 110 -3.726 5.415 1.287 810 HG12 VAL 110 2HG1 VAL 110 -2.014 5.730 0.994 811 HG13 VAL 110 3HG1 VAL 110 -2.638 5.698 2.646 812 HG21 VAL 110 3HG2 VAL 110 -3.703 3.285 0.042 813 HG22 VAL 110 1HG2 VAL 110 -2.534 2.019 0.427 814 HG23 VAL 110 2HG2 VAL 110 -1.999 3.499 -0.370 815 HA PRO 111 HA PRO 111 0.115 -0.356 3.817 816 HB2 PRO 111 2HB PRO 111 1.251 -0.038 6.286 817 HB3 PRO 111 1HB PRO 111 2.189 0.149 4.792 818 HG2 PRO 111 2HG PRO 111 1.061 2.263 6.581 819 HG3 PRO 111 1HG PRO 111 2.625 2.213 5.739 820 HD2 PRO 111 2HD PRO 111 0.442 3.632 4.821 821 HD3 PRO 111 1HD PRO 111 1.744 3.024 3.774 822 H PHE 112 H PHE 112 -1.687 -1.408 4.508 823 HA PHE 112 HA PHE 112 -3.229 -0.288 6.756 824 HB2 PHE 112 2HB PHE 112 -5.283 -1.151 5.816 825 HB3 PHE 112 1HB PHE 112 -4.509 -0.089 4.663 826 HD1 PHE 112 HD1 PHE 112 -3.407 -1.069 2.617 827 HD2 PHE 112 HD2 PHE 112 -5.798 -3.425 5.269 828 HE1 PHE 112 HE1 PHE 112 -3.702 -2.767 0.861 829 HE2 PHE 112 HE2 PHE 112 -6.076 -5.115 3.511 830 HZ PHE 112 HZ PHE 112 -5.037 -4.784 1.308 831 H ARG 113 H ARG 113 -3.558 -1.555 8.431 832 HA ARG 113 HA ARG 113 -2.685 -4.382 8.324 833 HB2 ARG 113 2HB ARG 113 -1.557 -3.001 10.024 834 HB3 ARG 113 1HB ARG 113 -3.111 -2.476 10.676 835 HG2 ARG 113 2HG ARG 113 -3.609 -4.874 11.255 836 HG3 ARG 113 1HG ARG 113 -1.987 -5.305 10.719 837 HD2 ARG 113 2HD ARG 113 -0.987 -4.037 12.500 838 HD3 ARG 113 1HD ARG 113 -2.541 -3.320 12.946 839 HE ARG 113 HE ARG 113 -1.554 -5.959 13.618 840 HH11 ARG 113 1HH1 ARG 113 -4.453 -3.964 13.389 841 HH12 ARG 113 2HH1 ARG 113 -5.358 -4.956 14.483 842 HH21 ARG 113 1HH2 ARG 113 -2.775 -7.257 15.004 843 HH22 ARG 113 2HH2 ARG 113 -4.403 -6.813 15.392 844 H ASP 114 H ASP 114 -4.345 -5.818 8.106 845 HA ASP 114 HA ASP 114 -7.013 -5.138 9.197 846 HB2 ASP 114 2HB ASP 114 -8.052 -6.107 7.270 847 HB3 ASP 114 1HB ASP 114 -6.806 -5.037 6.634 848 H LYS 115 H LYS 115 -8.102 -7.758 8.631 849 HA LYS 115 HA LYS 115 -6.917 -9.198 10.865 850 HB2 LYS 115 2HB LYS 115 -9.410 -9.812 9.246 851 HB3 LYS 115 1HB LYS 115 -8.904 -10.674 10.697 852 HG2 LYS 115 2HG LYS 115 -9.642 -7.736 10.559 853 HG3 LYS 115 1HG LYS 115 -10.679 -9.029 11.152 854 HD2 LYS 115 2HD LYS 115 -8.015 -8.258 12.401 855 HD3 LYS 115 1HD LYS 115 -9.593 -7.690 12.955 856 HE2 LYS 115 2HE LYS 115 -10.274 -10.009 13.421 857 HE3 LYS 115 1HE LYS 115 -8.707 -10.581 12.871 858 HZ1 LYS 115 3HZ LYS 115 -8.866 -10.406 15.306 859 HZ2 LYS 115 1HZ LYS 115 -9.117 -8.740 15.154 860 HZ3 LYS 115 2HZ LYS 115 -7.652 -9.422 14.667 861 H THR 116 H THR 116 -6.588 -9.424 7.398 862 HA THR 116 HA THR 116 -5.861 -12.207 7.380 863 HB THR 116 HB THR 116 -4.846 -11.866 5.173 864 HG1 THR 116 HG1 THR 116 -5.429 -9.118 5.197 865 HG21 THR 116 3HG2 THR 116 -7.306 -12.058 5.194 866 HG22 THR 116 1HG2 THR 116 -6.762 -11.005 3.884 867 HG23 THR 116 2HG2 THR 116 -7.448 -10.306 5.351 868 H THR 117 H THR 117 -4.270 -9.218 8.122 869 HA THR 117 HA THR 117 -1.566 -9.804 7.832 870 HB THR 117 HB THR 117 -2.989 -7.937 9.785 871 HG1 THR 117 HG1 THR 117 -3.185 -7.608 7.419 872 HG21 THR 117 3HG2 THR 117 -0.698 -8.345 10.619 873 HG22 THR 117 1HG2 THR 117 -0.828 -6.708 9.968 874 HG23 THR 117 2HG2 THR 117 -0.041 -7.973 9.025 875 H GLY 118 H GLY 118 -0.407 -11.334 8.765 876 HA2 GLY 118 2HA GLY 118 0.596 -12.716 10.277 877 HA3 GLY 118 1HA GLY 118 -0.087 -11.711 11.536 878 H GLN 119 H GLN 119 -2.503 -13.094 9.521 879 HA GLN 119 HA GLN 119 -2.996 -15.263 11.487 880 HB2 GLN 119 2HB GLN 119 -5.178 -13.584 10.170 881 HB3 GLN 119 1HB GLN 119 -5.384 -14.789 11.433 882 HG2 GLN 119 2HG GLN 119 -3.998 -12.105 11.735 883 HG3 GLN 119 1HG GLN 119 -5.610 -12.503 12.318 884 HE21 GLN 119 1HE2 GLN 119 -3.202 -11.572 13.755 885 HE22 GLN 119 2HE2 GLN 119 -2.935 -12.737 15.007 886 H GLN 120 H GLN 120 -4.767 -14.341 8.508 887 HA GLN 120 HA GLN 120 -4.215 -17.003 7.337 888 HB2 GLN 120 2HB GLN 120 -6.131 -16.535 5.822 889 HB3 GLN 120 1HB GLN 120 -6.597 -16.443 7.516 890 HG2 GLN 120 2HG GLN 120 -6.553 -14.001 7.422 891 HG3 GLN 120 1HG GLN 120 -6.012 -14.058 5.749 892 HE21 GLN 120 1HE2 GLN 120 -8.731 -14.665 7.894 893 HE22 GLN 120 2HE2 GLN 120 -9.943 -14.618 6.669 894 H SER 121 H SER 121 -2.463 -14.594 7.415 895 HA SER 121 HA SER 121 -1.242 -14.769 4.865 896 HB2 SER 121 2HB SER 121 -3.106 -13.169 4.259 897 HB3 SER 121 1HB SER 121 -2.511 -12.048 5.478 898 HG SER 121 HG SER 121 -1.424 -12.750 2.996 899 H TYR 122 H TYR 122 0.526 -12.817 4.834 900 HA TYR 122 HA TYR 122 2.225 -13.527 7.026 901 HB2 TYR 122 2HB TYR 122 2.672 -11.540 4.759 902 HB3 TYR 122 1HB TYR 122 3.918 -12.143 5.845 903 HD1 TYR 122 HD1 TYR 122 4.714 -14.495 5.667 904 HD2 TYR 122 HD2 TYR 122 1.839 -12.924 2.917 905 HE1 TYR 122 HE1 TYR 122 5.130 -16.377 4.149 906 HE2 TYR 122 HE2 TYR 122 2.262 -14.813 1.400 907 HH TYR 122 HH TYR 122 3.949 -16.462 0.942 908 H ASP 123 H ASP 123 3.392 -12.046 8.393 909 HA ASP 123 HA ASP 123 1.681 -10.013 9.593 910 HB2 ASP 123 2HB ASP 123 3.066 -10.132 11.500 911 HB3 ASP 123 1HB ASP 123 3.072 -11.783 10.897 912 H GLY 124 H GLY 124 3.216 -8.071 10.596 913 HA2 GLY 124 2HA GLY 124 4.583 -6.221 10.088 914 HA3 GLY 124 1HA GLY 124 4.791 -6.826 8.449 915 H GLY 125 H GLY 125 2.110 -7.250 7.770 916 HA2 GLY 125 2HA GLY 125 0.023 -5.787 8.021 917 HA3 GLY 125 1HA GLY 125 1.102 -4.483 7.526 918 H ARG 126 H ARG 126 -0.949 -4.728 6.002 919 HA ARG 126 HA ARG 126 0.025 -6.039 3.529 920 HB2 ARG 126 2HB ARG 126 -2.674 -4.719 4.117 921 HB3 ARG 126 1HB ARG 126 -2.243 -5.570 2.641 922 HG2 ARG 126 2HG ARG 126 -2.309 -6.935 5.344 923 HG3 ARG 126 1HG ARG 126 -3.729 -6.807 4.311 924 HD2 ARG 126 2HD ARG 126 -2.629 -8.992 4.096 925 HD3 ARG 126 1HD ARG 126 -2.614 -8.104 2.568 926 HE ARG 126 HE ARG 126 -0.278 -8.289 4.385 927 HH11 ARG 126 1HH1 ARG 126 -1.590 -8.363 1.109 928 HH12 ARG 126 2HH1 ARG 126 -0.033 -8.528 0.371 929 HH21 ARG 126 1HH2 ARG 126 1.718 -8.333 3.395 930 HH22 ARG 126 2HH2 ARG 126 1.850 -8.505 1.676 931 H TYR 127 H TYR 127 0.857 -4.688 1.935 932 HA TYR 127 HA TYR 127 0.919 -1.779 2.572 933 HB2 TYR 127 2HB TYR 127 3.012 -3.453 1.088 934 HB3 TYR 127 1HB TYR 127 3.138 -1.737 1.489 935 HD1 TYR 127 HD1 TYR 127 3.224 -1.048 3.953 936 HD2 TYR 127 HD2 TYR 127 3.622 -5.118 2.726 937 HE1 TYR 127 HE1 TYR 127 4.160 -1.629 6.157 938 HE2 TYR 127 HE2 TYR 127 4.557 -5.673 4.915 939 HH TYR 127 HH TYR 127 5.757 -4.518 6.751 940 H MET 128 H MET 128 0.181 -0.421 1.053 941 HA MET 128 HA MET 128 -0.500 -1.461 -1.618 942 HB2 MET 128 2HB MET 128 -2.412 -1.480 0.322 943 HB3 MET 128 1HB MET 128 -2.575 0.197 -0.171 944 HG2 MET 128 2HG MET 128 -2.720 -2.084 -2.147 945 HG3 MET 128 1HG MET 128 -4.130 -1.487 -1.273 946 HE1 MET 128 3HE MET 128 -4.299 1.456 -1.224 947 HE2 MET 128 1HE MET 128 -5.523 0.414 -1.956 948 HE3 MET 128 2HE MET 128 -4.952 1.849 -2.817 949 H GLU 129 H GLU 129 -0.503 0.166 -3.222 950 HA GLU 129 HA GLU 129 0.377 2.857 -2.359 951 HB2 GLU 129 2HB GLU 129 2.342 1.490 -3.001 952 HB3 GLU 129 1HB GLU 129 1.625 1.176 -4.575 953 HG2 GLU 129 2HG GLU 129 1.776 3.571 -5.128 954 HG3 GLU 129 1HG GLU 129 2.475 3.910 -3.546 955 H LEU 130 H LEU 130 -0.626 4.472 -3.368 956 HA LEU 130 HA LEU 130 -1.977 4.030 -5.946 957 HB2 LEU 130 2HB LEU 130 -3.668 5.876 -4.855 958 HB3 LEU 130 1HB LEU 130 -3.967 4.147 -4.855 959 HG LEU 130 HG LEU 130 -2.991 4.078 -2.490 960 HD11 LEU 130 1HD1 LEU 130 -2.946 6.171 -1.201 961 HD12 LEU 130 2HD1 LEU 130 -3.235 7.092 -2.679 962 HD13 LEU 130 3HD1 LEU 130 -1.742 6.172 -2.489 963 HD21 LEU 130 3HD2 LEU 130 -5.399 3.987 -2.904 964 HD22 LEU 130 1HD2 LEU 130 -5.481 5.750 -2.927 965 HD23 LEU 130 2HD2 LEU 130 -5.057 4.901 -1.436 966 H GLU 131 H GLU 131 -1.913 5.681 -7.344 967 HA GLU 131 HA GLU 131 -0.490 8.162 -6.618 968 HB2 GLU 131 2HB GLU 131 -0.097 6.507 -9.147 969 HB3 GLU 131 1HB GLU 131 0.568 8.119 -8.889 970 HG2 GLU 131 2HG GLU 131 1.901 7.287 -6.998 971 HG3 GLU 131 1HG GLU 131 1.208 5.682 -7.202 972 HA PRO 132 HA PRO 132 -4.631 9.412 -8.213 973 HB2 PRO 132 2HB PRO 132 -4.518 11.956 -7.130 974 HB3 PRO 132 1HB PRO 132 -4.990 10.527 -6.192 975 HG2 PRO 132 2HG PRO 132 -2.300 11.864 -6.348 976 HG3 PRO 132 1HG PRO 132 -3.196 11.316 -4.911 977 HD2 PRO 132 2HD PRO 132 -1.217 9.831 -5.927 978 HD3 PRO 132 1HD PRO 132 -2.685 9.065 -5.281 979 H ASP 133 H ASP 133 -5.339 11.193 -9.597 980 HA ASP 133 HA ASP 133 -3.645 11.574 -11.834 981 HB2 ASP 133 2HB ASP 133 -6.095 11.412 -12.031 982 HB3 ASP 133 1HB ASP 133 -6.296 12.892 -11.100 983 H ARG 134 H ARG 134 -4.928 13.909 -9.451 984 HA ARG 134 HA ARG 134 -2.495 15.561 -9.760 985 HB2 ARG 134 2HB ARG 134 -3.895 17.476 -8.974 986 HB3 ARG 134 1HB ARG 134 -4.467 16.803 -10.490 987 HG2 ARG 134 2HG ARG 134 -6.502 17.029 -9.442 988 HG3 ARG 134 1HG ARG 134 -6.094 15.431 -8.851 989 HD2 ARG 134 2HD ARG 134 -5.337 16.350 -6.732 990 HD3 ARG 134 1HD ARG 134 -5.543 18.000 -7.322 991 HE ARG 134 HE ARG 134 -7.715 16.085 -6.696 992 HH11 ARG 134 1HH1 ARG 134 -6.680 19.412 -7.176 993 HH12 ARG 134 2HH1 ARG 134 -8.196 20.075 -6.653 994 HH21 ARG 134 1HH2 ARG 134 -9.692 16.962 -6.047 995 HH22 ARG 134 2HH2 ARG 134 -9.904 18.687 -6.015 996 H ASP 135 H ASP 135 -2.403 16.938 -7.420 997 HA ASP 135 HA ASP 135 -1.761 14.797 -5.537 998 HB2 ASP 135 2HB ASP 135 -0.203 16.776 -5.913 999 HB3 ASP 135 1HB ASP 135 -1.375 17.795 -5.087 1000 H LEU 136 H LEU 136 -2.812 14.440 -3.559 1001 HA LEU 136 HA LEU 136 -5.602 15.066 -3.598 1002 HB2 LEU 136 2HB LEU 136 -3.918 13.611 -1.535 1003 HB3 LEU 136 1HB LEU 136 -5.671 13.732 -1.474 1004 HG LEU 136 HG LEU 136 -4.060 12.310 -3.625 1005 HD11 LEU 136 1HD1 LEU 136 -5.017 10.266 -2.729 1006 HD12 LEU 136 2HD1 LEU 136 -5.906 11.180 -1.508 1007 HD13 LEU 136 3HD1 LEU 136 -4.143 11.127 -1.463 1008 HD21 LEU 136 3HD2 LEU 136 -6.052 13.296 -4.628 1009 HD22 LEU 136 1HD2 LEU 136 -7.070 12.606 -3.356 1010 HD23 LEU 136 2HD2 LEU 136 -6.239 11.549 -4.501 1011 H SER 137 H SER 137 -6.657 16.624 -2.599 1012 HA SER 137 HA SER 137 -5.290 18.462 -0.738 1013 HB2 SER 137 2HB SER 137 -7.903 18.808 -2.289 1014 HB3 SER 137 1HB SER 137 -7.084 20.058 -1.344 1015 HG SER 137 HG SER 137 -5.227 19.485 -2.853 1016 H ASP 138 H ASP 138 -6.751 19.358 1.030 1017 HA ASP 138 HA ASP 138 -7.961 17.231 2.545 1018 HB2 ASP 138 2HB ASP 138 -8.379 19.023 4.257 1019 HB3 ASP 138 1HB ASP 138 -6.703 18.898 3.752 1020 H GLY 139 H GLY 139 -9.861 16.468 1.921 1021 HA2 GLY 139 2HA GLY 139 -12.292 16.749 1.927 1022 HA3 GLY 139 1HA GLY 139 -12.076 18.309 1.139 1023 H ASP 140 H ASP 140 -9.811 16.618 -0.356 1024 HA ASP 140 HA ASP 140 -11.250 16.102 -2.776 1025 HB2 ASP 140 2HB ASP 140 -8.764 16.737 -2.463 1026 HB3 ASP 140 1HB ASP 140 -8.476 15.061 -2.037 1027 H GLU 141 H GLU 141 -11.212 13.811 -3.854 1028 HA GLU 141 HA GLU 141 -11.461 11.655 -1.811 1029 HB2 GLU 141 2HB GLU 141 -13.169 12.103 -4.303 1030 HB3 GLU 141 1HB GLU 141 -13.259 10.683 -3.264 1031 HG2 GLU 141 2HG GLU 141 -14.028 12.012 -1.392 1032 HG3 GLU 141 1HG GLU 141 -13.750 13.504 -2.280 1033 H ILE 142 H ILE 142 -11.051 9.456 -2.646 1034 HA ILE 142 HA ILE 142 -9.188 9.221 -4.880 1035 HB ILE 142 HB ILE 142 -7.716 10.085 -3.111 1036 HG12 ILE 142 2HG1 ILE 142 -6.061 8.190 -2.896 1037 HG13 ILE 142 1HG1 ILE 142 -7.270 7.093 -3.549 1038 HG21 ILE 142 1HG2 ILE 142 -9.041 9.514 -1.148 1039 HG22 ILE 142 2HG2 ILE 142 -7.390 8.925 -0.961 1040 HG23 ILE 142 3HG2 ILE 142 -8.686 7.799 -1.370 1041 HD11 ILE 142 3HD1 ILE 142 -5.617 7.750 -5.215 1042 HD12 ILE 142 1HD1 ILE 142 -6.053 9.445 -5.004 1043 HD13 ILE 142 2HD1 ILE 142 -7.226 8.307 -5.672 1044 H THR 143 H THR 143 -8.917 7.035 -5.526 1045 HA THR 143 HA THR 143 -10.908 5.135 -4.575 1046 HB THR 143 HB THR 143 -8.804 4.963 -6.780 1047 HG1 THR 143 HG1 THR 143 -10.508 6.477 -7.138 1048 HG21 THR 143 3HG2 THR 143 -11.108 3.077 -6.185 1049 HG22 THR 143 1HG2 THR 143 -9.391 2.704 -6.006 1050 HG23 THR 143 2HG2 THR 143 -10.064 3.013 -7.607 1051 H LEU 144 H LEU 144 -10.477 3.217 -3.415 1052 HA LEU 144 HA LEU 144 -7.721 2.724 -2.446 1053 HB2 LEU 144 2HB LEU 144 -10.304 3.028 -0.924 1054 HB3 LEU 144 1HB LEU 144 -9.198 1.798 -0.362 1055 HG LEU 144 HG LEU 144 -8.966 3.873 0.926 1056 HD11 LEU 144 1HD1 LEU 144 -7.000 2.434 0.719 1057 HD12 LEU 144 2HD1 LEU 144 -6.530 4.128 0.840 1058 HD13 LEU 144 3HD1 LEU 144 -6.483 3.312 -0.725 1059 HD21 LEU 144 3HD2 LEU 144 -8.088 5.939 -0.025 1060 HD22 LEU 144 1HD2 LEU 144 -9.606 5.504 -0.806 1061 HD23 LEU 144 2HD2 LEU 144 -8.075 5.229 -1.641 1062 H ASP 145 H ASP 145 -7.266 0.988 -3.778 1063 HA ASP 145 HA ASP 145 -9.043 -1.371 -3.788 1064 HB2 ASP 145 2HB ASP 145 -6.606 -0.577 -5.399 1065 HB3 ASP 145 1HB ASP 145 -7.158 -2.251 -5.379 1066 H PHE 146 H PHE 146 -8.810 -2.411 -1.874 1067 HA PHE 146 HA PHE 146 -6.290 -2.788 -0.534 1068 HB2 PHE 146 2HB PHE 146 -8.903 -4.242 0.011 1069 HB3 PHE 146 1HB PHE 146 -7.552 -4.004 1.121 1070 HD1 PHE 146 HD2 PHE 146 -6.926 -1.140 0.739 1071 HD2 PHE 146 HD1 PHE 146 -10.709 -3.110 1.032 1072 HE1 PHE 146 HE2 PHE 146 -7.955 0.932 1.520 1073 HE2 PHE 146 HE1 PHE 146 -11.726 -1.026 1.819 1074 HZ PHE 146 HZ PHE 146 -10.351 1.001 2.067 1075 H ASN 147 H ASN 147 -7.922 -4.414 -3.015 1076 HA ASN 147 HA ASN 147 -6.820 -7.007 -2.814 1077 HB2 ASN 147 2HB ASN 147 -7.239 -7.064 -5.361 1078 HB3 ASN 147 1HB ASN 147 -8.626 -6.814 -4.312 1079 HD21 ASN 147 1HD2 ASN 147 -9.633 -4.764 -4.275 1080 HD22 ASN 147 2HD2 ASN 147 -9.374 -3.609 -5.537 1081 H LEU 148 H LEU 148 -5.461 -3.965 -4.004 1082 HA LEU 148 HA LEU 148 -3.216 -5.206 -5.362 1083 HB2 LEU 148 2HB LEU 148 -3.711 -2.280 -4.692 1084 HB3 LEU 148 1HB LEU 148 -2.504 -2.890 -5.816 1085 HG LEU 148 HG LEU 148 -5.525 -2.921 -6.156 1086 HD11 LEU 148 1HD1 LEU 148 -4.476 -0.778 -6.679 1087 HD12 LEU 148 2HD1 LEU 148 -5.101 -1.540 -8.140 1088 HD13 LEU 148 3HD1 LEU 148 -3.368 -1.571 -7.803 1089 HD21 LEU 148 3HD2 LEU 148 -4.735 -5.058 -6.988 1090 HD22 LEU 148 1HD2 LEU 148 -3.473 -4.262 -7.940 1091 HD23 LEU 148 2HD2 LEU 148 -5.176 -4.025 -8.345 1092 H ALA 149 H ALA 149 -3.413 -5.867 -2.513 1093 HA ALA 149 HA ALA 149 -1.377 -4.327 -1.126 1094 HB1 ALA 149 3HB ALA 149 -3.394 -5.032 0.081 1095 HB2 ALA 149 1HB ALA 149 -1.953 -5.752 0.807 1096 HB3 ALA 149 2HB ALA 149 -3.005 -6.728 -0.222 1097 H TYR 150 H TYR 150 0.674 -4.832 -1.172 1098 HA TYR 150 HA TYR 150 1.671 -7.203 -2.582 1099 HB2 TYR 150 2HB TYR 150 3.230 -4.736 -1.707 1100 HB3 TYR 150 1HB TYR 150 3.704 -5.914 -2.929 1101 HD1 TYR 150 HD1 TYR 150 1.662 -6.199 -4.818 1102 HD2 TYR 150 HD2 TYR 150 2.564 -2.640 -2.613 1103 HE1 TYR 150 HE1 TYR 150 0.574 -4.845 -6.544 1104 HE2 TYR 150 HE2 TYR 150 1.479 -1.286 -4.368 1105 HH TYR 150 HH TYR 150 0.858 -1.454 -6.738 1106 H SER 151 H SER 151 3.392 -8.505 -1.737 1107 HA SER 151 HA SER 151 3.073 -9.368 0.882 1108 HB2 SER 151 2HB SER 151 3.856 -10.738 -1.089 1109 HB3 SER 151 1HB SER 151 5.427 -9.945 -0.974 1110 HG SER 151 HG SER 151 5.105 -12.074 0.116 1111 HA PRO 152 HA PRO 152 5.664 -6.661 3.303 1112 HB2 PRO 152 2HB PRO 152 5.726 -8.631 5.502 1113 HB3 PRO 152 1HB PRO 152 4.736 -7.168 5.355 1114 HG2 PRO 152 2HG PRO 152 3.663 -9.644 5.271 1115 HG3 PRO 152 1HG PRO 152 2.979 -8.283 4.348 1116 HD2 PRO 152 2HD PRO 152 4.871 -10.445 3.373 1117 HD3 PRO 152 1HD PRO 152 3.333 -9.889 2.658 1118 H PHE 153 H PHE 153 7.835 -6.282 3.043 1119 HA PHE 153 HA PHE 153 9.924 -7.943 2.736 1120 HB2 PHE 153 2HB PHE 153 9.884 -5.295 4.233 1121 HB3 PHE 153 1HB PHE 153 11.342 -6.083 3.637 1122 HD1 PHE 153 HD2 PHE 153 11.677 -6.384 1.156 1123 HD2 PHE 153 HD1 PHE 153 8.489 -3.996 2.727 1124 HE1 PHE 153 HE2 PHE 153 11.371 -5.328 -1.044 1125 HE2 PHE 153 HE1 PHE 153 8.192 -2.948 0.513 1126 HZ PHE 153 HZ PHE 153 9.631 -3.619 -1.369 1127 H CYS 154 H CYS 154 8.850 -6.749 5.974 1128 HA CYS 154 HA CYS 154 10.846 -8.008 7.499 1129 HB2 CYS 154 2HB CYS 154 9.264 -7.667 9.424 1130 HB3 CYS 154 1HB CYS 154 9.479 -6.236 8.419 1131 HG CYS 154 HG CYS 154 7.051 -6.080 7.428 1132 H ALA 155 H ALA 155 7.726 -9.235 6.399 1133 HA ALA 155 HA ALA 155 7.296 -11.468 7.911 1134 HB1 ALA 155 3HB ALA 155 6.825 -11.171 4.933 1135 HB2 ALA 155 1HB ALA 155 5.755 -10.602 6.218 1136 HB3 ALA 155 2HB ALA 155 6.017 -12.334 6.000 1137 H TYR 156 H TYR 156 8.856 -11.644 4.693 1138 HA TYR 156 HA TYR 156 9.769 -14.358 5.236 1139 HB2 TYR 156 2HB TYR 156 10.613 -14.155 2.760 1140 HB3 TYR 156 1HB TYR 156 8.888 -14.261 3.080 1141 HD1 TYR 156 HD1 TYR 156 11.489 -11.531 2.796 1142 HD2 TYR 156 HD2 TYR 156 7.541 -12.827 1.803 1143 HE1 TYR 156 HE1 TYR 156 11.114 -9.468 1.544 1144 HE2 TYR 156 HE2 TYR 156 7.186 -10.744 0.533 1145 HH TYR 156 HH TYR 156 8.104 -8.415 0.549 1146 H SER 157 H SER 157 11.131 -11.244 5.562 1147 HA SER 157 HA SER 157 13.772 -12.419 6.057 1148 HB2 SER 157 2HB SER 157 14.831 -10.416 4.838 1149 HB3 SER 157 1HB SER 157 14.097 -11.656 3.819 1150 HG SER 157 HG SER 157 12.680 -9.343 4.624 1151 H ASP 158 H ASP 158 14.275 -11.918 8.058 1152 HA ASP 158 HA ASP 158 12.721 -10.016 9.581 1153 HB2 ASP 158 2HB ASP 158 15.003 -11.839 10.447 1154 HB3 ASP 158 1HB ASP 158 13.938 -10.953 11.534 1155 H THR 159 H THR 159 15.459 -9.561 7.765 1156 HA THR 159 HA THR 159 17.075 -7.933 9.452 1157 HB THR 159 HB THR 159 17.984 -9.008 7.415 1158 HG1 THR 159 HG1 THR 159 18.958 -7.056 8.285 1159 HG21 THR 159 3HG2 THR 159 16.066 -8.734 5.899 1160 HG22 THR 159 1HG2 THR 159 17.529 -8.068 5.167 1161 HG23 THR 159 2HG2 THR 159 16.318 -6.990 5.866 1162 H PHE 160 H PHE 160 14.040 -7.293 7.962 1163 HA PHE 160 HA PHE 160 14.447 -4.384 7.735 1164 HB2 PHE 160 2HB PHE 160 12.053 -6.159 7.061 1165 HB3 PHE 160 1HB PHE 160 12.070 -4.409 6.868 1166 HD1 PHE 160 HD2 PHE 160 13.443 -7.605 5.575 1167 HD2 PHE 160 HD1 PHE 160 13.194 -3.375 4.983 1168 HE1 PHE 160 HE2 PHE 160 14.307 -7.868 3.286 1169 HE2 PHE 160 HE1 PHE 160 14.059 -3.655 2.698 1170 HZ PHE 160 HZ PHE 160 14.613 -5.897 1.846 1171 H SER 161 H SER 161 14.042 -3.157 9.525 1172 HA SER 161 HA SER 161 12.623 -4.064 11.839 1173 HB2 SER 161 2HB SER 161 14.327 -2.271 11.991 1174 HB3 SER 161 1HB SER 161 13.337 -1.219 10.980 1175 HG SER 161 HG SER 161 11.998 -0.867 12.622 1176 H CYS 162 H CYS 162 10.440 -3.941 12.286 1177 HA CYS 162 HA CYS 162 8.609 -3.748 10.168 1178 HB2 CYS 162 2HB CYS 162 6.904 -4.024 12.031 1179 HB3 CYS 162 1HB CYS 162 8.200 -5.219 12.051 1180 HG CYS 162 HG CYS 162 8.834 -2.529 13.914 1181 HA PRO 163 HA PRO 163 7.443 0.590 10.026 1182 HB2 PRO 163 2HB PRO 163 4.643 -0.340 9.456 1183 HB3 PRO 163 1HB PRO 163 5.724 0.667 8.467 1184 HG2 PRO 163 2HG PRO 163 5.232 -1.830 7.760 1185 HG3 PRO 163 1HG PRO 163 6.876 -1.161 7.607 1186 HD2 PRO 163 2HD PRO 163 5.766 -2.940 9.791 1187 HD3 PRO 163 1HD PRO 163 7.293 -3.088 8.883 1188 H LEU 164 H LEU 164 5.839 2.162 10.922 1189 HA LEU 164 HA LEU 164 4.783 1.389 13.573 1190 HB2 LEU 164 2HB LEU 164 5.289 4.179 12.420 1191 HB3 LEU 164 1HB LEU 164 4.690 3.835 14.034 1192 HG LEU 164 HG LEU 164 7.472 3.168 12.995 1193 HD11 LEU 164 1HD1 LEU 164 6.599 5.275 15.000 1194 HD12 LEU 164 2HD1 LEU 164 7.177 5.570 13.358 1195 HD13 LEU 164 3HD1 LEU 164 8.268 4.890 14.563 1196 HD21 LEU 164 3HD2 LEU 164 6.758 1.485 14.616 1197 HD22 LEU 164 1HD2 LEU 164 6.320 2.748 15.773 1198 HD23 LEU 164 2HD2 LEU 164 8.008 2.515 15.307 1199 HA PRO 165 HA PRO 165 0.960 1.923 11.017 1200 HB2 PRO 165 2HB PRO 165 -0.419 -0.275 11.805 1201 HB3 PRO 165 1HB PRO 165 0.929 -0.396 10.655 1202 HG2 PRO 165 2HG PRO 165 0.846 -1.137 13.536 1203 HG3 PRO 165 1HG PRO 165 1.770 -1.867 12.207 1204 HD2 PRO 165 2HD PRO 165 2.749 0.022 14.107 1205 HD3 PRO 165 1HD PRO 165 3.581 -0.535 12.642 1206 HA PRO 166 HA PRO 166 -1.017 4.041 14.577 1207 HB2 PRO 166 2HB PRO 166 -3.028 5.233 13.049 1208 HB3 PRO 166 1HB PRO 166 -1.412 5.924 13.294 1209 HG2 PRO 166 2HG PRO 166 -2.469 4.381 10.966 1210 HG3 PRO 166 1HG PRO 166 -1.382 5.784 10.985 1211 HD2 PRO 166 2HD PRO 166 -0.469 3.265 10.580 1212 HD3 PRO 166 1HD PRO 166 0.498 4.491 11.432 1213 H GLU 167 H GLU 167 -2.899 3.691 15.739 1214 HA GLU 167 HA GLU 167 -4.072 1.100 15.517 1215 HB2 GLU 167 2HB GLU 167 -4.877 3.426 17.308 1216 HB3 GLU 167 1HB GLU 167 -5.341 1.738 17.531 1217 HG2 GLU 167 2HG GLU 167 -3.087 1.090 18.035 1218 HG3 GLU 167 1HG GLU 167 -2.457 2.660 17.542 1219 H SER 168 H SER 168 -5.034 4.215 14.386 1220 HA SER 168 HA SER 168 -7.823 3.668 13.943 1221 HB2 SER 168 2HB SER 168 -6.025 5.839 12.780 1222 HB3 SER 168 1HB SER 168 -7.791 5.838 12.775 1223 HG SER 168 HG SER 168 -6.653 5.491 15.275 1224 H ASN 169 H ASN 169 -4.972 2.767 12.377 1225 HA ASN 169 HA ASN 169 -6.004 2.512 9.656 1226 HB2 ASN 169 2HB ASN 169 -3.711 3.267 9.956 1227 HB3 ASN 169 1HB ASN 169 -3.336 1.905 10.994 1228 HD21 ASN 169 1HD2 ASN 169 -4.115 2.816 7.725 1229 HD22 ASN 169 2HD2 ASN 169 -3.299 1.522 6.950 1230 H TRP 170 H TRP 170 -6.114 0.720 12.516 1231 HA TRP 170 HA TRP 170 -5.749 -1.938 11.457 1232 HB2 TRP 170 2HB TRP 170 -6.870 -1.013 14.140 1233 HB3 TRP 170 1HB TRP 170 -6.498 -2.682 13.722 1234 HD1 TRP 170 HD1 TRP 170 -3.689 -0.838 12.303 1235 HE1 TRP 170 HE1 TRP 170 -1.692 -0.737 13.919 1236 HE3 TRP 170 HE3 TRP 170 -6.042 -2.292 16.618 1237 HZ2 TRP 170 HZ2 TRP 170 -1.173 -1.216 16.659 1238 HZ3 TRP 170 HZ3 TRP 170 -4.722 -2.452 18.687 1239 HH2 TRP 170 HH2 TRP 170 -2.336 -1.926 18.710 1240 H LEU 171 H LEU 171 -7.231 -2.853 10.191 1241 HA LEU 171 HA LEU 171 -10.057 -2.099 10.252 1242 HB2 LEU 171 2HB LEU 171 -8.742 -4.120 8.390 1243 HB3 LEU 171 1HB LEU 171 -10.246 -3.249 8.146 1244 HG LEU 171 HG LEU 171 -7.441 -2.074 7.999 1245 HD11 LEU 171 1HD1 LEU 171 -7.997 -3.468 6.060 1246 HD12 LEU 171 2HD1 LEU 171 -7.888 -1.769 5.611 1247 HD13 LEU 171 3HD1 LEU 171 -9.471 -2.532 5.792 1248 HD21 LEU 171 3HD2 LEU 171 -8.941 -0.394 8.894 1249 HD22 LEU 171 1HD2 LEU 171 -10.100 -0.687 7.594 1250 HD23 LEU 171 2HD2 LEU 171 -8.521 0.005 7.233 1251 H GLU 172 H GLU 172 -11.375 -3.287 11.584 1252 HA GLU 172 HA GLU 172 -10.559 -5.934 12.545 1253 HB2 GLU 172 2HB GLU 172 -11.627 -3.963 13.931 1254 HB3 GLU 172 1HB GLU 172 -13.152 -4.472 13.223 1255 HG2 GLU 172 2HG GLU 172 -12.980 -5.448 15.400 1256 HG3 GLU 172 1HG GLU 172 -12.778 -6.745 14.218 1257 H THR 173 H THR 173 -10.802 -6.103 9.964 1258 HA THR 173 HA THR 173 -12.870 -7.992 9.432 1259 HB THR 173 HB THR 173 -14.141 -5.942 8.899 1260 HG1 THR 173 HG1 THR 173 -14.642 -7.618 7.564 1261 HG21 THR 173 3HG2 THR 173 -11.971 -5.291 6.863 1262 HG22 THR 173 1HG2 THR 173 -12.252 -4.405 8.366 1263 HG23 THR 173 2HG2 THR 173 -13.481 -4.410 7.099 1264 H ALA 174 H ALA 174 -12.385 -9.132 7.379 1265 HA ALA 174 HA ALA 174 -9.467 -9.113 6.868 1266 HB1 ALA 174 3HB ALA 174 -10.371 -11.200 7.811 1267 HB2 ALA 174 1HB ALA 174 -9.753 -11.458 6.177 1268 HB3 ALA 174 2HB ALA 174 -11.492 -11.341 6.455 1269 H VAL 175 H VAL 175 -8.682 -8.877 4.849 1270 HA VAL 175 HA VAL 175 -10.510 -7.943 2.755 1271 HB VAL 175 HB VAL 175 -7.460 -7.776 2.964 1272 HG11 VAL 175 1HG1 VAL 175 -7.537 -6.335 0.941 1273 HG12 VAL 175 2HG1 VAL 175 -9.267 -6.655 0.781 1274 HG13 VAL 175 3HG1 VAL 175 -8.106 -7.972 0.590 1275 HG21 VAL 175 3HG2 VAL 175 -7.877 -5.333 3.235 1276 HG22 VAL 175 1HG2 VAL 175 -8.642 -6.277 4.516 1277 HG23 VAL 175 2HG2 VAL 175 -9.615 -5.635 3.192 1278 H THR 176 H THR 176 -11.388 -9.986 2.262 1279 HA THR 176 HA THR 176 -9.713 -11.815 0.695 1280 HB THR 176 HB THR 176 -11.940 -13.108 0.548 1281 HG1 THR 176 HG1 THR 176 -12.954 -11.839 2.780 1282 HG21 THR 176 3HG2 THR 176 -11.804 -13.980 2.866 1283 HG22 THR 176 1HG2 THR 176 -10.811 -12.595 3.330 1284 HG23 THR 176 2HG2 THR 176 -10.198 -13.773 2.166 1285 H ALA 177 H ALA 177 -9.282 -10.840 -1.213 1286 HA ALA 177 HA ALA 177 -11.528 -10.000 -2.954 1287 HB1 ALA 177 3HB ALA 177 -10.433 -7.975 -2.087 1288 HB2 ALA 177 1HB ALA 177 -10.139 -8.154 -3.817 1289 HB3 ALA 177 2HB ALA 177 -8.865 -8.553 -2.659 1290 H GLY 178 H GLY 178 -11.534 -11.101 -4.814 1291 HA2 GLY 178 2HA GLY 178 -11.026 -12.740 -6.337 1292 HA3 GLY 178 1HA GLY 178 -9.450 -11.968 -6.410 1293 H GLU 179 H GLU 179 -8.492 -14.056 -6.775 1294 HA GLU 179 HA GLU 179 -8.396 -16.076 -4.750 1295 HB2 GLU 179 2HB GLU 179 -7.770 -16.407 -7.188 1296 HB3 GLU 179 1HB GLU 179 -6.321 -15.450 -6.915 1297 HG2 GLU 179 2HG GLU 179 -5.881 -17.890 -6.929 1298 HG3 GLU 179 1HG GLU 179 -5.437 -17.131 -5.399 1299 H ARG 180 H ARG 180 -6.376 -16.543 -3.477 1300 HA ARG 180 HA ARG 180 -5.234 -14.052 -2.330 1301 HB2 ARG 180 2HB ARG 180 -6.341 -16.466 -0.826 1302 HB3 ARG 180 1HB ARG 180 -5.520 -15.097 -0.085 1303 HG2 ARG 180 2HG ARG 180 -7.351 -13.630 -0.503 1304 HG3 ARG 180 1HG ARG 180 -8.099 -14.756 -1.641 1305 HD2 ARG 180 2HD ARG 180 -9.161 -14.619 0.688 1306 HD3 ARG 180 1HD ARG 180 -8.782 -16.235 0.088 1307 HE ARG 180 HE ARG 180 -6.886 -14.853 1.874 1308 HH11 ARG 180 1HH1 ARG 180 -9.167 -17.507 1.414 1309 HH12 ARG 180 2HH1 ARG 180 -8.618 -18.372 2.817 1310 HH21 ARG 180 1HH2 ARG 180 -6.126 -16.041 3.643 1311 HH22 ARG 180 2HH2 ARG 180 -6.888 -17.539 4.080 1312 H THR 181 H THR 181 -2.949 -14.236 -2.367 1313 HA THR 181 HA THR 181 -1.278 -16.182 -2.747 1314 HB THR 181 HB THR 181 0.193 -15.129 -0.866 1315 HG1 THR 181 HG1 THR 181 -0.946 -13.958 0.485 1316 HG21 THR 181 3HG2 THR 181 -0.986 -13.361 -3.028 1317 HG22 THR 181 1HG2 THR 181 0.376 -14.466 -3.222 1318 HG23 THR 181 2HG2 THR 181 0.525 -13.059 -2.168 1319 H ASP 182 H ASP 182 -0.448 -17.979 -1.906 1320 HA ASP 182 HA ASP 182 -1.782 -19.489 0.091 1321 HB2 ASP 182 2HB ASP 182 0.885 -19.946 -1.316 1322 HB3 ASP 182 1HB ASP 182 0.047 -21.154 -0.348 1323 H LEU 183 H LEU 183 -0.431 -20.696 1.757 1324 HA LEU 183 HA LEU 183 0.737 -18.936 3.676 1325 HB2 LEU 183 2HB LEU 183 1.002 -20.828 5.080 1326 HB3 LEU 183 1HB LEU 183 -0.485 -21.100 4.198 1327 HG LEU 183 HG LEU 183 2.171 -22.464 3.556 1328 HD11 LEU 183 1HD1 LEU 183 1.333 -23.177 5.746 1329 HD12 LEU 183 2HD1 LEU 183 1.228 -24.484 4.570 1330 HD13 LEU 183 3HD1 LEU 183 -0.227 -23.595 5.028 1331 HD21 LEU 183 3HD2 LEU 183 0.709 -22.338 1.580 1332 HD22 LEU 183 1HD2 LEU 183 -0.610 -23.078 2.494 1333 HD23 LEU 183 2HD2 LEU 183 0.858 -23.998 2.155 1334 H GLU 184 H GLU 184 1.982 -20.978 1.151 1335 HA GLU 184 HA GLU 184 4.768 -20.921 1.981 1336 HB2 GLU 184 2HB GLU 184 5.133 -22.268 -0.088 1337 HB3 GLU 184 1HB GLU 184 3.861 -22.941 0.929 1338 HG2 GLU 184 2HG GLU 184 2.156 -21.874 -0.554 1339 HG3 GLU 184 1HG GLU 184 3.457 -21.307 -1.597 1340 H HIS 185 H HIS 185 2.687 -19.232 -0.267 1341 HA HIS 185 HA HIS 185 4.626 -17.186 -0.811 1342 HB2 HIS 185 2HB HIS 185 5.391 -18.804 -2.476 1343 HB3 HIS 185 1HB HIS 185 3.747 -19.055 -3.057 1344 HD1 HIS 185 HD1 HIS 185 2.792 -17.353 -4.699 1345 HD2 HIS 185 HD2 HIS 185 6.569 -16.294 -3.312 1346 HE1 HIS 185 HE1 HIS 185 3.538 -15.447 -6.146 1347 HE2 HIS 185 HE2 HIS 185 5.862 -14.912 -5.383 Start of MODEL 7 1 H1 MET 1 1H MET 1 -18.873 4.217 -14.996 2 H2 MET 1 2H MET 1 -19.709 2.779 -14.697 3 H3 MET 1 3H MET 1 -20.555 4.167 -15.147 4 HA MET 1 HA MET 1 -20.335 2.544 -16.944 5 HB2 MET 1 2HB MET 1 -19.615 4.150 -18.685 6 HB3 MET 1 1HB MET 1 -20.651 4.925 -17.498 7 HG2 MET 1 2HG MET 1 -18.634 5.904 -16.424 8 HG3 MET 1 1HG MET 1 -17.637 5.170 -17.680 9 HE1 MET 1 3HE MET 1 -20.727 8.527 -18.441 10 HE2 MET 1 1HE MET 1 -20.334 7.907 -16.837 11 HE3 MET 1 2HE MET 1 -21.209 6.893 -17.989 12 H ASP 2 H ASP 2 -18.980 1.408 -18.396 13 HA ASP 2 HA ASP 2 -16.618 0.297 -17.362 14 HB2 ASP 2 2HB ASP 2 -17.640 0.354 -20.236 15 HB3 ASP 2 1HB ASP 2 -16.267 -0.616 -19.709 16 H GLU 3 H GLU 3 -17.123 3.007 -19.567 17 HA GLU 3 HA GLU 3 -14.548 3.456 -20.550 18 HB2 GLU 3 2HB GLU 3 -16.757 5.466 -19.922 19 HB3 GLU 3 1HB GLU 3 -15.338 5.816 -20.912 20 HG2 GLU 3 2HG GLU 3 -16.045 4.242 -22.611 21 HG3 GLU 3 1HG GLU 3 -17.367 3.659 -21.594 22 H ASP 4 H ASP 4 -15.951 4.266 -17.448 23 HA ASP 4 HA ASP 4 -13.708 5.926 -16.581 24 HB2 ASP 4 2HB ASP 4 -15.980 6.636 -15.986 25 HB3 ASP 4 1HB ASP 4 -16.294 5.091 -15.207 26 H THR 5 H THR 5 -15.081 2.703 -16.015 27 HA THR 5 HA THR 5 -13.591 1.979 -13.716 28 HB THR 5 HB THR 5 -14.765 0.113 -15.829 29 HG1 THR 5 HG1 THR 5 -15.956 1.749 -13.946 30 HG21 THR 5 3HG2 THR 5 -13.325 -1.063 -14.180 31 HG22 THR 5 1HG2 THR 5 -15.025 -1.493 -13.964 32 HG23 THR 5 2HG2 THR 5 -14.256 -0.352 -12.858 33 H GLU 6 H GLU 6 -12.908 1.725 -17.175 34 HA GLU 6 HA GLU 6 -10.697 -0.087 -16.937 35 HB2 GLU 6 2HB GLU 6 -10.381 0.288 -19.353 36 HB3 GLU 6 1HB GLU 6 -12.060 -0.074 -18.956 37 HG2 GLU 6 2HG GLU 6 -12.539 2.392 -19.050 38 HG3 GLU 6 1HG GLU 6 -10.892 2.645 -19.639 39 H ASP 7 H ASP 7 -10.925 3.378 -16.508 40 HA ASP 7 HA ASP 7 -8.236 4.109 -17.053 41 HB2 ASP 7 2HB ASP 7 -10.124 5.194 -14.919 42 HB3 ASP 7 1HB ASP 7 -8.578 5.931 -15.334 43 H TRP 8 H TRP 8 -9.780 2.922 -14.069 44 HA TRP 8 HA TRP 8 -7.655 2.486 -12.392 45 HB2 TRP 8 2HB TRP 8 -9.884 1.956 -11.621 46 HB3 TRP 8 1HB TRP 8 -10.101 0.749 -12.879 47 HD1 TRP 8 HD1 TRP 8 -8.002 1.231 -9.632 48 HE1 TRP 8 HE1 TRP 8 -7.599 -1.095 -8.607 49 HE3 TRP 8 HE3 TRP 8 -10.085 -1.664 -13.306 50 HZ2 TRP 8 HZ2 TRP 8 -8.084 -3.786 -9.255 51 HZ3 TRP 8 HZ3 TRP 8 -10.070 -4.112 -13.030 52 HH2 TRP 8 HH2 TRP 8 -9.086 -5.151 -11.042 53 H GLU 9 H GLU 9 -8.739 0.312 -15.036 54 HA GLU 9 HA GLU 9 -6.700 -1.636 -14.756 55 HB2 GLU 9 2HB GLU 9 -8.826 -2.092 -15.947 56 HB3 GLU 9 1HB GLU 9 -8.352 -0.972 -17.225 57 HG2 GLU 9 2HG GLU 9 -6.353 -2.449 -17.681 58 HG3 GLU 9 1HG GLU 9 -7.000 -3.592 -16.503 59 H THR 10 H THR 10 -6.734 1.437 -16.512 60 HA THR 10 HA THR 10 -4.573 0.914 -18.288 61 HB THR 10 HB THR 10 -5.540 3.637 -17.290 62 HG1 THR 10 HG1 THR 10 -7.050 3.530 -18.884 63 HG21 THR 10 3HG2 THR 10 -4.681 4.465 -19.469 64 HG22 THR 10 1HG2 THR 10 -4.069 2.851 -19.842 65 HG23 THR 10 2HG2 THR 10 -3.383 3.768 -18.497 66 H GLN 11 H GLN 11 -4.693 2.928 -15.315 67 HA GLN 11 HA GLN 11 -1.881 3.131 -14.973 68 HB2 GLN 11 2HB GLN 11 -2.449 4.035 -12.721 69 HB3 GLN 11 1HB GLN 11 -3.374 4.787 -14.016 70 HG2 GLN 11 2HG GLN 11 -5.301 3.278 -13.439 71 HG3 GLN 11 1HG GLN 11 -4.380 2.699 -12.052 72 HE21 GLN 11 1HE2 GLN 11 -6.948 4.160 -12.223 73 HE22 GLN 11 2HE2 GLN 11 -6.753 5.555 -11.227 74 H LEU 12 H LEU 12 -4.128 0.618 -14.197 75 HA LEU 12 HA LEU 12 -3.057 -0.624 -11.953 76 HB2 LEU 12 2HB LEU 12 -5.239 -1.148 -13.040 77 HB3 LEU 12 1HB LEU 12 -4.386 -1.921 -14.357 78 HG LEU 12 HG LEU 12 -3.533 -3.643 -12.747 79 HD11 LEU 12 1HD1 LEU 12 -5.365 -2.250 -10.774 80 HD12 LEU 12 2HD1 LEU 12 -3.599 -2.299 -10.712 81 HD13 LEU 12 3HD1 LEU 12 -4.524 -3.782 -10.514 82 HD21 LEU 12 3HD2 LEU 12 -5.638 -4.860 -12.509 83 HD22 LEU 12 1HD2 LEU 12 -5.576 -4.065 -14.081 84 HD23 LEU 12 2HD2 LEU 12 -6.561 -3.381 -12.782 85 H GLN 13 H GLN 13 -2.255 -1.042 -15.400 86 HA GLN 13 HA GLN 13 -0.844 -3.430 -15.216 87 HB2 GLN 13 2HB GLN 13 0.071 -2.957 -17.434 88 HB3 GLN 13 1HB GLN 13 -1.628 -2.500 -17.366 89 HG2 GLN 13 2HG GLN 13 -1.035 -0.145 -17.215 90 HG3 GLN 13 1HG GLN 13 0.678 -0.539 -17.125 91 HE21 GLN 13 1HE2 GLN 13 0.575 -2.596 -19.210 92 HE22 GLN 13 2HE2 GLN 13 0.371 -1.756 -20.703 93 H ALA 14 H ALA 14 0.311 -0.106 -14.752 94 HA ALA 14 HA ALA 14 3.090 -0.636 -14.644 95 HB1 ALA 14 3HB ALA 14 2.177 1.625 -14.955 96 HB2 ALA 14 1HB ALA 14 3.279 1.568 -13.576 97 HB3 ALA 14 2HB ALA 14 1.532 1.606 -13.312 98 H ASN 15 H ASN 15 0.540 -0.712 -12.181 99 HA ASN 15 HA ASN 15 2.223 -0.870 -9.903 100 HB2 ASN 15 2HB ASN 15 -0.707 -1.574 -10.294 101 HB3 ASN 15 1HB ASN 15 0.101 -1.685 -8.728 102 HD21 ASN 15 1HD2 ASN 15 -1.144 0.487 -11.160 103 HD22 ASN 15 2HD2 ASN 15 -0.977 1.931 -10.228 104 H ARG 16 H ARG 16 1.469 -3.330 -12.207 105 HA ARG 16 HA ARG 16 2.890 -5.242 -10.430 106 HB2 ARG 16 2HB ARG 16 2.326 -6.989 -12.293 107 HB3 ARG 16 1HB ARG 16 1.099 -6.541 -11.125 108 HG2 ARG 16 2HG ARG 16 1.204 -5.226 -13.853 109 HG3 ARG 16 1HG ARG 16 0.414 -6.790 -13.611 110 HD2 ARG 16 2HD ARG 16 -0.303 -4.129 -12.332 111 HD3 ARG 16 1HD ARG 16 -1.288 -5.081 -13.445 112 HE ARG 16 HE ARG 16 -1.321 -6.811 -11.615 113 HH11 ARG 16 1HH1 ARG 16 -1.069 -3.395 -10.851 114 HH12 ARG 16 2HH1 ARG 16 -1.752 -3.584 -9.272 115 HH21 ARG 16 1HH2 ARG 16 -2.020 -7.067 -9.500 116 HH22 ARG 16 2HH2 ARG 16 -2.294 -5.682 -8.497 117 H ASP 17 H ASP 17 3.054 -3.540 -13.485 118 HA ASP 17 HA ASP 17 5.047 -4.992 -14.798 119 HB2 ASP 17 2HB ASP 17 3.556 -3.357 -15.910 120 HB3 ASP 17 1HB ASP 17 4.349 -2.031 -15.063 121 H GLU 18 H GLU 18 5.456 -1.863 -13.094 122 HA GLU 18 HA GLU 18 8.326 -1.992 -13.182 123 HB2 GLU 18 2HB GLU 18 8.303 0.044 -11.784 124 HB3 GLU 18 1HB GLU 18 7.248 0.201 -13.185 125 HG2 GLU 18 2HG GLU 18 5.283 0.039 -11.873 126 HG3 GLU 18 1HG GLU 18 6.158 -0.589 -10.478 127 H LYS 19 H LYS 19 5.830 -2.828 -10.792 128 HA LYS 19 HA LYS 19 7.566 -2.870 -8.512 129 HB2 LYS 19 2HB LYS 19 4.884 -4.295 -8.751 130 HB3 LYS 19 1HB LYS 19 5.706 -3.816 -7.266 131 HG2 LYS 19 2HG LYS 19 4.487 -1.961 -9.338 132 HG3 LYS 19 1HG LYS 19 3.817 -2.343 -7.753 133 HD2 LYS 19 2HD LYS 19 5.773 -1.221 -6.683 134 HD3 LYS 19 1HD LYS 19 6.405 -0.824 -8.287 135 HE2 LYS 19 2HE LYS 19 4.238 0.438 -8.723 136 HE3 LYS 19 1HE LYS 19 3.825 0.187 -7.024 137 HZ1 LYS 19 3HZ LYS 19 6.198 1.648 -8.052 138 HZ2 LYS 19 1HZ LYS 19 5.830 1.399 -6.418 139 HZ3 LYS 19 2HZ LYS 19 4.811 2.346 -7.375 140 H ASP 20 H ASP 20 6.713 -5.202 -10.949 141 HA ASP 20 HA ASP 20 7.561 -7.603 -9.706 142 HB2 ASP 20 2HB ASP 20 6.137 -7.672 -11.678 143 HB3 ASP 20 1HB ASP 20 7.335 -6.815 -12.637 144 H ARG 21 H ARG 21 9.170 -5.439 -11.999 145 HA ARG 21 HA ARG 21 11.704 -6.853 -11.839 146 HB2 ARG 21 2HB ARG 21 12.506 -5.270 -13.497 147 HB3 ARG 21 1HB ARG 21 10.920 -5.864 -13.983 148 HG2 ARG 21 2HG ARG 21 9.892 -3.760 -13.145 149 HG3 ARG 21 1HG ARG 21 11.496 -3.162 -12.711 150 HD2 ARG 21 2HD ARG 21 10.850 -2.196 -14.826 151 HD3 ARG 21 1HD ARG 21 12.162 -3.346 -15.104 152 HE ARG 21 HE ARG 21 10.545 -4.914 -15.980 153 HH11 ARG 21 1HH1 ARG 21 9.347 -1.623 -15.636 154 HH12 ARG 21 2HH1 ARG 21 8.063 -1.860 -16.773 155 HH21 ARG 21 1HH2 ARG 21 8.844 -5.188 -17.443 156 HH22 ARG 21 2HH2 ARG 21 7.775 -3.862 -17.790 157 H PHE 22 H PHE 22 10.119 -4.350 -10.109 158 HA PHE 22 HA PHE 22 12.298 -3.007 -8.962 159 HB2 PHE 22 2HB PHE 22 9.832 -2.391 -8.772 160 HB3 PHE 22 1HB PHE 22 9.662 -3.675 -7.589 161 HD1 PHE 22 HD2 PHE 22 10.911 -3.486 -5.366 162 HD2 PHE 22 HD1 PHE 22 10.702 -0.252 -8.168 163 HE1 PHE 22 HE2 PHE 22 11.555 -1.905 -3.607 164 HE2 PHE 22 HE1 PHE 22 11.337 1.308 -6.382 165 HZ PHE 22 HZ PHE 22 11.759 0.476 -4.109 166 H PHE 23 H PHE 23 10.608 -5.991 -8.057 167 HA PHE 23 HA PHE 23 12.327 -6.520 -5.791 168 HB2 PHE 23 2HB PHE 23 10.032 -8.041 -7.072 169 HB3 PHE 23 1HB PHE 23 10.992 -8.745 -5.775 170 HD1 PHE 23 HD2 PHE 23 9.644 -5.230 -6.194 171 HD2 PHE 23 HD1 PHE 23 9.597 -8.832 -3.891 172 HE1 PHE 23 HE2 PHE 23 8.215 -4.145 -4.516 173 HE2 PHE 23 HE1 PHE 23 8.169 -7.735 -2.217 174 HZ PHE 23 HZ PHE 23 7.479 -5.394 -2.521 175 H SER 24 H SER 24 12.251 -7.364 -9.181 176 HA SER 24 HA SER 24 14.008 -9.679 -8.871 177 HB2 SER 24 2HB SER 24 12.797 -8.412 -11.351 178 HB3 SER 24 1HB SER 24 13.719 -9.917 -11.330 179 HG SER 24 HG SER 24 12.011 -10.917 -10.665 180 H GLU 25 H GLU 25 14.317 -6.312 -10.029 181 HA GLU 25 HA GLU 25 17.071 -6.876 -11.001 182 HB2 GLU 25 2HB GLU 25 15.091 -4.903 -12.227 183 HB3 GLU 25 1HB GLU 25 16.689 -5.310 -12.849 184 HG2 GLU 25 2HG GLU 25 14.316 -7.211 -12.709 185 HG3 GLU 25 1HG GLU 25 14.822 -6.324 -14.145 186 H HIS 26 H HIS 26 14.850 -4.368 -9.786 187 HA HIS 26 HA HIS 26 16.836 -2.281 -9.663 188 HB2 HIS 26 2HB HIS 26 14.493 -1.781 -10.224 189 HB3 HIS 26 1HB HIS 26 13.955 -2.429 -8.679 190 HD2 HIS 26 HD2 HIS 26 15.858 0.759 -10.033 191 HE1 HIS 26 HE1 HIS 26 14.259 1.494 -6.178 192 HE2 HIS 26 HE2 HIS 26 15.209 2.564 -8.282 193 H ARG 27 H ARG 27 15.081 -4.205 -7.283 194 HA ARG 27 HA ARG 27 16.971 -3.532 -5.130 195 HB2 ARG 27 2HB ARG 27 13.921 -3.528 -4.938 196 HB3 ARG 27 1HB ARG 27 14.966 -3.588 -3.518 197 HG2 ARG 27 2HG ARG 27 14.824 -1.346 -5.555 198 HG3 ARG 27 1HG ARG 27 14.168 -1.317 -3.916 199 HD2 ARG 27 2HD ARG 27 16.403 -1.473 -2.986 200 HD3 ARG 27 1HD ARG 27 17.105 -1.648 -4.595 201 HE ARG 27 HE ARG 27 15.703 0.759 -4.558 202 HH11 ARG 27 1HH1 ARG 27 18.446 -0.660 -2.883 203 HH12 ARG 27 2HH1 ARG 27 19.239 0.861 -2.641 204 HH21 ARG 27 1HH2 ARG 27 16.764 2.733 -4.239 205 HH22 ARG 27 2HH2 ARG 27 18.281 2.784 -3.408 206 H GLN 28 H GLN 28 17.185 -5.111 -3.531 207 HA GLN 28 HA GLN 28 17.218 -7.795 -4.325 208 HB2 GLN 28 2HB GLN 28 17.728 -8.274 -1.915 209 HB3 GLN 28 1HB GLN 28 18.718 -6.985 -2.590 210 HG2 GLN 28 2HG GLN 28 17.237 -5.304 -1.485 211 HG3 GLN 28 1HG GLN 28 16.308 -6.625 -0.776 212 HE21 GLN 28 1HE2 GLN 28 19.342 -4.912 -0.727 213 HE22 GLN 28 2HE2 GLN 28 19.887 -5.527 0.790 214 H SER 29 H SER 29 15.629 -9.276 -4.447 215 HA SER 29 HA SER 29 12.930 -8.835 -3.728 216 HB2 SER 29 2HB SER 29 13.617 -10.432 -5.524 217 HB3 SER 29 1HB SER 29 14.298 -11.513 -4.309 218 HG SER 29 HG SER 29 11.798 -11.391 -5.183 219 HA PRO 30 HA PRO 30 13.420 -10.055 0.662 220 HB2 PRO 30 2HB PRO 30 10.868 -9.526 1.483 221 HB3 PRO 30 1HB PRO 30 12.038 -8.225 1.164 222 HG2 PRO 30 2HG PRO 30 9.870 -9.277 -0.647 223 HG3 PRO 30 1HG PRO 30 10.277 -7.590 -0.245 224 HD2 PRO 30 2HD PRO 30 11.162 -8.752 -2.536 225 HD3 PRO 30 1HD PRO 30 12.137 -7.548 -1.664 226 H ILE 31 H ILE 31 11.120 -11.267 -1.702 227 HA ILE 31 HA ILE 31 9.956 -13.414 -0.383 228 HB ILE 31 HB ILE 31 10.852 -13.566 -3.301 229 HG12 ILE 31 2HG1 ILE 31 9.748 -11.360 -2.998 230 HG13 ILE 31 1HG1 ILE 31 8.740 -12.429 -3.964 231 HG21 ILE 31 1HG2 ILE 31 8.809 -14.950 -3.585 232 HG22 ILE 31 2HG2 ILE 31 8.449 -14.782 -1.865 233 HG23 ILE 31 3HG2 ILE 31 9.901 -15.645 -2.383 234 HD11 ILE 31 3HD1 ILE 31 7.335 -12.848 -1.998 235 HD12 ILE 31 1HD1 ILE 31 7.423 -11.139 -2.419 236 HD13 ILE 31 2HD1 ILE 31 8.351 -11.754 -1.052 237 HA PRO 32 HA PRO 32 13.828 -15.416 0.894 238 HB2 PRO 32 2HB PRO 32 11.983 -17.749 1.421 239 HB3 PRO 32 1HB PRO 32 13.171 -16.983 2.500 240 HG2 PRO 32 2HG PRO 32 10.590 -16.524 2.845 241 HG3 PRO 32 1HG PRO 32 11.768 -15.199 3.013 242 HD2 PRO 32 2HD PRO 32 9.920 -15.795 0.713 243 HD3 PRO 32 1HD PRO 32 10.373 -14.229 1.423 244 HA PRO 33 HA PRO 33 15.093 -17.788 -2.806 245 HB2 PRO 33 2HB PRO 33 17.176 -19.192 -1.413 246 HB3 PRO 33 1HB PRO 33 17.341 -17.699 -2.355 247 HG2 PRO 33 2HG PRO 33 17.023 -18.043 0.596 248 HG3 PRO 33 1HG PRO 33 17.974 -16.842 -0.306 249 HD2 PRO 33 2HD PRO 33 15.663 -16.141 0.843 250 HD3 PRO 33 1HD PRO 33 16.092 -15.493 -0.762 251 H GLU 34 H GLU 34 14.508 -19.346 0.341 252 HA GLU 34 HA GLU 34 14.065 -21.984 -0.650 253 HB2 GLU 34 2HB GLU 34 13.075 -22.432 1.594 254 HB3 GLU 34 1HB GLU 34 14.644 -21.639 1.693 255 HG2 GLU 34 2HG GLU 34 13.423 -19.452 2.037 256 HG3 GLU 34 1HG GLU 34 11.924 -20.371 2.153 257 H GLU 35 H GLU 35 11.804 -19.305 0.163 258 HA GLU 35 HA GLU 35 9.448 -20.844 -0.285 259 HB2 GLU 35 2HB GLU 35 9.488 -19.063 1.373 260 HB3 GLU 35 1HB GLU 35 9.880 -17.864 0.146 261 HG2 GLU 35 2HG GLU 35 7.684 -18.013 -0.827 262 HG3 GLU 35 1HG GLU 35 7.297 -19.449 0.118 263 H ARG 36 H ARG 36 11.344 -18.634 -2.348 264 HA ARG 36 HA ARG 36 9.273 -18.021 -4.182 265 HB2 ARG 36 2HB ARG 36 11.006 -16.966 -5.533 266 HB3 ARG 36 1HB ARG 36 11.242 -16.558 -3.837 267 HG2 ARG 36 2HG ARG 36 13.071 -18.162 -3.664 268 HG3 ARG 36 1HG ARG 36 12.801 -18.703 -5.321 269 HD2 ARG 36 2HD ARG 36 14.699 -17.226 -5.318 270 HD3 ARG 36 1HD ARG 36 13.362 -16.383 -6.101 271 HE ARG 36 HE ARG 36 13.192 -15.527 -3.524 272 HH11 ARG 36 1HH1 ARG 36 15.876 -15.592 -5.810 273 HH12 ARG 36 2HH1 ARG 36 16.647 -14.200 -5.126 274 HH21 ARG 36 1HH2 ARG 36 14.244 -13.675 -2.654 275 HH22 ARG 36 2HH2 ARG 36 15.730 -13.122 -3.350 276 H ASP 37 H ASP 37 10.818 -20.981 -3.792 277 HA ASP 37 HA ASP 37 10.711 -21.793 -6.593 278 HB2 ASP 37 2HB ASP 37 12.430 -22.761 -5.066 279 HB3 ASP 37 1HB ASP 37 11.151 -23.479 -4.091 280 H ASP 38 H ASP 38 9.010 -22.594 -3.554 281 HA ASP 38 HA ASP 38 7.046 -24.300 -4.825 282 HB2 ASP 38 2HB ASP 38 7.117 -23.190 -1.981 283 HB3 ASP 38 1HB ASP 38 6.101 -24.520 -2.539 284 H PHE 39 H PHE 39 7.157 -21.054 -3.559 285 HA PHE 39 HA PHE 39 4.482 -20.379 -4.606 286 HB2 PHE 39 2HB PHE 39 6.356 -18.817 -2.753 287 HB3 PHE 39 1HB PHE 39 4.786 -18.245 -3.302 288 HD1 PHE 39 HD1 PHE 39 6.364 -21.090 -1.400 289 HD2 PHE 39 HD2 PHE 39 2.880 -18.655 -1.950 290 HE1 PHE 39 HE1 PHE 39 5.320 -22.130 0.568 291 HE2 PHE 39 HE2 PHE 39 1.850 -19.714 0.014 292 HZ PHE 39 HZ PHE 39 3.064 -21.446 1.275 293 H ASP 40 H ASP 40 4.350 -18.479 -5.978 294 HA ASP 40 HA ASP 40 6.329 -18.285 -8.001 295 HB2 ASP 40 2HB ASP 40 3.823 -16.672 -7.399 296 HB3 ASP 40 1HB ASP 40 4.877 -16.247 -8.745 297 H GLY 41 H GLY 41 7.345 -16.281 -8.723 298 HA2 GLY 41 2HA GLY 41 9.002 -14.849 -7.021 299 HA3 GLY 41 1HA GLY 41 8.497 -14.311 -8.613 300 H LEU 42 H LEU 42 8.369 -12.126 -8.031 301 HA LEU 42 HA LEU 42 6.841 -11.030 -5.929 302 HB2 LEU 42 2HB LEU 42 8.398 -9.684 -7.338 303 HB3 LEU 42 1HB LEU 42 7.289 -9.808 -8.682 304 HG LEU 42 HG LEU 42 7.370 -7.586 -7.250 305 HD11 LEU 42 1HD1 LEU 42 5.772 -7.925 -9.048 306 HD12 LEU 42 2HD1 LEU 42 5.057 -7.052 -7.696 307 HD13 LEU 42 3HD1 LEU 42 4.680 -8.761 -7.941 308 HD21 LEU 42 3HD2 LEU 42 5.465 -9.173 -5.496 309 HD22 LEU 42 1HD2 LEU 42 5.844 -7.452 -5.362 310 HD23 LEU 42 2HD2 LEU 42 7.089 -8.654 -5.040 311 H SER 43 H SER 43 5.023 -12.089 -5.609 312 HA SER 43 HA SER 43 2.729 -11.664 -7.376 313 HB2 SER 43 2HB SER 43 1.965 -14.031 -6.952 314 HB3 SER 43 1HB SER 43 3.450 -13.963 -7.896 315 HG SER 43 HG SER 43 4.610 -14.454 -6.022 316 H TYR 44 H TYR 44 0.797 -11.541 -6.208 317 HA TYR 44 HA TYR 44 0.697 -11.413 -3.350 318 HB2 TYR 44 2HB TYR 44 0.492 -8.914 -3.207 319 HB3 TYR 44 1HB TYR 44 2.101 -9.433 -3.686 320 HD1 TYR 44 HD2 TYR 44 2.867 -9.092 -6.069 321 HD2 TYR 44 HD1 TYR 44 -0.879 -7.542 -4.701 322 HE1 TYR 44 HE2 TYR 44 2.757 -7.618 -8.022 323 HE2 TYR 44 HE1 TYR 44 -0.973 -6.063 -6.661 324 HH TYR 44 HH TYR 44 1.035 -6.450 -9.340 325 H PHE 45 H PHE 45 -1.329 -9.482 -3.124 326 HA PHE 45 HA PHE 45 -3.675 -10.867 -3.802 327 HB2 PHE 45 2HB PHE 45 -3.252 -7.922 -3.103 328 HB3 PHE 45 1HB PHE 45 -4.851 -8.641 -3.308 329 HD1 PHE 45 HD2 PHE 45 -1.666 -9.221 -1.363 330 HD2 PHE 45 HD1 PHE 45 -5.941 -9.466 -1.411 331 HE1 PHE 45 HE2 PHE 45 -1.659 -9.973 0.977 332 HE2 PHE 45 HE1 PHE 45 -5.918 -10.220 0.925 333 HZ PHE 45 HZ PHE 45 -3.784 -10.473 2.121 334 H ASP 46 H ASP 46 -4.946 -10.881 -5.604 335 HA ASP 46 HA ASP 46 -3.881 -9.720 -8.056 336 HB2 ASP 46 2HB ASP 46 -4.436 -12.111 -8.094 337 HB3 ASP 46 1HB ASP 46 -6.074 -11.781 -7.543 338 HA PRO 47 HA PRO 47 -6.556 -6.149 -7.916 339 HB2 PRO 47 2HB PRO 47 -6.902 -5.739 -10.678 340 HB3 PRO 47 1HB PRO 47 -5.478 -5.240 -9.747 341 HG2 PRO 47 2HG PRO 47 -5.869 -7.727 -11.391 342 HG3 PRO 47 1HG PRO 47 -4.467 -6.630 -11.325 343 HD2 PRO 47 2HD PRO 47 -4.396 -8.928 -10.007 344 HD3 PRO 47 1HD PRO 47 -3.747 -7.459 -9.243 345 H ASP 48 H ASP 48 -8.585 -6.445 -7.173 346 HA ASP 48 HA ASP 48 -10.520 -8.040 -8.735 347 HB2 ASP 48 2HB ASP 48 -9.851 -8.849 -6.409 348 HB3 ASP 48 1HB ASP 48 -10.639 -7.417 -5.759 349 HA PRO 49 HA PRO 49 -12.208 -3.850 -9.414 350 HB2 PRO 49 2HB PRO 49 -14.280 -5.274 -11.021 351 HB3 PRO 49 1HB PRO 49 -13.109 -4.047 -11.542 352 HG2 PRO 49 2HG PRO 49 -12.865 -6.618 -12.292 353 HG3 PRO 49 1HG PRO 49 -11.446 -5.601 -11.957 354 HD2 PRO 49 2HD PRO 49 -12.721 -7.682 -10.188 355 HD3 PRO 49 1HD PRO 49 -10.999 -7.374 -10.508 356 H ASP 50 H ASP 50 -13.796 -6.539 -7.916 357 HA ASP 50 HA ASP 50 -16.343 -5.154 -7.463 358 HB2 ASP 50 2HB ASP 50 -16.502 -7.478 -8.172 359 HB3 ASP 50 1HB ASP 50 -15.427 -8.004 -6.878 360 H TYR 51 H TYR 51 -13.437 -6.116 -5.755 361 HA TYR 51 HA TYR 51 -14.592 -5.734 -3.096 362 HB2 TYR 51 2HB TYR 51 -12.832 -7.556 -3.777 363 HB3 TYR 51 1HB TYR 51 -11.651 -6.256 -3.677 364 HD1 TYR 51 HD2 TYR 51 -11.217 -5.131 -1.420 365 HD2 TYR 51 HD1 TYR 51 -13.761 -8.558 -1.785 366 HE1 TYR 51 HE2 TYR 51 -11.104 -5.475 1.007 367 HE2 TYR 51 HE1 TYR 51 -13.645 -8.894 0.646 368 HH TYR 51 HH TYR 51 -12.529 -6.543 2.759 369 H ARG 52 H ARG 52 -12.971 -3.949 -5.485 370 HA ARG 52 HA ARG 52 -11.440 -2.026 -4.172 371 HB2 ARG 52 2HB ARG 52 -11.590 -2.531 -6.652 372 HB3 ARG 52 1HB ARG 52 -13.124 -1.667 -6.687 373 HG2 ARG 52 2HG ARG 52 -11.913 0.402 -5.954 374 HG3 ARG 52 1HG ARG 52 -10.393 -0.493 -6.050 375 HD2 ARG 52 2HD ARG 52 -10.587 0.729 -8.100 376 HD3 ARG 52 1HD ARG 52 -10.945 -0.951 -8.496 377 HE ARG 52 HE ARG 52 -12.973 1.190 -8.163 378 HH11 ARG 52 1HH1 ARG 52 -12.005 -1.832 -9.670 379 HH12 ARG 52 2HH1 ARG 52 -13.424 -1.921 -10.664 380 HH21 ARG 52 1HH2 ARG 52 -14.807 1.058 -9.481 381 HH22 ARG 52 2HH2 ARG 52 -15.005 -0.289 -10.557 382 H VAL 53 H VAL 53 -11.946 -0.176 -3.030 383 HA VAL 53 HA VAL 53 -14.727 0.888 -3.062 384 HB VAL 53 HB VAL 53 -14.539 1.582 -0.725 385 HG11 VAL 53 1HG1 VAL 53 -13.734 -1.342 -0.965 386 HG12 VAL 53 2HG1 VAL 53 -15.374 -0.700 -1.091 387 HG13 VAL 53 3HG1 VAL 53 -14.502 -0.592 0.440 388 HG21 VAL 53 3HG2 VAL 53 -11.735 0.389 -0.701 389 HG22 VAL 53 1HG2 VAL 53 -12.588 1.033 0.708 390 HG23 VAL 53 2HG2 VAL 53 -12.136 2.106 -0.618 391 H GLU 54 H GLU 54 -14.759 3.254 -2.407 392 HA GLU 54 HA GLU 54 -12.355 4.755 -3.305 393 HB2 GLU 54 2HB GLU 54 -13.899 6.629 -3.833 394 HB3 GLU 54 1HB GLU 54 -14.286 5.182 -4.758 395 HG2 GLU 54 2HG GLU 54 -16.171 4.693 -3.267 396 HG3 GLU 54 1HG GLU 54 -15.764 6.086 -2.263 397 H ALA 55 H ALA 55 -11.834 6.687 -2.084 398 HA ALA 55 HA ALA 55 -12.983 6.946 0.621 399 HB1 ALA 55 3HB ALA 55 -11.009 5.468 0.821 400 HB2 ALA 55 1HB ALA 55 -10.746 7.012 1.636 401 HB3 ALA 55 2HB ALA 55 -10.001 6.701 0.063 402 H THR 56 H THR 56 -12.773 8.985 1.516 403 HA THR 56 HA THR 56 -12.126 11.206 -0.275 404 HB THR 56 HB THR 56 -13.381 11.247 2.507 405 HG1 THR 56 HG1 THR 56 -14.409 10.464 0.160 406 HG21 THR 56 3HG2 THR 56 -12.398 13.431 1.905 407 HG22 THR 56 1HG2 THR 56 -14.162 13.523 1.858 408 HG23 THR 56 2HG2 THR 56 -13.246 13.401 0.354 409 H VAL 57 H VAL 57 -10.280 12.318 -0.060 410 HA VAL 57 HA VAL 57 -8.197 11.536 1.720 411 HB VAL 57 HB VAL 57 -8.202 13.927 -0.174 412 HG11 VAL 57 1HG1 VAL 57 -5.758 13.599 -0.253 413 HG12 VAL 57 2HG1 VAL 57 -5.896 12.239 0.864 414 HG13 VAL 57 3HG1 VAL 57 -6.303 13.869 1.406 415 HG21 VAL 57 3HG2 VAL 57 -8.904 11.926 -1.438 416 HG22 VAL 57 1HG2 VAL 57 -7.479 11.055 -0.861 417 HG23 VAL 57 2HG2 VAL 57 -7.290 12.450 -1.926 418 H THR 58 H THR 58 -7.354 12.669 3.432 419 HA THR 58 HA THR 58 -8.505 15.280 4.236 420 HB THR 58 HB THR 58 -7.828 12.992 6.154 421 HG1 THR 58 HG1 THR 58 -9.721 12.575 4.872 422 HG21 THR 58 3HG2 THR 58 -7.600 15.224 7.205 423 HG22 THR 58 1HG2 THR 58 -9.006 14.370 7.852 424 HG23 THR 58 2HG2 THR 58 -9.225 15.652 6.662 425 H VAL 59 H VAL 59 -6.732 16.593 3.821 426 HA VAL 59 HA VAL 59 -4.031 15.446 4.006 427 HB VAL 59 HB VAL 59 -5.071 17.957 2.629 428 HG11 VAL 59 1HG1 VAL 59 -2.169 17.057 2.840 429 HG12 VAL 59 2HG1 VAL 59 -2.852 18.524 3.545 430 HG13 VAL 59 3HG1 VAL 59 -2.758 18.352 1.791 431 HG21 VAL 59 3HG2 VAL 59 -3.795 15.411 1.559 432 HG22 VAL 59 1HG2 VAL 59 -4.297 16.789 0.573 433 HG23 VAL 59 2HG2 VAL 59 -5.504 15.843 1.449 434 H HIS 60 H HIS 60 -2.621 16.032 5.489 435 HA HIS 60 HA HIS 60 -3.439 17.794 7.666 436 HB2 HIS 60 2HB HIS 60 -1.233 15.693 7.437 437 HB3 HIS 60 1HB HIS 60 -1.471 16.708 8.860 438 HD1 HIS 60 HD1 HIS 60 -3.830 14.547 6.765 439 HD2 HIS 60 HD2 HIS 60 -2.826 15.274 10.720 440 HE1 HIS 60 HE1 HIS 60 -5.386 13.130 8.118 441 HE2 HIS 60 HE2 HIS 60 -4.914 13.779 10.502 442 H GLU 61 H GLU 61 -2.836 19.819 7.493 443 HA GLU 61 HA GLU 61 -0.746 20.897 5.878 444 HB2 GLU 61 2HB GLU 61 -1.192 23.037 6.986 445 HB3 GLU 61 1HB GLU 61 -2.716 22.245 6.597 446 HG2 GLU 61 2HG GLU 61 -3.014 21.557 8.906 447 HG3 GLU 61 1HG GLU 61 -1.423 22.175 9.342 448 H THR 62 H THR 62 -0.845 19.554 9.079 449 HA THR 62 HA THR 62 1.993 20.217 9.580 450 HB THR 62 HB THR 62 1.415 19.881 12.038 451 HG1 THR 62 HG1 THR 62 -1.296 20.265 11.296 452 HG21 THR 62 3HG2 THR 62 1.603 22.175 11.123 453 HG22 THR 62 1HG2 THR 62 0.351 22.089 12.365 454 HG23 THR 62 2HG2 THR 62 -0.100 22.131 10.659 455 HA PRO 63 HA PRO 63 1.779 15.622 8.981 456 HB2 PRO 63 2HB PRO 63 4.095 15.318 7.595 457 HB3 PRO 63 1HB PRO 63 2.632 15.967 6.821 458 HG2 PRO 63 2HG PRO 63 5.032 17.452 7.855 459 HG3 PRO 63 1HG PRO 63 4.125 17.698 6.346 460 HD2 PRO 63 2HD PRO 63 3.746 19.223 8.628 461 HD3 PRO 63 1HD PRO 63 2.502 18.993 7.380 462 H GLU 64 H GLU 64 2.426 14.195 10.515 463 HA GLU 64 HA GLU 64 4.646 14.797 12.328 464 HB2 GLU 64 2HB GLU 64 3.823 12.904 13.667 465 HB3 GLU 64 1HB GLU 64 2.516 14.027 13.310 466 HG2 GLU 64 2HG GLU 64 1.636 12.531 11.595 467 HG3 GLU 64 1HG GLU 64 2.996 11.429 11.815 468 H SER 65 H SER 65 6.199 13.055 12.875 469 HA SER 65 HA SER 65 7.266 11.831 10.428 470 HB2 SER 65 2HB SER 65 9.396 11.699 11.752 471 HB3 SER 65 1HB SER 65 8.783 13.341 11.589 472 HG SER 65 HG SER 65 7.816 12.143 13.831 473 H VAL 66 H VAL 66 7.074 9.718 10.113 474 HA VAL 66 HA VAL 66 6.710 7.786 12.318 475 HB VAL 66 HB VAL 66 5.277 7.568 9.628 476 HG11 VAL 66 1HG1 VAL 66 3.840 5.916 10.786 477 HG12 VAL 66 2HG1 VAL 66 4.768 6.152 12.269 478 HG13 VAL 66 3HG1 VAL 66 5.544 5.449 10.850 479 HG21 VAL 66 3HG2 VAL 66 3.183 8.355 10.722 480 HG22 VAL 66 1HG2 VAL 66 4.420 9.618 10.662 481 HG23 VAL 66 2HG2 VAL 66 4.104 8.757 12.173 482 H ASP 67 H ASP 67 8.318 6.195 12.173 483 HA ASP 67 HA ASP 67 10.026 6.232 9.790 484 HB2 ASP 67 2HB ASP 67 11.633 4.904 11.079 485 HB3 ASP 67 1HB ASP 67 11.152 6.342 11.963 486 H LEU 68 H LEU 68 9.817 4.825 8.182 487 HA LEU 68 HA LEU 68 8.457 2.219 8.552 488 HB2 LEU 68 2HB LEU 68 7.817 4.220 6.335 489 HB3 LEU 68 1HB LEU 68 7.122 2.614 6.495 490 HG LEU 68 HG LEU 68 6.653 4.922 8.437 491 HD11 LEU 68 1HD1 LEU 68 4.814 3.792 6.313 492 HD12 LEU 68 2HD1 LEU 68 5.622 5.362 6.276 493 HD13 LEU 68 3HD1 LEU 68 4.398 5.036 7.499 494 HD21 LEU 68 3HD2 LEU 68 5.338 2.180 8.335 495 HD22 LEU 68 1HD2 LEU 68 4.879 3.511 9.406 496 HD23 LEU 68 2HD2 LEU 68 6.461 2.756 9.570 497 H GLU 69 H GLU 69 8.843 0.701 6.799 498 HA GLU 69 HA GLU 69 11.383 0.652 5.556 499 HB2 GLU 69 2HB GLU 69 8.806 -0.839 4.888 500 HB3 GLU 69 1HB GLU 69 10.354 -1.194 4.122 501 HG2 GLU 69 2HG GLU 69 11.295 -1.992 6.169 502 HG3 GLU 69 1HG GLU 69 9.951 -1.343 7.116 503 H THR 70 H THR 70 12.070 1.521 3.682 504 HA THR 70 HA THR 70 10.167 3.051 2.017 505 HB THR 70 HB THR 70 11.843 4.358 3.286 506 HG1 THR 70 HG1 THR 70 11.155 5.315 1.420 507 HG21 THR 70 3HG2 THR 70 13.927 2.981 1.563 508 HG22 THR 70 1HG2 THR 70 13.725 2.780 3.303 509 HG23 THR 70 2HG2 THR 70 14.218 4.340 2.647 510 H SER 71 H SER 71 11.722 3.567 -0.168 511 HA SER 71 HA SER 71 11.381 1.097 -1.679 512 HB2 SER 71 2HB SER 71 10.215 3.299 -2.239 513 HB3 SER 71 1HB SER 71 11.795 3.991 -2.591 514 HG SER 71 HG SER 71 10.319 2.065 -3.976 515 H ASP 72 H ASP 72 13.770 2.113 0.091 516 HA ASP 72 HA ASP 72 16.004 1.939 -1.835 517 HB2 ASP 72 2HB ASP 72 15.574 4.260 -0.961 518 HB3 ASP 72 1HB ASP 72 15.780 3.669 0.680 519 H ASP 73 H ASP 73 14.528 0.010 0.159 520 HA ASP 73 HA ASP 73 14.970 -1.796 1.421 521 HB2 ASP 73 2HB ASP 73 17.961 -1.332 1.062 522 HB3 ASP 73 1HB ASP 73 17.177 -2.828 1.561 523 H ARG 74 H ARG 74 15.425 1.163 2.461 524 HA ARG 74 HA ARG 74 16.888 0.610 4.967 525 HB2 ARG 74 2HB ARG 74 17.660 2.395 3.299 526 HB3 ARG 74 1HB ARG 74 16.197 3.294 3.674 527 HG2 ARG 74 2HG ARG 74 16.949 3.644 5.966 528 HG3 ARG 74 1HG ARG 74 18.343 2.592 5.717 529 HD2 ARG 74 2HD ARG 74 17.847 5.229 4.298 530 HD3 ARG 74 1HD ARG 74 18.928 5.005 5.678 531 HE ARG 74 HE ARG 74 19.705 3.193 3.709 532 HH11 ARG 74 1HH1 ARG 74 19.648 6.684 4.115 533 HH12 ARG 74 2HH1 ARG 74 20.990 6.943 3.052 534 HH21 ARG 74 1HH2 ARG 74 21.421 3.560 2.275 535 HH22 ARG 74 2HH2 ARG 74 21.996 5.173 2.006 536 H THR 75 H THR 75 15.999 2.360 6.685 537 HA THR 75 HA THR 75 13.058 2.363 6.812 538 HB THR 75 HB THR 75 14.973 1.845 9.138 539 HG1 THR 75 HG1 THR 75 14.282 0.036 7.788 540 HG21 THR 75 3HG2 THR 75 13.193 3.411 9.882 541 HG22 THR 75 1HG2 THR 75 12.961 1.813 10.598 542 HG23 THR 75 2HG2 THR 75 11.965 2.321 9.234 543 H VAL 76 H VAL 76 12.324 4.447 7.167 544 HA VAL 76 HA VAL 76 14.232 6.606 7.670 545 HB VAL 76 HB VAL 76 13.757 7.853 5.595 546 HG11 VAL 76 1HG1 VAL 76 14.861 5.101 4.942 547 HG12 VAL 76 2HG1 VAL 76 15.779 6.443 5.629 548 HG13 VAL 76 3HG1 VAL 76 15.115 6.575 3.999 549 HG21 VAL 76 3HG2 VAL 76 12.663 6.779 3.652 550 HG22 VAL 76 1HG2 VAL 76 11.574 7.042 5.016 551 HG23 VAL 76 2HG2 VAL 76 12.208 5.427 4.695 552 H ARG 77 H ARG 77 13.273 8.650 7.802 553 HA ARG 77 HA ARG 77 10.841 8.836 9.207 554 HB2 ARG 77 2HB ARG 77 12.866 10.344 9.428 555 HB3 ARG 77 1HB ARG 77 12.499 11.023 7.856 556 HG2 ARG 77 2HG ARG 77 10.599 11.230 10.215 557 HG3 ARG 77 1HG ARG 77 11.872 12.413 9.910 558 HD2 ARG 77 2HD ARG 77 9.466 11.781 8.167 559 HD3 ARG 77 1HD ARG 77 9.807 13.289 9.024 560 HE ARG 77 HE ARG 77 11.245 12.274 6.637 561 HH11 ARG 77 1HH1 ARG 77 10.298 14.993 8.666 562 HH12 ARG 77 2HH1 ARG 77 10.990 16.173 7.602 563 HH21 ARG 77 1HH2 ARG 77 12.236 13.830 5.330 564 HH22 ARG 77 2HH2 ARG 77 12.078 15.508 5.728 565 H TYR 78 H TYR 78 8.840 8.731 8.299 566 HA TYR 78 HA TYR 78 8.313 9.891 5.632 567 HB2 TYR 78 2HB TYR 78 6.904 7.755 7.275 568 HB3 TYR 78 1HB TYR 78 6.014 8.649 6.056 569 HD1 TYR 78 HD2 TYR 78 9.411 6.974 6.151 570 HD2 TYR 78 HD1 TYR 78 5.672 7.394 4.130 571 HE1 TYR 78 HE2 TYR 78 10.143 5.390 4.429 572 HE2 TYR 78 HE1 TYR 78 6.394 5.809 2.430 573 HH TYR 78 HH TYR 78 8.861 3.760 2.788 574 H LEU 79 H LEU 79 6.784 11.519 5.467 575 HA LEU 79 HA LEU 79 5.740 12.759 7.917 576 HB2 LEU 79 2HB LEU 79 6.175 13.835 5.099 577 HB3 LEU 79 1HB LEU 79 5.284 14.725 6.326 578 HG LEU 79 HG LEU 79 8.221 13.932 6.506 579 HD11 LEU 79 1HD1 LEU 79 7.862 15.697 4.858 580 HD12 LEU 79 2HD1 LEU 79 8.693 16.327 6.279 581 HD13 LEU 79 3HD1 LEU 79 6.971 16.654 6.046 582 HD21 LEU 79 3HD2 LEU 79 6.524 15.563 8.436 583 HD22 LEU 79 1HD2 LEU 79 8.274 15.333 8.546 584 HD23 LEU 79 2HD2 LEU 79 7.194 13.954 8.732 585 H HIS 80 H HIS 80 3.661 12.471 8.384 586 HA HIS 80 HA HIS 80 1.861 11.053 6.659 587 HB2 HIS 80 2HB HIS 80 1.775 10.747 9.102 588 HB3 HIS 80 1HB HIS 80 1.417 12.458 9.339 589 HD2 HIS 80 HD2 HIS 80 -0.491 9.999 6.870 590 HE1 HIS 80 HE1 HIS 80 -3.162 11.574 9.729 591 HE2 HIS 80 HE2 HIS 80 -2.900 9.958 7.812 592 H VAL 81 H VAL 81 1.289 12.144 4.863 593 HA VAL 81 HA VAL 81 0.728 15.021 4.931 594 HB VAL 81 HB VAL 81 0.763 14.893 2.436 595 HG11 VAL 81 1HG1 VAL 81 3.194 14.451 2.205 596 HG12 VAL 81 2HG1 VAL 81 3.201 13.662 3.784 597 HG13 VAL 81 3HG1 VAL 81 2.842 15.386 3.663 598 HG21 VAL 81 3HG2 VAL 81 1.492 12.800 1.296 599 HG22 VAL 81 1HG2 VAL 81 -0.061 12.584 2.111 600 HG23 VAL 81 2HG2 VAL 81 1.412 11.937 2.836 601 H ALA 82 H ALA 82 -1.033 11.986 4.488 602 HA ALA 82 HA ALA 82 -3.561 13.463 4.457 603 HB1 ALA 82 3HB ALA 82 -4.404 12.361 2.418 604 HB2 ALA 82 1HB ALA 82 -2.837 11.577 2.183 605 HB3 ALA 82 2HB ALA 82 -2.973 13.333 2.064 606 H THR 83 H THR 83 -5.424 12.150 4.849 607 HA THR 83 HA THR 83 -4.968 9.320 5.540 608 HB THR 83 HB THR 83 -6.829 11.223 7.033 609 HG1 THR 83 HG1 THR 83 -5.232 10.399 8.771 610 HG21 THR 83 3HG2 THR 83 -7.733 8.921 6.939 611 HG22 THR 83 1HG2 THR 83 -7.201 9.321 8.574 612 HG23 THR 83 2HG2 THR 83 -6.199 8.292 7.548 613 H LEU 84 H LEU 84 -6.285 8.004 4.452 614 HA LEU 84 HA LEU 84 -8.326 9.100 2.654 615 HB2 LEU 84 2HB LEU 84 -7.199 6.271 2.637 616 HB3 LEU 84 1HB LEU 84 -7.979 7.137 1.320 617 HG LEU 84 HG LEU 84 -5.195 7.712 2.441 618 HD11 LEU 84 1HD1 LEU 84 -5.253 5.667 1.125 619 HD12 LEU 84 2HD1 LEU 84 -4.337 6.926 0.301 620 HD13 LEU 84 3HD1 LEU 84 -5.976 6.533 -0.234 621 HD21 LEU 84 3HD2 LEU 84 -4.937 9.342 0.601 622 HD22 LEU 84 1HD2 LEU 84 -6.225 9.807 1.711 623 HD23 LEU 84 2HD2 LEU 84 -6.625 9.101 0.144 624 H SER 85 H SER 85 -10.190 9.226 3.790 625 HA SER 85 HA SER 85 -10.950 7.246 5.802 626 HB2 SER 85 2HB SER 85 -12.241 9.912 5.066 627 HB3 SER 85 1HB SER 85 -12.600 8.933 6.493 628 HG SER 85 HG SER 85 -11.164 10.506 7.100 629 H PHE 86 H PHE 86 -12.615 5.833 5.572 630 HA PHE 86 HA PHE 86 -14.671 5.973 3.558 631 HB2 PHE 86 2HB PHE 86 -13.987 3.921 2.300 632 HB3 PHE 86 1HB PHE 86 -12.819 5.218 2.109 633 HD1 PHE 86 HD1 PHE 86 -10.599 5.098 3.296 634 HD2 PHE 86 HD2 PHE 86 -13.344 1.813 3.342 635 HE1 PHE 86 HE1 PHE 86 -8.801 3.601 4.034 636 HE2 PHE 86 HE2 PHE 86 -11.537 0.329 4.086 637 HZ PHE 86 HZ PHE 86 -9.264 1.220 4.434 638 H ASP 87 H ASP 87 -15.621 3.479 3.467 639 HA ASP 87 HA ASP 87 -15.464 2.264 6.171 640 HB2 ASP 87 2HB ASP 87 -17.834 1.803 6.241 641 HB3 ASP 87 1HB ASP 87 -17.656 3.515 5.882 642 H LEU 88 H LEU 88 -15.776 -0.026 6.192 643 HA LEU 88 HA LEU 88 -15.919 -1.536 3.735 644 HB2 LEU 88 2HB LEU 88 -13.477 -0.902 3.919 645 HB3 LEU 88 1HB LEU 88 -13.417 -1.700 5.482 646 HG LEU 88 HG LEU 88 -13.945 -3.890 4.359 647 HD11 LEU 88 1HD1 LEU 88 -15.160 -3.067 2.408 648 HD12 LEU 88 2HD1 LEU 88 -13.819 -4.098 1.915 649 HD13 LEU 88 3HD1 LEU 88 -13.684 -2.343 1.763 650 HD21 LEU 88 3HD2 LEU 88 -11.736 -4.244 3.341 651 HD22 LEU 88 1HD2 LEU 88 -11.612 -3.298 4.825 652 HD23 LEU 88 2HD2 LEU 88 -11.481 -2.497 3.257 653 H ASP 89 H ASP 89 -16.882 -3.436 4.125 654 HA ASP 89 HA ASP 89 -17.762 -5.283 5.070 655 HB2 ASP 89 2HB ASP 89 -15.568 -5.731 6.095 656 HB3 ASP 89 1HB ASP 89 -15.954 -4.663 7.445 657 H GLY 90 H GLY 90 -17.392 -3.268 8.001 658 HA2 GLY 90 2HA GLY 90 -20.122 -2.401 8.054 659 HA3 GLY 90 1HA GLY 90 -19.832 -3.715 9.196 660 H GLU 91 H GLU 91 -17.268 -1.545 8.418 661 HA GLU 91 HA GLU 91 -17.579 0.052 10.869 662 HB2 GLU 91 2HB GLU 91 -15.205 -0.561 11.527 663 HB3 GLU 91 1HB GLU 91 -16.375 -1.872 11.667 664 HG2 GLU 91 2HG GLU 91 -15.577 -2.717 9.417 665 HG3 GLU 91 1HG GLU 91 -14.293 -1.507 9.488 666 H SER 92 H SER 92 -16.527 1.989 10.850 667 HA SER 92 HA SER 92 -15.874 3.156 8.295 668 HB2 SER 92 2HB SER 92 -17.149 4.441 9.989 669 HB3 SER 92 1HB SER 92 -15.801 4.322 11.120 670 HG SER 92 HG SER 92 -16.208 6.194 9.363 671 H ARG 93 H ARG 93 -13.923 2.633 7.454 672 HA ARG 93 HA ARG 93 -11.554 2.335 9.209 673 HB2 ARG 93 2HB ARG 93 -12.047 1.280 6.398 674 HB3 ARG 93 1HB ARG 93 -10.562 1.048 7.313 675 HG2 ARG 93 2HG ARG 93 -13.299 -0.061 8.038 676 HG3 ARG 93 1HG ARG 93 -11.967 -0.966 7.317 677 HD2 ARG 93 2HD ARG 93 -11.781 -1.537 9.576 678 HD3 ARG 93 1HD ARG 93 -10.628 -0.205 9.455 679 HE ARG 93 HE ARG 93 -13.293 0.604 10.211 680 HH11 ARG 93 1HH1 ARG 93 -10.245 -0.590 11.501 681 HH12 ARG 93 2HH1 ARG 93 -10.532 0.055 13.081 682 HH21 ARG 93 1HH2 ARG 93 -13.619 1.484 12.264 683 HH22 ARG 93 2HH2 ARG 93 -12.443 1.229 13.512 684 H ASP 94 H ASP 94 -9.697 3.480 8.811 685 HA ASP 94 HA ASP 94 -9.509 5.175 6.400 686 HB2 ASP 94 2HB ASP 94 -8.735 7.101 7.654 687 HB3 ASP 94 1HB ASP 94 -10.273 6.597 8.334 688 H LEU 95 H LEU 95 -7.464 5.442 5.587 689 HA LEU 95 HA LEU 95 -5.247 3.883 6.811 690 HB2 LEU 95 2HB LEU 95 -5.773 4.351 3.844 691 HB3 LEU 95 1HB LEU 95 -4.369 3.525 4.510 692 HG LEU 95 HG LEU 95 -7.252 2.558 4.474 693 HD11 LEU 95 1HD1 LEU 95 -4.719 1.373 3.307 694 HD12 LEU 95 2HD1 LEU 95 -6.009 2.188 2.417 695 HD13 LEU 95 3HD1 LEU 95 -6.335 0.659 3.228 696 HD21 LEU 95 3HD2 LEU 95 -6.518 0.549 5.710 697 HD22 LEU 95 1HD2 LEU 95 -6.375 2.009 6.686 698 HD23 LEU 95 2HD2 LEU 95 -4.933 1.286 5.971 699 H HIS 96 H HIS 96 -3.295 4.907 7.018 700 HA HIS 96 HA HIS 96 -3.302 7.810 6.601 701 HB2 HIS 96 2HB HIS 96 -1.550 5.993 8.302 702 HB3 HIS 96 1HB HIS 96 -1.245 7.718 8.108 703 HD2 HIS 96 HD2 HIS 96 -4.461 5.657 9.196 704 HE1 HIS 96 HE1 HIS 96 -4.027 9.104 11.593 705 HE2 HIS 96 HE2 HIS 96 -5.585 7.248 10.887 706 H ALA 97 H ALA 97 -2.200 8.699 5.022 707 HA ALA 97 HA ALA 97 -0.426 7.113 3.292 708 HB1 ALA 97 3HB ALA 97 -2.460 8.003 2.195 709 HB2 ALA 97 1HB ALA 97 -1.004 8.744 1.520 710 HB3 ALA 97 2HB ALA 97 -2.005 9.642 2.665 711 H PHE 98 H PHE 98 1.688 7.580 3.363 712 HA PHE 98 HA PHE 98 2.596 10.290 4.101 713 HB2 PHE 98 2HB PHE 98 4.443 8.157 5.029 714 HB3 PHE 98 1HB PHE 98 3.909 9.601 5.849 715 HD1 PHE 98 HD2 PHE 98 2.694 6.156 4.954 716 HD2 PHE 98 HD1 PHE 98 2.668 9.320 7.824 717 HE1 PHE 98 HE2 PHE 98 1.503 4.716 6.548 718 HE2 PHE 98 HE1 PHE 98 1.481 7.872 9.404 719 HZ PHE 98 HZ PHE 98 0.903 5.568 8.770 720 H ARG 99 H ARG 99 5.048 10.372 3.702 721 HA ARG 99 HA ARG 99 6.252 8.736 1.681 722 HB2 ARG 99 2HB ARG 99 6.564 10.482 -0.021 723 HB3 ARG 99 1HB ARG 99 4.852 10.183 0.246 724 HG2 ARG 99 2HG ARG 99 5.440 12.337 1.996 725 HG3 ARG 99 1HG ARG 99 6.383 12.684 0.543 726 HD2 ARG 99 2HD ARG 99 3.388 12.270 0.754 727 HD3 ARG 99 1HD ARG 99 4.245 13.752 0.327 728 HE ARG 99 HE ARG 99 4.850 11.654 -1.511 729 HH11 ARG 99 1HH1 ARG 99 2.309 13.957 -0.734 730 HH12 ARG 99 2HH1 ARG 99 1.671 13.961 -2.340 731 HH21 ARG 99 1HH2 ARG 99 3.984 11.639 -3.578 732 HH22 ARG 99 2HH2 ARG 99 2.623 12.644 -3.954 733 H GLN 100 H GLN 100 8.561 9.535 1.312 734 HA GLN 100 HA GLN 100 9.761 9.515 3.811 735 HB2 GLN 100 2HB GLN 100 11.105 10.454 1.241 736 HB3 GLN 100 1HB GLN 100 11.910 9.822 2.678 737 HG2 GLN 100 2HG GLN 100 10.816 7.631 2.305 738 HG3 GLN 100 1HG GLN 100 10.051 8.271 0.850 739 HE21 GLN 100 1HE2 GLN 100 13.398 8.871 1.909 740 HE22 GLN 100 2HE2 GLN 100 14.136 8.065 0.573 741 H ALA 101 H ALA 101 10.457 12.308 1.618 742 HA ALA 101 HA ALA 101 10.056 14.123 3.936 743 HB1 ALA 101 3HB ALA 101 11.982 14.490 1.619 744 HB2 ALA 101 1HB ALA 101 12.416 14.009 3.258 745 HB3 ALA 101 2HB ALA 101 11.746 15.613 2.962 746 H ALA 102 H ALA 102 10.369 14.649 0.419 747 HA ALA 102 HA ALA 102 7.915 16.300 0.465 748 HB1 ALA 102 3HB ALA 102 9.160 18.071 -0.700 749 HB2 ALA 102 1HB ALA 102 10.632 17.094 -0.638 750 HB3 ALA 102 2HB ALA 102 9.908 17.697 0.855 751 H ASP 103 H ASP 103 7.906 13.709 -0.603 752 HA ASP 103 HA ASP 103 8.676 13.508 -3.322 753 HB2 ASP 103 2HB ASP 103 8.230 11.489 -1.967 754 HB3 ASP 103 1HB ASP 103 6.549 11.966 -1.769 755 H GLU 104 H GLU 104 7.628 13.990 -5.162 756 HA GLU 104 HA GLU 104 4.853 14.988 -5.135 757 HB2 GLU 104 2HB GLU 104 5.510 16.709 -6.808 758 HB3 GLU 104 1HB GLU 104 6.274 16.952 -5.241 759 HG2 GLU 104 2HG GLU 104 8.375 15.983 -6.100 760 HG3 GLU 104 1HG GLU 104 7.621 15.721 -7.675 761 H SER 105 H SER 105 6.657 12.539 -6.004 762 HA SER 105 HA SER 105 5.882 12.150 -8.779 763 HB2 SER 105 2HB SER 105 8.065 11.332 -7.879 764 HB3 SER 105 1HB SER 105 7.205 10.266 -6.769 765 HG SER 105 HG SER 105 6.745 8.949 -8.372 766 H ARG 106 H ARG 106 4.010 12.329 -6.241 767 HA ARG 106 HA ARG 106 1.893 11.766 -5.766 768 HB2 ARG 106 2HB ARG 106 1.960 10.073 -8.297 769 HB3 ARG 106 1HB ARG 106 0.501 10.538 -7.421 770 HG2 ARG 106 2HG ARG 106 2.411 12.415 -8.876 771 HG3 ARG 106 1HG ARG 106 0.819 11.907 -9.450 772 HD2 ARG 106 2HD ARG 106 -0.268 13.096 -7.635 773 HD3 ARG 106 1HD ARG 106 1.289 13.469 -6.882 774 HE ARG 106 HE ARG 106 0.468 14.525 -9.534 775 HH11 ARG 106 1HH1 ARG 106 1.951 15.034 -6.392 776 HH12 ARG 106 2HH1 ARG 106 2.362 16.685 -6.708 777 HH21 ARG 106 1HH2 ARG 106 1.009 16.714 -9.913 778 HH22 ARG 106 2HH2 ARG 106 1.831 17.629 -8.694 779 H THR 107 H THR 107 4.327 10.004 -5.103 780 HA THR 107 HA THR 107 3.278 7.306 -4.933 781 HB THR 107 HB THR 107 5.957 8.473 -4.049 782 HG1 THR 107 HG1 THR 107 4.966 7.495 -6.494 783 HG21 THR 107 3HG2 THR 107 5.160 5.571 -4.520 784 HG22 THR 107 1HG2 THR 107 5.466 6.304 -2.938 785 HG23 THR 107 2HG2 THR 107 6.776 6.148 -4.108 786 H LEU 108 H LEU 108 1.730 7.202 -3.419 787 HA LEU 108 HA LEU 108 2.187 8.220 -0.669 788 HB2 LEU 108 2HB LEU 108 -0.410 7.421 -2.062 789 HB3 LEU 108 1HB LEU 108 -0.280 8.013 -0.407 790 HG LEU 108 HG LEU 108 0.393 9.616 -2.910 791 HD11 LEU 108 1HD1 LEU 108 -2.010 9.250 -2.676 792 HD12 LEU 108 2HD1 LEU 108 -1.588 10.938 -2.404 793 HD13 LEU 108 3HD1 LEU 108 -1.966 9.892 -1.031 794 HD21 LEU 108 3HD2 LEU 108 0.409 10.470 0.009 795 HD22 LEU 108 1HD2 LEU 108 0.631 11.542 -1.378 796 HD23 LEU 108 2HD2 LEU 108 1.817 10.287 -1.040 797 H PHE 109 H PHE 109 2.572 6.734 0.860 798 HA PHE 109 HA PHE 109 2.233 3.868 0.211 799 HB2 PHE 109 2HB PHE 109 4.575 4.631 0.574 800 HB3 PHE 109 1HB PHE 109 4.138 5.225 2.170 801 HD1 PHE 109 HD1 PHE 109 3.548 1.973 0.323 802 HD2 PHE 109 HD2 PHE 109 5.100 3.884 3.842 803 HE1 PHE 109 HE1 PHE 109 4.159 -0.221 1.262 804 HE2 PHE 109 HE2 PHE 109 5.697 1.685 4.761 805 HZ PHE 109 HZ PHE 109 5.231 -0.365 3.476 806 H VAL 110 H VAL 110 0.444 3.074 1.141 807 HA VAL 110 HA VAL 110 -0.246 3.805 3.921 808 HB VAL 110 HB VAL 110 -2.606 3.079 3.447 809 HG11 VAL 110 1HG1 VAL 110 -1.634 5.351 1.682 810 HG12 VAL 110 2HG1 VAL 110 -2.031 5.461 3.396 811 HG13 VAL 110 3HG1 VAL 110 -3.300 5.106 2.224 812 HG21 VAL 110 3HG2 VAL 110 -1.756 3.012 0.527 813 HG22 VAL 110 1HG2 VAL 110 -3.421 2.901 1.113 814 HG23 VAL 110 2HG2 VAL 110 -2.261 1.629 1.496 815 HA PRO 111 HA PRO 111 0.739 -0.677 4.388 816 HB2 PRO 111 2HB PRO 111 2.079 -0.478 6.757 817 HB3 PRO 111 1HB PRO 111 2.888 -0.160 5.204 818 HG2 PRO 111 2HG PRO 111 1.835 1.810 7.217 819 HG3 PRO 111 1HG PRO 111 3.331 1.869 6.256 820 HD2 PRO 111 2HD PRO 111 1.006 3.244 5.592 821 HD3 PRO 111 1HD PRO 111 2.266 2.800 4.422 822 H PHE 112 H PHE 112 -0.894 -1.866 5.244 823 HA PHE 112 HA PHE 112 -2.232 -0.995 7.697 824 HB2 PHE 112 2HB PHE 112 -4.452 -1.400 6.828 825 HB3 PHE 112 1HB PHE 112 -3.641 -0.218 5.823 826 HD1 PHE 112 HD1 PHE 112 -2.748 -0.969 3.521 827 HD2 PHE 112 HD2 PHE 112 -5.387 -3.383 5.885 828 HE1 PHE 112 HE1 PHE 112 -3.417 -2.236 1.519 829 HE2 PHE 112 HE2 PHE 112 -6.033 -4.638 3.876 830 HZ PHE 112 HZ PHE 112 -5.055 -4.064 1.691 831 H ARG 113 H ARG 113 -3.787 -2.814 8.437 832 HA ARG 113 HA ARG 113 -2.779 -5.527 7.934 833 HB2 ARG 113 2HB ARG 113 -2.605 -4.061 10.589 834 HB3 ARG 113 1HB ARG 113 -2.798 -5.809 10.569 835 HG2 ARG 113 2HG ARG 113 -0.676 -6.043 9.339 836 HG3 ARG 113 1HG ARG 113 -0.478 -4.286 9.326 837 HD2 ARG 113 2HD ARG 113 -0.040 -4.191 11.629 838 HD3 ARG 113 1HD ARG 113 -0.848 -5.724 11.956 839 HE ARG 113 HE ARG 113 1.477 -6.139 10.367 840 HH11 ARG 113 1HH1 ARG 113 0.509 -5.368 13.651 841 HH12 ARG 113 2HH1 ARG 113 1.916 -6.078 14.370 842 HH21 ARG 113 1HH2 ARG 113 3.284 -7.155 11.351 843 HH22 ARG 113 2HH2 ARG 113 3.475 -7.081 13.072 844 H ASP 114 H ASP 114 -4.394 -7.028 8.091 845 HA ASP 114 HA ASP 114 -7.043 -6.173 9.104 846 HB2 ASP 114 2HB ASP 114 -8.083 -7.301 7.252 847 HB3 ASP 114 1HB ASP 114 -6.837 -6.267 6.573 848 H LYS 115 H LYS 115 -8.234 -8.792 8.766 849 HA LYS 115 HA LYS 115 -7.188 -10.001 11.191 850 HB2 LYS 115 2HB LYS 115 -9.654 -10.684 9.555 851 HB3 LYS 115 1HB LYS 115 -9.192 -11.523 11.032 852 HG2 LYS 115 2HG LYS 115 -9.935 -8.585 10.814 853 HG3 LYS 115 1HG LYS 115 -10.973 -9.869 11.419 854 HD2 LYS 115 2HD LYS 115 -10.233 -8.989 13.428 855 HD3 LYS 115 1HD LYS 115 -8.987 -10.208 13.179 856 HE2 LYS 115 2HE LYS 115 -7.456 -8.468 12.321 857 HE3 LYS 115 1HE LYS 115 -8.728 -7.257 12.480 858 HZ1 LYS 115 3HZ LYS 115 -7.150 -7.200 14.310 859 HZ2 LYS 115 1HZ LYS 115 -7.542 -8.790 14.725 860 HZ3 LYS 115 2HZ LYS 115 -8.704 -7.572 14.854 861 H THR 116 H THR 116 -6.713 -10.644 7.819 862 HA THR 116 HA THR 116 -5.959 -13.407 8.145 863 HB THR 116 HB THR 116 -4.864 -13.310 5.963 864 HG1 THR 116 HG1 THR 116 -5.354 -10.502 5.927 865 HG21 THR 116 3HG2 THR 116 -7.323 -13.510 5.931 866 HG22 THR 116 1HG2 THR 116 -6.753 -12.598 4.529 867 HG23 THR 116 2HG2 THR 116 -7.473 -11.750 5.897 868 H THR 117 H THR 117 -4.433 -10.329 8.743 869 HA THR 117 HA THR 117 -1.713 -11.177 8.766 870 HB THR 117 HB THR 117 -2.958 -8.781 10.195 871 HG1 THR 117 HG1 THR 117 -2.196 -9.199 7.507 872 HG21 THR 117 3HG2 THR 117 -0.640 -9.270 10.943 873 HG22 THR 117 1HG2 THR 117 -0.706 -7.776 10.012 874 HG23 THR 117 2HG2 THR 117 -0.089 -9.249 9.265 875 H GLY 118 H GLY 118 -0.612 -12.185 10.354 876 HA2 GLY 118 2HA GLY 118 -0.020 -13.219 12.290 877 HA3 GLY 118 1HA GLY 118 -1.095 -12.106 13.124 878 H GLN 119 H GLN 119 -2.940 -13.820 10.851 879 HA GLN 119 HA GLN 119 -3.689 -15.947 12.783 880 HB2 GLN 119 2HB GLN 119 -5.578 -14.164 11.187 881 HB3 GLN 119 1HB GLN 119 -6.090 -15.618 12.031 882 HG2 GLN 119 2HG GLN 119 -4.912 -13.148 13.351 883 HG3 GLN 119 1HG GLN 119 -6.627 -13.557 13.282 884 HE21 GLN 119 1HE2 GLN 119 -3.613 -14.171 14.862 885 HE22 GLN 119 2HE2 GLN 119 -4.213 -15.267 16.053 886 H GLN 120 H GLN 120 -4.784 -15.016 9.491 887 HA GLN 120 HA GLN 120 -4.396 -17.696 8.401 888 HB2 GLN 120 2HB GLN 120 -5.386 -15.097 7.160 889 HB3 GLN 120 1HB GLN 120 -5.209 -16.581 6.242 890 HG2 GLN 120 2HG GLN 120 -7.532 -16.234 6.833 891 HG3 GLN 120 1HG GLN 120 -6.915 -17.667 7.641 892 HE21 GLN 120 1HE2 GLN 120 -7.969 -14.359 8.090 893 HE22 GLN 120 2HE2 GLN 120 -8.208 -14.456 9.799 894 H SER 121 H SER 121 -2.152 -15.891 9.289 895 HA SER 121 HA SER 121 -0.200 -16.313 7.264 896 HB2 SER 121 2HB SER 121 -0.911 -13.412 7.979 897 HB3 SER 121 1HB SER 121 0.455 -13.926 6.982 898 HG SER 121 HG SER 121 -1.530 -15.008 5.819 899 H TYR 122 H TYR 122 1.810 -16.485 8.383 900 HA TYR 122 HA TYR 122 1.997 -16.539 11.177 901 HB2 TYR 122 2HB TYR 122 3.750 -17.567 9.796 902 HB3 TYR 122 1HB TYR 122 4.191 -16.005 9.108 903 HD1 TYR 122 HD2 TYR 122 4.105 -17.901 12.363 904 HD2 TYR 122 HD1 TYR 122 5.892 -14.669 10.177 905 HE1 TYR 122 HE2 TYR 122 5.723 -17.554 14.176 906 HE2 TYR 122 HE1 TYR 122 7.500 -14.337 12.005 907 HH TYR 122 HH TYR 122 7.882 -16.584 14.553 908 H ASP 123 H ASP 123 3.134 -14.040 9.012 909 HA ASP 123 HA ASP 123 2.141 -11.941 10.857 910 HB2 ASP 123 2HB ASP 123 4.558 -11.740 10.868 911 HB3 ASP 123 1HB ASP 123 4.626 -11.759 9.107 912 H GLY 124 H GLY 124 3.344 -11.765 7.489 913 HA2 GLY 124 2HA GLY 124 2.335 -11.130 5.542 914 HA3 GLY 124 1HA GLY 124 0.869 -11.877 6.165 915 H GLY 125 H GLY 125 2.846 -9.006 6.860 916 HA2 GLY 125 2HA GLY 125 0.655 -7.256 7.452 917 HA3 GLY 125 1HA GLY 125 2.292 -6.750 7.050 918 H ARG 126 H ARG 126 -0.217 -5.505 6.091 919 HA ARG 126 HA ARG 126 -0.219 -6.272 3.218 920 HB2 ARG 126 2HB ARG 126 -2.189 -4.449 4.660 921 HB3 ARG 126 1HB ARG 126 -2.360 -5.164 3.059 922 HG2 ARG 126 2HG ARG 126 -2.294 -6.804 5.617 923 HG3 ARG 126 1HG ARG 126 -3.778 -6.161 4.915 924 HD2 ARG 126 2HD ARG 126 -3.617 -8.437 4.227 925 HD3 ARG 126 1HD ARG 126 -3.251 -7.458 2.813 926 HE ARG 126 HE ARG 126 -0.839 -7.955 3.319 927 HH11 ARG 126 1HH1 ARG 126 -3.320 -10.222 4.401 928 HH12 ARG 126 2HH1 ARG 126 -2.231 -11.573 4.385 929 HH21 ARG 126 1HH2 ARG 126 0.540 -9.723 3.310 930 HH22 ARG 126 2HH2 ARG 126 -0.057 -11.289 3.767 931 H TYR 127 H TYR 127 0.808 -4.926 1.852 932 HA TYR 127 HA TYR 127 1.484 -2.158 2.678 933 HB2 TYR 127 2HB TYR 127 2.995 -4.067 0.813 934 HB3 TYR 127 1HB TYR 127 3.454 -2.398 1.123 935 HD1 TYR 127 HD2 TYR 127 2.528 -5.277 3.384 936 HD2 TYR 127 HD1 TYR 127 5.448 -2.342 2.371 937 HE1 TYR 127 HE2 TYR 127 3.888 -6.023 5.248 938 HE2 TYR 127 HE1 TYR 127 6.841 -3.114 4.250 939 HH TYR 127 HH TYR 127 6.621 -4.322 6.353 940 H MET 128 H MET 128 0.630 -0.603 1.359 941 HA MET 128 HA MET 128 -0.303 -1.324 -1.344 942 HB2 MET 128 2HB MET 128 -2.058 -0.971 0.946 943 HB3 MET 128 1HB MET 128 -2.280 0.423 -0.104 944 HG2 MET 128 2HG MET 128 -2.474 -2.417 -1.113 945 HG3 MET 128 1HG MET 128 -3.859 -1.500 -0.517 946 HE1 MET 128 3HE MET 128 -4.290 1.319 -3.125 947 HE2 MET 128 1HE MET 128 -3.461 1.435 -1.572 948 HE3 MET 128 2HE MET 128 -4.958 0.506 -1.708 949 H GLU 129 H GLU 129 -0.100 0.335 -2.814 950 HA GLU 129 HA GLU 129 0.798 2.981 -1.855 951 HB2 GLU 129 2HB GLU 129 2.784 1.534 -2.392 952 HB3 GLU 129 1HB GLU 129 2.182 1.365 -4.038 953 HG2 GLU 129 2HG GLU 129 2.315 3.905 -4.213 954 HG3 GLU 129 1HG GLU 129 3.177 3.884 -2.677 955 H LEU 130 H LEU 130 -0.168 4.587 -2.929 956 HA LEU 130 HA LEU 130 -1.641 4.022 -5.444 957 HB2 LEU 130 2HB LEU 130 -2.414 6.331 -3.635 958 HB3 LEU 130 1HB LEU 130 -3.369 5.489 -4.843 959 HG LEU 130 HG LEU 130 -3.201 3.464 -3.116 960 HD11 LEU 130 1HD1 LEU 130 -2.777 5.837 -1.277 961 HD12 LEU 130 2HD1 LEU 130 -1.629 4.525 -1.572 962 HD13 LEU 130 3HD1 LEU 130 -3.164 4.186 -0.774 963 HD21 LEU 130 3HD2 LEU 130 -5.299 4.155 -2.096 964 HD22 LEU 130 1HD2 LEU 130 -5.290 4.550 -3.813 965 HD23 LEU 130 2HD2 LEU 130 -5.035 5.822 -2.615 966 H GLU 131 H GLU 131 -1.159 5.290 -7.125 967 HA GLU 131 HA GLU 131 0.313 7.816 -6.720 968 HB2 GLU 131 2HB GLU 131 0.874 5.773 -8.913 969 HB3 GLU 131 1HB GLU 131 1.606 7.374 -8.787 970 HG2 GLU 131 2HG GLU 131 2.633 6.710 -6.620 971 HG3 GLU 131 1HG GLU 131 1.944 5.096 -6.806 972 HA PRO 132 HA PRO 132 -3.624 8.751 -9.001 973 HB2 PRO 132 2HB PRO 132 -3.820 11.325 -7.993 974 HB3 PRO 132 1HB PRO 132 -4.429 9.900 -7.122 975 HG2 PRO 132 2HG PRO 132 -1.798 11.331 -6.777 976 HG3 PRO 132 1HG PRO 132 -2.950 10.801 -5.532 977 HD2 PRO 132 2HD PRO 132 -0.762 9.343 -6.077 978 HD3 PRO 132 1HD PRO 132 -2.304 8.540 -5.703 979 H ASP 133 H ASP 133 -4.037 10.527 -10.565 980 HA ASP 133 HA ASP 133 -1.830 11.139 -12.253 981 HB2 ASP 133 2HB ASP 133 -4.050 10.918 -13.233 982 HB3 ASP 133 1HB ASP 133 -4.705 12.152 -12.162 983 H ARG 134 H ARG 134 -3.977 13.276 -10.376 984 HA ARG 134 HA ARG 134 -1.845 15.313 -10.184 985 HB2 ARG 134 2HB ARG 134 -3.709 16.895 -9.698 986 HB3 ARG 134 1HB ARG 134 -3.869 16.108 -11.256 987 HG2 ARG 134 2HG ARG 134 -6.058 15.969 -10.542 988 HG3 ARG 134 1HG ARG 134 -5.454 14.440 -9.912 989 HD2 ARG 134 2HD ARG 134 -5.188 15.451 -7.683 990 HD3 ARG 134 1HD ARG 134 -5.723 17.014 -8.303 991 HE ARG 134 HE ARG 134 -7.349 14.872 -7.418 992 HH11 ARG 134 1HH1 ARG 134 -7.326 17.403 -9.894 993 HH12 ARG 134 2HH1 ARG 134 -9.057 17.441 -10.017 994 HH21 ARG 134 1HH2 ARG 134 -9.589 15.019 -7.561 995 HH22 ARG 134 2HH2 ARG 134 -10.324 16.099 -8.701 996 H ASP 135 H ASP 135 -2.187 16.688 -8.057 997 HA ASP 135 HA ASP 135 -1.532 14.888 -5.883 998 HB2 ASP 135 2HB ASP 135 -0.192 16.927 -6.151 999 HB3 ASP 135 1HB ASP 135 -1.630 17.937 -6.007 1000 H LEU 136 H LEU 136 -2.755 14.466 -4.103 1001 HA LEU 136 HA LEU 136 -5.606 14.923 -4.285 1002 HB2 LEU 136 2HB LEU 136 -3.934 13.448 -2.213 1003 HB3 LEU 136 1HB LEU 136 -5.694 13.476 -2.246 1004 HG LEU 136 HG LEU 136 -3.902 12.247 -4.387 1005 HD11 LEU 136 1HD1 LEU 136 -5.716 10.888 -2.377 1006 HD12 LEU 136 2HD1 LEU 136 -3.956 10.957 -2.290 1007 HD13 LEU 136 3HD1 LEU 136 -4.735 10.102 -3.618 1008 HD21 LEU 136 3HD2 LEU 136 -6.009 11.390 -5.372 1009 HD22 LEU 136 1HD2 LEU 136 -5.931 13.151 -5.407 1010 HD23 LEU 136 2HD2 LEU 136 -6.937 12.338 -4.204 1011 H SER 137 H SER 137 -6.713 16.434 -3.264 1012 HA SER 137 HA SER 137 -5.411 18.293 -1.391 1013 HB2 SER 137 2HB SER 137 -8.065 18.488 -2.886 1014 HB3 SER 137 1HB SER 137 -7.329 19.773 -1.924 1015 HG SER 137 HG SER 137 -6.004 20.202 -3.501 1016 H ASP 138 H ASP 138 -6.713 19.042 0.490 1017 HA ASP 138 HA ASP 138 -7.973 16.932 1.963 1018 HB2 ASP 138 2HB ASP 138 -8.493 18.729 3.656 1019 HB3 ASP 138 1HB ASP 138 -6.793 18.604 3.239 1020 H GLY 139 H GLY 139 -9.887 16.161 1.389 1021 HA2 GLY 139 2HA GLY 139 -12.280 16.349 1.304 1022 HA3 GLY 139 1HA GLY 139 -12.114 17.946 0.590 1023 H ASP 140 H ASP 140 -9.796 16.136 -0.875 1024 HA ASP 140 HA ASP 140 -11.241 15.784 -3.359 1025 HB2 ASP 140 2HB ASP 140 -8.671 16.360 -2.913 1026 HB3 ASP 140 1HB ASP 140 -8.481 14.622 -2.808 1027 H GLU 141 H GLU 141 -11.034 13.481 -4.494 1028 HA GLU 141 HA GLU 141 -11.442 11.292 -2.534 1029 HB2 GLU 141 2HB GLU 141 -12.658 11.603 -5.307 1030 HB3 GLU 141 1HB GLU 141 -12.958 10.260 -4.197 1031 HG2 GLU 141 2HG GLU 141 -13.990 11.849 -2.589 1032 HG3 GLU 141 1HG GLU 141 -13.716 13.174 -3.721 1033 H ILE 142 H ILE 142 -10.846 9.138 -3.303 1034 HA ILE 142 HA ILE 142 -8.827 8.885 -5.382 1035 HB ILE 142 HB ILE 142 -7.468 9.751 -3.530 1036 HG12 ILE 142 2HG1 ILE 142 -5.833 7.841 -3.183 1037 HG13 ILE 142 1HG1 ILE 142 -7.012 6.748 -3.900 1038 HG21 ILE 142 1HG2 ILE 142 -8.600 7.515 -1.816 1039 HG22 ILE 142 2HG2 ILE 142 -8.912 9.240 -1.633 1040 HG23 ILE 142 3HG2 ILE 142 -7.295 8.599 -1.336 1041 HD11 ILE 142 3HD1 ILE 142 -5.678 9.070 -5.302 1042 HD12 ILE 142 1HD1 ILE 142 -6.838 7.949 -6.024 1043 HD13 ILE 142 2HD1 ILE 142 -5.266 7.364 -5.478 1044 H THR 143 H THR 143 -8.583 6.776 -6.045 1045 HA THR 143 HA THR 143 -10.555 4.806 -5.304 1046 HB THR 143 HB THR 143 -8.214 4.661 -7.257 1047 HG1 THR 143 HG1 THR 143 -10.670 5.869 -7.393 1048 HG21 THR 143 3HG2 THR 143 -9.005 2.407 -6.660 1049 HG22 THR 143 1HG2 THR 143 -9.473 2.802 -8.316 1050 HG23 THR 143 2HG2 THR 143 -10.668 2.880 -7.018 1051 H LEU 144 H LEU 144 -10.235 3.163 -3.811 1052 HA LEU 144 HA LEU 144 -7.509 2.545 -2.843 1053 HB2 LEU 144 2HB LEU 144 -10.101 2.959 -1.363 1054 HB3 LEU 144 1HB LEU 144 -9.065 1.686 -0.769 1055 HG LEU 144 HG LEU 144 -8.764 3.797 0.482 1056 HD11 LEU 144 1HD1 LEU 144 -6.298 2.970 -1.083 1057 HD12 LEU 144 2HD1 LEU 144 -6.908 2.206 0.387 1058 HD13 LEU 144 3HD1 LEU 144 -6.310 3.862 0.442 1059 HD21 LEU 144 3HD2 LEU 144 -7.702 5.738 -0.534 1060 HD22 LEU 144 1HD2 LEU 144 -9.223 5.376 -1.347 1061 HD23 LEU 144 2HD2 LEU 144 -7.691 4.945 -2.111 1062 H ASP 145 H ASP 145 -7.173 0.858 -4.306 1063 HA ASP 145 HA ASP 145 -8.946 -1.500 -4.118 1064 HB2 ASP 145 2HB ASP 145 -8.233 -0.575 -6.414 1065 HB3 ASP 145 1HB ASP 145 -6.598 -1.103 -6.033 1066 H PHE 146 H PHE 146 -8.367 -2.281 -2.125 1067 HA PHE 146 HA PHE 146 -5.741 -2.603 -1.065 1068 HB2 PHE 146 2HB PHE 146 -8.156 -4.302 -0.328 1069 HB3 PHE 146 1HB PHE 146 -6.775 -3.901 0.695 1070 HD1 PHE 146 HD2 PHE 146 -6.412 -1.106 0.621 1071 HD2 PHE 146 HD1 PHE 146 -10.108 -3.269 0.416 1072 HE1 PHE 146 HE2 PHE 146 -7.623 0.859 1.427 1073 HE2 PHE 146 HE1 PHE 146 -11.297 -1.289 1.231 1074 HZ PHE 146 HZ PHE 146 -10.054 0.766 1.733 1075 H ASN 147 H ASN 147 -7.369 -4.244 -3.446 1076 HA ASN 147 HA ASN 147 -6.216 -6.869 -3.241 1077 HB2 ASN 147 2HB ASN 147 -7.489 -5.746 -5.753 1078 HB3 ASN 147 1HB ASN 147 -7.609 -7.370 -5.082 1079 HD21 ASN 147 1HD2 ASN 147 -9.530 -5.022 -5.833 1080 HD22 ASN 147 2HD2 ASN 147 -10.659 -5.040 -4.528 1081 H LEU 148 H LEU 148 -4.947 -3.898 -4.076 1082 HA LEU 148 HA LEU 148 -2.780 -5.064 -5.712 1083 HB2 LEU 148 2HB LEU 148 -3.298 -2.142 -4.989 1084 HB3 LEU 148 1HB LEU 148 -2.039 -2.730 -6.069 1085 HG LEU 148 HG LEU 148 -5.032 -2.661 -6.552 1086 HD11 LEU 148 1HD1 LEU 148 -3.838 -0.578 -7.013 1087 HD12 LEU 148 2HD1 LEU 148 -4.481 -1.302 -8.482 1088 HD13 LEU 148 3HD1 LEU 148 -2.756 -1.426 -8.123 1089 HD21 LEU 148 3HD2 LEU 148 -4.232 -4.846 -7.292 1090 HD22 LEU 148 1HD2 LEU 148 -2.970 -4.078 -8.265 1091 HD23 LEU 148 2HD2 LEU 148 -4.676 -3.833 -8.653 1092 H ALA 149 H ALA 149 -3.255 -5.593 -2.784 1093 HA ALA 149 HA ALA 149 -1.195 -4.172 -1.364 1094 HB1 ALA 149 3HB ALA 149 -3.119 -5.124 -0.136 1095 HB2 ALA 149 1HB ALA 149 -1.596 -5.772 0.479 1096 HB3 ALA 149 2HB ALA 149 -2.610 -6.756 -0.579 1097 H TYR 150 H TYR 150 0.855 -4.439 -1.735 1098 HA TYR 150 HA TYR 150 1.910 -6.523 -3.417 1099 HB2 TYR 150 2HB TYR 150 3.447 -4.225 -2.110 1100 HB3 TYR 150 1HB TYR 150 3.916 -5.147 -3.536 1101 HD1 TYR 150 HD1 TYR 150 1.961 -5.123 -5.460 1102 HD2 TYR 150 HD2 TYR 150 2.610 -2.045 -2.558 1103 HE1 TYR 150 HE1 TYR 150 0.773 -3.521 -6.878 1104 HE2 TYR 150 HE2 TYR 150 1.436 -0.440 -4.002 1105 HH TYR 150 HH TYR 150 0.812 -0.134 -6.318 1106 H SER 151 H SER 151 3.598 -7.927 -2.923 1107 HA SER 151 HA SER 151 3.709 -9.380 -0.706 1108 HB2 SER 151 2HB SER 151 6.115 -8.734 -2.447 1109 HB3 SER 151 1HB SER 151 5.904 -10.189 -1.463 1110 HG SER 151 HG SER 151 4.236 -10.832 -2.802 1111 HA PRO 152 HA PRO 152 5.418 -6.733 2.531 1112 HB2 PRO 152 2HB PRO 152 5.647 -9.219 4.165 1113 HB3 PRO 152 1HB PRO 152 4.622 -7.797 4.426 1114 HG2 PRO 152 2HG PRO 152 3.587 -10.165 3.692 1115 HG3 PRO 152 1HG PRO 152 2.898 -8.617 3.151 1116 HD2 PRO 152 2HD PRO 152 4.700 -10.501 1.641 1117 HD3 PRO 152 1HD PRO 152 3.252 -9.632 1.076 1118 H PHE 153 H PHE 153 7.582 -6.076 2.164 1119 HA PHE 153 HA PHE 153 9.850 -7.526 2.049 1120 HB2 PHE 153 2HB PHE 153 9.512 -4.923 3.584 1121 HB3 PHE 153 1HB PHE 153 11.041 -5.572 3.005 1122 HD1 PHE 153 HD2 PHE 153 11.552 -5.603 0.561 1123 HD2 PHE 153 HD1 PHE 153 7.996 -3.750 2.077 1124 HE1 PHE 153 HE2 PHE 153 11.278 -4.379 -1.554 1125 HE2 PHE 153 HE1 PHE 153 7.735 -2.532 -0.041 1126 HZ PHE 153 HZ PHE 153 9.375 -2.840 -1.855 1127 H CYS 154 H CYS 154 8.417 -6.347 5.129 1128 HA CYS 154 HA CYS 154 10.354 -7.276 6.883 1129 HB2 CYS 154 2HB CYS 154 8.766 -5.616 7.570 1130 HB3 CYS 154 1HB CYS 154 7.405 -6.698 7.294 1131 HG CYS 154 HG CYS 154 9.727 -6.912 9.764 1132 H ALA 155 H ALA 155 7.177 -8.861 6.256 1133 HA ALA 155 HA ALA 155 7.573 -11.051 7.988 1134 HB1 ALA 155 3HB ALA 155 5.731 -10.896 5.577 1135 HB2 ALA 155 1HB ALA 155 5.345 -10.326 7.204 1136 HB3 ALA 155 2HB ALA 155 5.604 -12.046 6.913 1137 H TYR 156 H TYR 156 8.775 -10.500 4.801 1138 HA TYR 156 HA TYR 156 9.328 -13.370 4.332 1139 HB2 TYR 156 2HB TYR 156 9.119 -10.996 2.440 1140 HB3 TYR 156 1HB TYR 156 9.813 -12.531 1.934 1141 HD1 TYR 156 HD1 TYR 156 6.738 -11.711 3.975 1142 HD2 TYR 156 HD2 TYR 156 8.276 -13.606 0.483 1143 HE1 TYR 156 HE1 TYR 156 4.493 -12.532 3.451 1144 HE2 TYR 156 HE2 TYR 156 6.022 -14.425 -0.052 1145 HH TYR 156 HH TYR 156 3.904 -14.913 1.103 1146 H SER 157 H SER 157 10.915 -10.408 5.209 1147 HA SER 157 HA SER 157 13.462 -11.839 5.340 1148 HB2 SER 157 2HB SER 157 13.106 -9.284 3.724 1149 HB3 SER 157 1HB SER 157 14.676 -9.826 4.316 1150 HG SER 157 HG SER 157 13.064 -11.589 2.858 1151 H ASP 158 H ASP 158 14.379 -11.483 7.211 1152 HA ASP 158 HA ASP 158 13.356 -9.519 9.079 1153 HB2 ASP 158 2HB ASP 158 15.460 -11.703 9.364 1154 HB3 ASP 158 1HB ASP 158 14.996 -10.627 10.684 1155 H THR 159 H THR 159 15.856 -9.474 6.764 1156 HA THR 159 HA THR 159 17.740 -7.781 8.057 1157 HB THR 159 HB THR 159 18.297 -9.012 5.961 1158 HG1 THR 159 HG1 THR 159 19.688 -7.488 5.412 1159 HG21 THR 159 3HG2 THR 159 17.566 -8.179 3.757 1160 HG22 THR 159 1HG2 THR 159 16.524 -6.984 4.536 1161 HG23 THR 159 2HG2 THR 159 16.173 -8.706 4.703 1162 H PHE 160 H PHE 160 14.566 -7.219 6.756 1163 HA PHE 160 HA PHE 160 14.865 -4.298 6.648 1164 HB2 PHE 160 2HB PHE 160 12.478 -6.125 6.070 1165 HB3 PHE 160 1HB PHE 160 12.451 -4.374 5.929 1166 HD1 PHE 160 HD1 PHE 160 13.724 -3.243 4.087 1167 HD2 PHE 160 HD2 PHE 160 13.430 -7.503 4.316 1168 HE1 PHE 160 HE1 PHE 160 14.390 -3.432 1.726 1169 HE2 PHE 160 HE2 PHE 160 14.114 -7.677 1.960 1170 HZ PHE 160 HZ PHE 160 14.593 -5.640 0.662 1171 H SER 161 H SER 161 14.140 -3.049 8.353 1172 HA SER 161 HA SER 161 13.459 -4.240 10.876 1173 HB2 SER 161 2HB SER 161 13.305 -1.317 9.997 1174 HB3 SER 161 1HB SER 161 13.275 -1.897 11.665 1175 HG SER 161 HG SER 161 15.410 -2.946 10.790 1176 H CYS 162 H CYS 162 11.390 -4.413 11.861 1177 HA CYS 162 HA CYS 162 9.109 -4.353 10.067 1178 HB2 CYS 162 2HB CYS 162 9.471 -6.279 11.613 1179 HB3 CYS 162 1HB CYS 162 9.293 -5.200 12.996 1180 HG CYS 162 HG CYS 162 6.927 -6.414 10.899 1181 HA PRO 163 HA PRO 163 8.323 -0.217 11.843 1182 HB2 PRO 163 2HB PRO 163 6.687 0.765 9.924 1183 HB3 PRO 163 1HB PRO 163 8.424 0.535 9.628 1184 HG2 PRO 163 2HG PRO 163 6.124 -1.152 8.717 1185 HG3 PRO 163 1HG PRO 163 7.628 -0.738 7.865 1186 HD2 PRO 163 2HD PRO 163 7.170 -3.146 9.240 1187 HD3 PRO 163 1HD PRO 163 8.765 -2.522 8.774 1188 H LEU 164 H LEU 164 6.836 0.401 13.311 1189 HA LEU 164 HA LEU 164 4.421 -1.087 13.802 1190 HB2 LEU 164 2HB LEU 164 5.369 1.516 15.074 1191 HB3 LEU 164 1HB LEU 164 4.084 0.477 15.676 1192 HG LEU 164 HG LEU 164 7.052 -0.210 15.579 1193 HD11 LEU 164 1HD1 LEU 164 6.937 -0.182 18.031 1194 HD12 LEU 164 2HD1 LEU 164 5.248 0.334 17.951 1195 HD13 LEU 164 3HD1 LEU 164 6.527 1.385 17.336 1196 HD21 LEU 164 3HD2 LEU 164 5.757 -2.237 15.165 1197 HD22 LEU 164 1HD2 LEU 164 4.736 -1.916 16.571 1198 HD23 LEU 164 2HD2 LEU 164 6.448 -2.294 16.783 1199 HA PRO 165 HA PRO 165 2.214 1.752 10.981 1200 HB2 PRO 165 2HB PRO 165 0.076 0.195 10.429 1201 HB3 PRO 165 1HB PRO 165 1.667 -0.181 9.744 1202 HG2 PRO 165 2HG PRO 165 0.280 -1.459 12.087 1203 HG3 PRO 165 1HG PRO 165 1.230 -2.219 10.789 1204 HD2 PRO 165 2HD PRO 165 2.247 -1.625 13.312 1205 HD3 PRO 165 1HD PRO 165 3.243 -1.829 11.858 1206 HA PRO 166 HA PRO 166 -0.123 3.867 14.200 1207 HB2 PRO 166 2HB PRO 166 -2.004 5.155 12.460 1208 HB3 PRO 166 1HB PRO 166 -0.447 5.808 13.003 1209 HG2 PRO 166 2HG PRO 166 -1.119 4.411 10.450 1210 HG3 PRO 166 1HG PRO 166 0.018 5.747 10.740 1211 HD2 PRO 166 2HD PRO 166 0.923 3.258 10.335 1212 HD3 PRO 166 1HD PRO 166 1.715 4.313 11.530 1213 H GLU 167 H GLU 167 -2.060 3.783 15.312 1214 HA GLU 167 HA GLU 167 -3.287 1.276 15.390 1215 HB2 GLU 167 2HB GLU 167 -4.166 3.887 16.683 1216 HB3 GLU 167 1HB GLU 167 -4.753 2.290 17.149 1217 HG2 GLU 167 2HG GLU 167 -2.572 1.628 17.946 1218 HG3 GLU 167 1HG GLU 167 -1.820 3.077 17.275 1219 H SER 168 H SER 168 -4.263 4.182 13.748 1220 HA SER 168 HA SER 168 -7.044 3.593 13.488 1221 HB2 SER 168 2HB SER 168 -5.364 5.605 11.960 1222 HB3 SER 168 1HB SER 168 -7.122 5.625 12.145 1223 HG SER 168 HG SER 168 -6.891 6.502 14.033 1224 H ASN 169 H ASN 169 -4.294 2.438 11.683 1225 HA ASN 169 HA ASN 169 -5.959 2.022 9.249 1226 HB2 ASN 169 2HB ASN 169 -3.872 1.360 8.078 1227 HB3 ASN 169 1HB ASN 169 -3.813 3.002 8.704 1228 HD21 ASN 169 1HD2 ASN 169 -3.115 -0.024 10.539 1229 HD22 ASN 169 2HD2 ASN 169 -1.495 0.409 10.859 1230 H TRP 170 H TRP 170 -5.487 0.501 12.070 1231 HA TRP 170 HA TRP 170 -5.140 -2.242 11.192 1232 HB2 TRP 170 2HB TRP 170 -6.116 -1.157 13.887 1233 HB3 TRP 170 1HB TRP 170 -5.658 -2.825 13.559 1234 HD1 TRP 170 HD1 TRP 170 -2.973 -1.334 11.825 1235 HE1 TRP 170 HE1 TRP 170 -0.935 -0.831 13.309 1236 HE3 TRP 170 HE3 TRP 170 -5.210 -1.648 16.416 1237 HZ2 TRP 170 HZ2 TRP 170 -0.336 -0.626 16.037 1238 HZ3 TRP 170 HZ3 TRP 170 -3.824 -1.293 18.422 1239 HH2 TRP 170 HH2 TRP 170 -1.435 -0.791 18.235 1240 H LEU 171 H LEU 171 -6.734 -3.047 9.948 1241 HA LEU 171 HA LEU 171 -9.517 -2.223 10.212 1242 HB2 LEU 171 2HB LEU 171 -8.454 -4.383 8.347 1243 HB3 LEU 171 1HB LEU 171 -9.912 -3.415 8.176 1244 HG LEU 171 HG LEU 171 -7.035 -2.542 7.692 1245 HD11 LEU 171 1HD1 LEU 171 -9.412 -2.683 5.820 1246 HD12 LEU 171 2HD1 LEU 171 -8.046 -3.802 5.877 1247 HD13 LEU 171 3HD1 LEU 171 -7.784 -2.126 5.408 1248 HD21 LEU 171 3HD2 LEU 171 -7.857 -0.298 7.126 1249 HD22 LEU 171 1HD2 LEU 171 -8.178 -0.681 8.815 1250 HD23 LEU 171 2HD2 LEU 171 -9.488 -0.748 7.634 1251 H GLU 172 H GLU 172 -10.824 -3.305 11.652 1252 HA GLU 172 HA GLU 172 -10.020 -5.887 12.768 1253 HB2 GLU 172 2HB GLU 172 -10.854 -3.902 14.138 1254 HB3 GLU 172 1HB GLU 172 -12.439 -4.142 13.427 1255 HG2 GLU 172 2HG GLU 172 -12.368 -5.081 15.669 1256 HG3 GLU 172 1HG GLU 172 -12.581 -6.369 14.479 1257 H THR 173 H THR 173 -10.418 -6.263 10.214 1258 HA THR 173 HA THR 173 -12.660 -8.018 9.851 1259 HB THR 173 HB THR 173 -13.791 -5.895 9.280 1260 HG1 THR 173 HG1 THR 173 -14.574 -7.400 7.971 1261 HG21 THR 173 3HG2 THR 173 -11.620 -5.472 7.181 1262 HG22 THR 173 1HG2 THR 173 -11.811 -4.518 8.656 1263 HG23 THR 173 2HG2 THR 173 -13.056 -4.470 7.404 1264 H ALA 174 H ALA 174 -12.422 -9.092 7.629 1265 HA ALA 174 HA ALA 174 -9.544 -9.432 7.060 1266 HB1 ALA 174 3HB ALA 174 -11.885 -11.212 6.311 1267 HB2 ALA 174 1HB ALA 174 -10.797 -11.450 7.680 1268 HB3 ALA 174 2HB ALA 174 -10.177 -11.569 6.031 1269 H VAL 175 H VAL 175 -8.684 -8.926 5.134 1270 HA VAL 175 HA VAL 175 -10.356 -7.928 2.928 1271 HB VAL 175 HB VAL 175 -7.355 -7.592 3.415 1272 HG11 VAL 175 1HG1 VAL 175 -7.822 -7.680 0.991 1273 HG12 VAL 175 2HG1 VAL 175 -7.380 -6.040 1.468 1274 HG13 VAL 175 3HG1 VAL 175 -9.072 -6.444 1.168 1275 HG21 VAL 175 3HG2 VAL 175 -7.893 -5.200 3.805 1276 HG22 VAL 175 1HG2 VAL 175 -8.729 -6.241 4.962 1277 HG23 VAL 175 2HG2 VAL 175 -9.612 -5.550 3.599 1278 H THR 176 H THR 176 -11.026 -9.936 2.171 1279 HA THR 176 HA THR 176 -9.050 -11.904 1.267 1280 HB THR 176 HB THR 176 -11.121 -13.278 0.764 1281 HG1 THR 176 HG1 THR 176 -12.550 -11.452 0.500 1282 HG21 THR 176 3HG2 THR 176 -9.978 -13.516 2.953 1283 HG22 THR 176 1HG2 THR 176 -11.727 -13.703 3.127 1284 HG23 THR 176 2HG2 THR 176 -10.950 -12.192 3.604 1285 H ALA 177 H ALA 177 -8.173 -11.465 -0.653 1286 HA ALA 177 HA ALA 177 -9.787 -11.135 -3.033 1287 HB1 ALA 177 3HB ALA 177 -7.853 -8.926 -2.239 1288 HB2 ALA 177 1HB ALA 177 -9.613 -8.793 -2.263 1289 HB3 ALA 177 2HB ALA 177 -8.728 -9.032 -3.772 1290 H GLY 178 H GLY 178 -8.683 -11.755 -4.876 1291 HA2 GLY 178 2HA GLY 178 -7.205 -13.050 -6.057 1292 HA3 GLY 178 1HA GLY 178 -6.040 -11.896 -5.435 1293 H GLU 179 H GLU 179 -4.362 -13.353 -5.324 1294 HA GLU 179 HA GLU 179 -4.467 -15.779 -3.810 1295 HB2 GLU 179 2HB GLU 179 -2.856 -15.402 -5.682 1296 HB3 GLU 179 1HB GLU 179 -2.049 -14.166 -4.724 1297 HG2 GLU 179 2HG GLU 179 -0.870 -16.381 -4.729 1298 HG3 GLU 179 1HG GLU 179 -1.284 -15.802 -3.111 1299 H ARG 180 H ARG 180 -3.774 -16.142 -1.743 1300 HA ARG 180 HA ARG 180 -3.831 -13.910 0.136 1301 HB2 ARG 180 2HB ARG 180 -4.161 -15.625 1.835 1302 HB3 ARG 180 1HB ARG 180 -5.211 -16.007 0.474 1303 HG2 ARG 180 2HG ARG 180 -3.708 -17.779 -0.262 1304 HG3 ARG 180 1HG ARG 180 -2.511 -17.325 0.951 1305 HD2 ARG 180 2HD ARG 180 -4.165 -17.934 2.738 1306 HD3 ARG 180 1HD ARG 180 -5.261 -18.503 1.473 1307 HE ARG 180 HE ARG 180 -2.689 -19.721 1.278 1308 HH11 ARG 180 1HH1 ARG 180 -5.709 -19.953 3.073 1309 HH12 ARG 180 2HH1 ARG 180 -5.478 -21.628 3.451 1310 HH21 ARG 180 1HH2 ARG 180 -2.408 -21.912 1.805 1311 HH22 ARG 180 2HH2 ARG 180 -3.621 -22.734 2.737 1312 H THR 181 H THR 181 -2.298 -14.996 2.211 1313 HA THR 181 HA THR 181 0.448 -15.432 1.254 1314 HB THR 181 HB THR 181 1.264 -13.972 3.225 1315 HG1 THR 181 HG1 THR 181 -1.016 -13.852 4.088 1316 HG21 THR 181 3HG2 THR 181 -0.185 -12.509 0.986 1317 HG22 THR 181 1HG2 THR 181 1.465 -13.135 0.904 1318 HG23 THR 181 2HG2 THR 181 1.073 -11.821 2.017 1319 H ASP 182 H ASP 182 1.003 -17.395 2.040 1320 HA ASP 182 HA ASP 182 -0.614 -18.983 3.588 1321 HB2 ASP 182 2HB ASP 182 1.093 -19.861 2.059 1322 HB3 ASP 182 1HB ASP 182 2.379 -19.257 3.100 1323 H LEU 183 H LEU 183 -0.661 -19.744 5.626 1324 HA LEU 183 HA LEU 183 0.094 -17.972 7.737 1325 HB2 LEU 183 2HB LEU 183 -1.115 -19.417 9.244 1326 HB3 LEU 183 1HB LEU 183 -2.074 -19.104 7.814 1327 HG LEU 183 HG LEU 183 -0.507 -21.701 8.058 1328 HD11 LEU 183 1HD1 LEU 183 -3.284 -21.253 9.170 1329 HD12 LEU 183 2HD1 LEU 183 -1.813 -21.546 10.106 1330 HD13 LEU 183 3HD1 LEU 183 -2.441 -22.804 9.043 1331 HD21 LEU 183 3HD2 LEU 183 -2.300 -22.592 6.586 1332 HD22 LEU 183 1HD2 LEU 183 -1.440 -21.244 5.846 1333 HD23 LEU 183 2HD2 LEU 183 -3.042 -20.989 6.537 1334 H GLU 184 H GLU 184 1.263 -21.053 6.554 1335 HA GLU 184 HA GLU 184 2.807 -21.670 8.925 1336 HB2 GLU 184 2HB GLU 184 2.783 -23.035 6.196 1337 HB3 GLU 184 1HB GLU 184 3.535 -23.674 7.663 1338 HG2 GLU 184 2HG GLU 184 1.290 -23.724 8.750 1339 HG3 GLU 184 1HG GLU 184 0.564 -23.177 7.240 1340 H HIS 185 H HIS 185 3.443 -20.553 5.649 1341 HA HIS 185 HA HIS 185 5.164 -19.579 4.573 1342 HB2 HIS 185 2HB HIS 185 4.600 -17.825 6.297 1343 HB3 HIS 185 1HB HIS 185 5.882 -18.472 7.317 1344 HD1 HIS 185 HD1 HIS 185 8.349 -18.021 6.552 1345 HD2 HIS 185 HD2 HIS 185 5.469 -16.228 4.161 1346 HE1 HIS 185 HE1 HIS 185 9.590 -16.351 5.143 1347 HE2 HIS 185 HE2 HIS 185 7.852 -15.542 3.502 Start of MODEL 8 1 H1 MET 1 1H MET 1 -18.997 2.318 -16.328 2 H2 MET 1 2H MET 1 -19.931 3.467 -17.141 3 H3 MET 1 3H MET 1 -18.245 3.637 -17.070 4 HA MET 1 HA MET 1 -19.687 1.443 -18.427 5 HB2 MET 1 2HB MET 1 -19.983 3.607 -19.584 6 HB3 MET 1 1HB MET 1 -18.249 3.891 -19.549 7 HG2 MET 1 2HG MET 1 -19.057 3.195 -21.768 8 HG3 MET 1 1HG MET 1 -17.871 2.068 -21.102 9 HE1 MET 1 3HE MET 1 -18.582 0.249 -22.928 10 HE2 MET 1 1HE MET 1 -19.761 1.381 -23.594 11 HE3 MET 1 2HE MET 1 -20.247 -0.265 -23.189 12 H ASP 2 H ASP 2 -18.298 -0.026 -19.556 13 HA ASP 2 HA ASP 2 -15.982 -0.886 -18.254 14 HB2 ASP 2 2HB ASP 2 -16.860 -1.488 -21.108 15 HB3 ASP 2 1HB ASP 2 -15.655 -2.405 -20.196 16 H GLU 3 H GLU 3 -16.330 1.304 -20.954 17 HA GLU 3 HA GLU 3 -13.755 1.530 -21.963 18 HB2 GLU 3 2HB GLU 3 -15.829 3.747 -21.631 19 HB3 GLU 3 1HB GLU 3 -14.408 3.852 -22.669 20 HG2 GLU 3 2HG GLU 3 -15.258 2.019 -24.054 21 HG3 GLU 3 1HG GLU 3 -16.647 1.838 -22.984 22 H ASP 4 H ASP 4 -15.134 3.169 -19.093 23 HA ASP 4 HA ASP 4 -12.539 4.414 -18.488 24 HB2 ASP 4 2HB ASP 4 -13.688 5.616 -16.681 25 HB3 ASP 4 1HB ASP 4 -14.517 5.838 -18.213 26 H THR 5 H THR 5 -14.479 1.684 -17.443 27 HA THR 5 HA THR 5 -13.369 1.225 -14.893 28 HB THR 5 HB THR 5 -14.477 -0.836 -16.857 29 HG1 THR 5 HG1 THR 5 -15.725 1.201 -15.772 30 HG21 THR 5 3HG2 THR 5 -15.040 -2.162 -14.838 31 HG22 THR 5 1HG2 THR 5 -14.235 -0.963 -13.819 32 HG23 THR 5 2HG2 THR 5 -13.300 -1.919 -14.968 33 H GLU 6 H GLU 6 -12.269 0.330 -18.153 34 HA GLU 6 HA GLU 6 -10.174 -1.438 -17.312 35 HB2 GLU 6 2HB GLU 6 -9.455 -1.423 -19.651 36 HB3 GLU 6 1HB GLU 6 -11.199 -1.624 -19.538 37 HG2 GLU 6 2HG GLU 6 -11.494 0.783 -20.095 38 HG3 GLU 6 1HG GLU 6 -9.744 0.937 -20.250 39 H ASP 7 H ASP 7 -10.389 2.012 -17.538 40 HA ASP 7 HA ASP 7 -7.670 2.753 -17.860 41 HB2 ASP 7 2HB ASP 7 -9.407 4.445 -18.068 42 HB3 ASP 7 1HB ASP 7 -9.958 4.152 -16.426 43 H TRP 8 H TRP 8 -9.570 2.054 -14.955 44 HA TRP 8 HA TRP 8 -7.733 2.165 -12.935 45 HB2 TRP 8 2HB TRP 8 -9.989 1.533 -12.429 46 HB3 TRP 8 1HB TRP 8 -9.911 0.118 -13.468 47 HD1 TRP 8 HD1 TRP 8 -8.641 1.329 -9.996 48 HE1 TRP 8 HE1 TRP 8 -8.103 -0.742 -8.578 49 HE3 TRP 8 HE3 TRP 8 -9.349 -2.316 -13.523 50 HZ2 TRP 8 HZ2 TRP 8 -8.015 -3.541 -8.879 51 HZ3 TRP 8 HZ3 TRP 8 -9.034 -4.669 -12.873 52 HH2 TRP 8 HH2 TRP 8 -8.382 -5.261 -10.598 53 H GLU 9 H GLU 9 -8.126 -0.621 -15.200 54 HA GLU 9 HA GLU 9 -5.881 -2.040 -14.074 55 HB2 GLU 9 2HB GLU 9 -7.874 -3.180 -15.124 56 HB3 GLU 9 1HB GLU 9 -7.300 -2.649 -16.704 57 HG2 GLU 9 2HG GLU 9 -5.231 -3.933 -16.405 58 HG3 GLU 9 1HG GLU 9 -5.737 -4.413 -14.788 59 H THR 10 H THR 10 -6.223 0.380 -16.522 60 HA THR 10 HA THR 10 -3.874 -0.157 -18.059 61 HB THR 10 HB THR 10 -5.362 2.499 -17.697 62 HG1 THR 10 HG1 THR 10 -6.408 1.835 -19.661 63 HG21 THR 10 3HG2 THR 10 -3.573 1.569 -19.987 64 HG22 THR 10 1HG2 THR 10 -3.122 2.764 -18.767 65 HG23 THR 10 2HG2 THR 10 -4.434 3.106 -19.896 66 H GLN 11 H GLN 11 -4.574 2.331 -15.539 67 HA GLN 11 HA GLN 11 -1.895 3.027 -15.042 68 HB2 GLN 11 2HB GLN 11 -2.727 4.193 -13.071 69 HB3 GLN 11 1HB GLN 11 -3.836 4.433 -14.415 70 HG2 GLN 11 2HG GLN 11 -5.258 2.576 -13.418 71 HG3 GLN 11 1HG GLN 11 -4.222 2.664 -11.996 72 HE21 GLN 11 1HE2 GLN 11 -6.676 4.282 -13.872 73 HE22 GLN 11 2HE2 GLN 11 -7.082 5.472 -12.685 74 H LEU 12 H LEU 12 -3.895 0.402 -13.741 75 HA LEU 12 HA LEU 12 -2.331 -0.325 -11.510 76 HB2 LEU 12 2HB LEU 12 -4.544 -1.230 -11.663 77 HB3 LEU 12 1HB LEU 12 -4.239 -1.908 -13.250 78 HG LEU 12 HG LEU 12 -2.758 -3.626 -12.267 79 HD11 LEU 12 1HD1 LEU 12 -1.843 -2.427 -10.365 80 HD12 LEU 12 2HD1 LEU 12 -2.564 -3.942 -9.838 81 HD13 LEU 12 3HD1 LEU 12 -3.418 -2.424 -9.566 82 HD21 LEU 12 3HD2 LEU 12 -4.466 -4.975 -11.126 83 HD22 LEU 12 1HD2 LEU 12 -5.141 -4.152 -12.530 84 HD23 LEU 12 2HD2 LEU 12 -5.477 -3.544 -10.906 85 H GLN 13 H GLN 13 -2.247 -1.566 -14.885 86 HA GLN 13 HA GLN 13 -0.225 -3.478 -14.420 87 HB2 GLN 13 2HB GLN 13 0.022 -3.617 -16.868 88 HB3 GLN 13 1HB GLN 13 -1.663 -3.675 -16.369 89 HG2 GLN 13 2HG GLN 13 -1.971 -1.350 -17.051 90 HG3 GLN 13 1HG GLN 13 -0.267 -1.229 -17.481 91 HE21 GLN 13 1HE2 GLN 13 -0.084 -3.823 -18.783 92 HE22 GLN 13 2HE2 GLN 13 -0.958 -3.689 -20.266 93 H ALA 14 H ALA 14 -0.043 -0.083 -15.419 94 HA ALA 14 HA ALA 14 2.733 0.073 -15.889 95 HB1 ALA 14 3HB ALA 14 0.855 2.238 -14.890 96 HB2 ALA 14 1HB ALA 14 1.169 1.831 -16.580 97 HB3 ALA 14 2HB ALA 14 2.459 2.503 -15.581 98 H ASN 15 H ASN 15 0.849 0.743 -12.923 99 HA ASN 15 HA ASN 15 2.878 1.383 -11.136 100 HB2 ASN 15 2HB ASN 15 0.203 0.003 -10.661 101 HB3 ASN 15 1HB ASN 15 1.263 0.451 -9.332 102 HD21 ASN 15 1HD2 ASN 15 -1.473 1.359 -10.048 103 HD22 ASN 15 2HD2 ASN 15 -1.376 3.081 -10.142 104 H ARG 16 H ARG 16 1.414 -1.850 -11.544 105 HA ARG 16 HA ARG 16 3.018 -3.082 -9.577 106 HB2 ARG 16 2HB ARG 16 2.026 -5.203 -10.340 107 HB3 ARG 16 1HB ARG 16 0.815 -3.941 -10.149 108 HG2 ARG 16 2HG ARG 16 0.808 -3.583 -12.600 109 HG3 ARG 16 1HG ARG 16 1.997 -4.873 -12.783 110 HD2 ARG 16 2HD ARG 16 0.403 -6.506 -11.905 111 HD3 ARG 16 1HD ARG 16 -0.773 -5.222 -11.599 112 HE ARG 16 HE ARG 16 0.033 -5.335 -14.346 113 HH11 ARG 16 1HH1 ARG 16 -2.099 -6.871 -12.018 114 HH12 ARG 16 2HH1 ARG 16 -3.234 -7.395 -13.223 115 HH21 ARG 16 1HH2 ARG 16 -1.452 -6.030 -15.916 116 HH22 ARG 16 2HH2 ARG 16 -2.863 -6.917 -15.435 117 H ASP 17 H ASP 17 3.436 -2.836 -13.088 118 HA ASP 17 HA ASP 17 5.551 -4.759 -13.249 119 HB2 ASP 17 2HB ASP 17 4.499 -2.672 -15.174 120 HB3 ASP 17 1HB ASP 17 5.958 -3.578 -15.548 121 H GLU 18 H GLU 18 5.515 -1.224 -12.697 122 HA GLU 18 HA GLU 18 8.423 -1.120 -12.790 123 HB2 GLU 18 2HB GLU 18 8.281 1.230 -12.251 124 HB3 GLU 18 1HB GLU 18 7.127 0.834 -13.519 125 HG2 GLU 18 2HG GLU 18 5.315 0.825 -11.820 126 HG3 GLU 18 1HG GLU 18 6.496 1.318 -10.603 127 H LYS 19 H LYS 19 6.037 -1.724 -10.369 128 HA LYS 19 HA LYS 19 7.819 -1.506 -8.102 129 HB2 LYS 19 2HB LYS 19 5.210 -3.065 -8.395 130 HB3 LYS 19 1HB LYS 19 6.083 -2.843 -6.884 131 HG2 LYS 19 2HG LYS 19 4.803 -0.647 -8.535 132 HG3 LYS 19 1HG LYS 19 4.166 -1.326 -7.035 133 HD2 LYS 19 2HD LYS 19 6.063 -0.440 -5.776 134 HD3 LYS 19 1HD LYS 19 6.842 0.110 -7.261 135 HE2 LYS 19 2HE LYS 19 4.926 1.682 -7.624 136 HE3 LYS 19 1HE LYS 19 4.270 1.186 -6.059 137 HZ1 LYS 19 3HZ LYS 19 6.231 2.014 -4.978 138 HZ2 LYS 19 1HZ LYS 19 5.586 3.244 -5.947 139 HZ3 LYS 19 2HZ LYS 19 6.954 2.390 -6.456 140 H ASP 20 H ASP 20 6.967 -3.964 -10.460 141 HA ASP 20 HA ASP 20 8.244 -6.190 -9.158 142 HB2 ASP 20 2HB ASP 20 6.353 -6.581 -10.648 143 HB3 ASP 20 1HB ASP 20 7.187 -5.811 -11.993 144 H ARG 21 H ARG 21 9.077 -3.957 -11.790 145 HA ARG 21 HA ARG 21 11.512 -5.169 -12.588 146 HB2 ARG 21 2HB ARG 21 12.007 -3.243 -13.877 147 HB3 ARG 21 1HB ARG 21 10.250 -3.307 -13.879 148 HG2 ARG 21 2HG ARG 21 10.094 -1.483 -12.324 149 HG3 ARG 21 1HG ARG 21 11.799 -1.574 -11.934 150 HD2 ARG 21 2HD ARG 21 12.385 -0.763 -14.163 151 HD3 ARG 21 1HD ARG 21 10.667 -0.683 -14.604 152 HE ARG 21 HE ARG 21 11.795 0.881 -12.353 153 HH11 ARG 21 1HH1 ARG 21 9.937 0.829 -15.337 154 HH12 ARG 21 2HH1 ARG 21 9.496 2.503 -15.226 155 HH21 ARG 21 1HH2 ARG 21 11.218 3.044 -12.212 156 HH22 ARG 21 2HH2 ARG 21 10.227 3.763 -13.439 157 H PHE 22 H PHE 22 10.675 -2.964 -10.021 158 HA PHE 22 HA PHE 22 13.141 -1.853 -9.345 159 HB2 PHE 22 2HB PHE 22 10.783 -1.282 -8.441 160 HB3 PHE 22 1HB PHE 22 10.977 -2.621 -7.318 161 HD1 PHE 22 HD2 PHE 22 12.830 -2.499 -5.567 162 HD2 PHE 22 HD1 PHE 22 11.819 0.843 -8.031 163 HE1 PHE 22 HE2 PHE 22 13.992 -0.989 -4.016 164 HE2 PHE 22 HE1 PHE 22 12.988 2.340 -6.474 165 HZ PHE 22 HZ PHE 22 14.076 1.429 -4.468 166 H PHE 23 H PHE 23 11.673 -4.915 -8.414 167 HA PHE 23 HA PHE 23 13.736 -5.756 -6.595 168 HB2 PHE 23 2HB PHE 23 11.441 -7.240 -7.927 169 HB3 PHE 23 1HB PHE 23 12.547 -8.003 -6.791 170 HD1 PHE 23 HD2 PHE 23 10.764 -4.665 -6.727 171 HD2 PHE 23 HD1 PHE 23 11.391 -8.432 -4.804 172 HE1 PHE 23 HE2 PHE 23 9.337 -3.954 -4.858 173 HE2 PHE 23 HE1 PHE 23 9.964 -7.709 -2.938 174 HZ PHE 23 HZ PHE 23 8.936 -5.477 -2.963 175 H SER 24 H SER 24 13.149 -6.123 -10.040 176 HA SER 24 HA SER 24 15.137 -8.164 -10.472 177 HB2 SER 24 2HB SER 24 13.073 -7.860 -11.901 178 HB3 SER 24 1HB SER 24 13.784 -6.384 -12.545 179 HG SER 24 HG SER 24 15.543 -7.688 -13.298 180 H GLU 25 H GLU 25 15.097 -4.589 -10.668 181 HA GLU 25 HA GLU 25 17.642 -4.547 -12.161 182 HB2 GLU 25 2HB GLU 25 15.464 -2.412 -11.839 183 HB3 GLU 25 1HB GLU 25 16.932 -2.227 -12.787 184 HG2 GLU 25 2HG GLU 25 14.708 -4.199 -13.353 185 HG3 GLU 25 1HG GLU 25 14.954 -2.664 -14.185 186 H HIS 26 H HIS 26 15.829 -2.726 -9.678 187 HA HIS 26 HA HIS 26 18.082 -0.997 -9.156 188 HB2 HIS 26 2HB HIS 26 15.763 -0.122 -9.221 189 HB3 HIS 26 1HB HIS 26 15.326 -1.120 -7.838 190 HD2 HIS 26 HD2 HIS 26 16.831 2.316 -8.622 191 HE1 HIS 26 HE1 HIS 26 17.242 1.678 -4.457 192 HE2 HIS 26 HE2 HIS 26 17.504 3.353 -6.337 193 H ARG 27 H ARG 27 16.171 -3.268 -7.188 194 HA ARG 27 HA ARG 27 18.288 -3.383 -5.148 195 HB2 ARG 27 2HB ARG 27 16.177 -1.838 -4.691 196 HB3 ARG 27 1HB ARG 27 15.308 -3.343 -4.453 197 HG2 ARG 27 2HG ARG 27 17.795 -2.588 -2.892 198 HG3 ARG 27 1HG ARG 27 16.174 -2.165 -2.364 199 HD2 ARG 27 2HD ARG 27 15.602 -4.449 -1.979 200 HD3 ARG 27 1HD ARG 27 17.010 -5.029 -2.874 201 HE ARG 27 HE ARG 27 17.952 -3.498 -0.725 202 HH11 ARG 27 1HH1 ARG 27 16.201 -6.509 -1.203 203 HH12 ARG 27 2HH1 ARG 27 16.812 -7.231 0.250 204 HH21 ARG 27 1HH2 ARG 27 18.823 -4.503 1.113 205 HH22 ARG 27 2HH2 ARG 27 18.295 -6.093 1.563 206 H GLN 28 H GLN 28 18.659 -5.455 -4.454 207 HA GLN 28 HA GLN 28 17.806 -7.720 -5.893 208 HB2 GLN 28 2HB GLN 28 18.991 -9.012 -4.084 209 HB3 GLN 28 1HB GLN 28 19.942 -7.684 -4.736 210 HG2 GLN 28 2HG GLN 28 19.240 -6.298 -2.752 211 HG3 GLN 28 1HG GLN 28 18.497 -7.740 -2.070 212 HE21 GLN 28 1HE2 GLN 28 21.519 -6.173 -2.868 213 HE22 GLN 28 2HE2 GLN 28 22.538 -7.211 -1.945 214 H SER 29 H SER 29 16.177 -9.189 -5.601 215 HA SER 29 HA SER 29 13.827 -8.405 -4.256 216 HB2 SER 29 2HB SER 29 13.002 -10.715 -4.983 217 HB3 SER 29 1HB SER 29 13.646 -9.709 -6.280 218 HG SER 29 HG SER 29 15.502 -11.330 -5.008 219 HA PRO 30 HA PRO 30 14.692 -10.178 -0.106 220 HB2 PRO 30 2HB PRO 30 12.161 -9.719 0.927 221 HB3 PRO 30 1HB PRO 30 13.399 -8.455 0.798 222 HG2 PRO 30 2HG PRO 30 11.135 -9.046 -1.079 223 HG3 PRO 30 1HG PRO 30 11.668 -7.484 -0.414 224 HD2 PRO 30 2HD PRO 30 12.384 -8.206 -2.882 225 HD3 PRO 30 1HD PRO 30 13.537 -7.361 -1.825 226 H ILE 31 H ILE 31 12.035 -10.977 -2.266 227 HA ILE 31 HA ILE 31 10.857 -13.130 -0.925 228 HB ILE 31 HB ILE 31 11.013 -12.914 -3.971 229 HG12 ILE 31 2HG1 ILE 31 10.372 -10.687 -3.055 230 HG13 ILE 31 1HG1 ILE 31 9.063 -11.423 -3.963 231 HG21 ILE 31 1HG2 ILE 31 8.849 -14.052 -2.157 232 HG22 ILE 31 2HG2 ILE 31 9.984 -14.981 -3.135 233 HG23 ILE 31 3HG2 ILE 31 8.772 -13.973 -3.923 234 HD11 ILE 31 3HD1 ILE 31 7.988 -12.057 -1.821 235 HD12 ILE 31 1HD1 ILE 31 8.204 -10.316 -2.006 236 HD13 ILE 31 2HD1 ILE 31 9.286 -11.230 -0.958 237 HA PRO 32 HA PRO 32 14.543 -15.794 -1.393 238 HB2 PRO 32 2HB PRO 32 13.711 -17.879 0.219 239 HB3 PRO 32 1HB PRO 32 14.354 -16.353 0.855 240 HG2 PRO 32 2HG PRO 32 11.519 -17.245 0.609 241 HG3 PRO 32 1HG PRO 32 12.315 -16.353 1.925 242 HD2 PRO 32 2HD PRO 32 10.747 -15.127 0.042 243 HD3 PRO 32 1HD PRO 32 12.092 -14.313 0.864 244 HA PRO 33 HA PRO 33 13.555 -18.498 -4.761 245 HB2 PRO 33 2HB PRO 33 15.387 -20.550 -4.484 246 HB3 PRO 33 1HB PRO 33 15.829 -18.912 -5.007 247 HG2 PRO 33 2HG PRO 33 16.019 -20.116 -2.262 248 HG3 PRO 33 1HG PRO 33 17.224 -19.159 -3.159 249 HD2 PRO 33 2HD PRO 33 15.700 -18.012 -1.276 250 HD3 PRO 33 1HD PRO 33 16.124 -17.140 -2.764 251 H GLU 34 H GLU 34 13.035 -19.576 -1.581 252 HA GLU 34 HA GLU 34 11.913 -22.173 -2.149 253 HB2 GLU 34 2HB GLU 34 11.640 -20.416 0.338 254 HB3 GLU 34 1HB GLU 34 11.318 -22.147 0.236 255 HG2 GLU 34 2HG GLU 34 13.666 -22.631 -0.094 256 HG3 GLU 34 1HG GLU 34 14.048 -20.919 -0.240 257 H GLU 35 H GLU 35 10.655 -18.987 -1.097 258 HA GLU 35 HA GLU 35 7.941 -19.461 -1.426 259 HB2 GLU 35 2HB GLU 35 9.438 -16.820 -1.747 260 HB3 GLU 35 1HB GLU 35 7.695 -16.970 -1.547 261 HG2 GLU 35 2HG GLU 35 9.808 -17.754 0.462 262 HG3 GLU 35 1HG GLU 35 8.750 -16.347 0.547 263 H ARG 36 H ARG 36 10.070 -17.659 -3.731 264 HA ARG 36 HA ARG 36 7.973 -17.155 -5.546 265 HB2 ARG 36 2HB ARG 36 9.758 -16.190 -6.964 266 HB3 ARG 36 1HB ARG 36 9.877 -15.667 -5.288 267 HG2 ARG 36 2HG ARG 36 11.635 -17.475 -4.959 268 HG3 ARG 36 1HG ARG 36 11.617 -17.695 -6.711 269 HD2 ARG 36 2HD ARG 36 12.338 -15.163 -5.208 270 HD3 ARG 36 1HD ARG 36 13.449 -16.230 -6.070 271 HE ARG 36 HE ARG 36 11.523 -15.360 -7.898 272 HH11 ARG 36 1HH1 ARG 36 14.155 -13.994 -6.019 273 HH12 ARG 36 2HH1 ARG 36 14.458 -12.711 -7.147 274 HH21 ARG 36 1HH2 ARG 36 11.891 -13.642 -9.351 275 HH22 ARG 36 2HH2 ARG 36 13.177 -12.514 -9.033 276 H ASP 37 H ASP 37 9.630 -20.077 -5.179 277 HA ASP 37 HA ASP 37 9.628 -20.794 -8.011 278 HB2 ASP 37 2HB ASP 37 11.523 -21.483 -6.610 279 HB3 ASP 37 1HB ASP 37 10.451 -22.401 -5.559 280 H ASP 38 H ASP 38 8.078 -22.126 -5.028 281 HA ASP 38 HA ASP 38 6.129 -23.624 -6.637 282 HB2 ASP 38 2HB ASP 38 6.572 -23.445 -3.631 283 HB3 ASP 38 1HB ASP 38 5.290 -24.404 -4.369 284 H PHE 39 H PHE 39 6.222 -20.915 -4.415 285 HA PHE 39 HA PHE 39 3.416 -20.153 -4.953 286 HB2 PHE 39 2HB PHE 39 5.395 -18.895 -2.973 287 HB3 PHE 39 1HB PHE 39 3.660 -18.586 -3.072 288 HD1 PHE 39 HD2 PHE 39 2.031 -20.349 -2.325 289 HD2 PHE 39 HD1 PHE 39 6.250 -20.853 -1.810 290 HE1 PHE 39 HE2 PHE 39 1.626 -22.172 -0.724 291 HE2 PHE 39 HE1 PHE 39 5.827 -22.683 -0.223 292 HZ PHE 39 HZ PHE 39 3.520 -23.344 0.327 293 H ASP 40 H ASP 40 3.137 -17.746 -5.477 294 HA ASP 40 HA ASP 40 4.825 -17.119 -7.723 295 HB2 ASP 40 2HB ASP 40 2.313 -16.690 -7.561 296 HB3 ASP 40 1HB ASP 40 2.679 -15.343 -6.489 297 H GLY 41 H GLY 41 5.973 -15.067 -8.004 298 HA2 GLY 41 2HA GLY 41 7.816 -14.444 -5.927 299 HA3 GLY 41 1HA GLY 41 7.678 -13.638 -7.481 300 H LEU 42 H LEU 42 8.092 -11.545 -6.412 301 HA LEU 42 HA LEU 42 6.426 -10.287 -4.561 302 HB2 LEU 42 2HB LEU 42 8.457 -9.226 -5.417 303 HB3 LEU 42 1HB LEU 42 7.805 -9.157 -7.036 304 HG LEU 42 HG LEU 42 7.934 -6.955 -5.667 305 HD11 LEU 42 1HD1 LEU 42 6.730 -7.038 -7.800 306 HD12 LEU 42 2HD1 LEU 42 5.916 -5.976 -6.654 307 HD13 LEU 42 3HD1 LEU 42 5.268 -7.587 -6.974 308 HD21 LEU 42 3HD2 LEU 42 5.444 -8.064 -4.325 309 HD22 LEU 42 1HD2 LEU 42 6.056 -6.414 -4.176 310 HD23 LEU 42 2HD2 LEU 42 7.000 -7.763 -3.549 311 H SER 43 H SER 43 4.292 -9.797 -4.630 312 HA SER 43 HA SER 43 2.745 -9.850 -7.077 313 HB2 SER 43 2HB SER 43 3.310 -12.315 -6.493 314 HB3 SER 43 1HB SER 43 2.303 -12.110 -5.062 315 HG SER 43 HG SER 43 1.559 -12.700 -7.533 316 H TYR 44 H TYR 44 0.337 -10.304 -6.165 317 HA TYR 44 HA TYR 44 -0.189 -9.286 -3.541 318 HB2 TYR 44 2HB TYR 44 -1.649 -7.389 -4.304 319 HB3 TYR 44 1HB TYR 44 0.057 -7.128 -4.604 320 HD1 TYR 44 HD1 TYR 44 -2.938 -8.495 -6.418 321 HD2 TYR 44 HD2 TYR 44 0.580 -6.088 -6.676 322 HE1 TYR 44 HE1 TYR 44 -3.542 -7.861 -8.681 323 HE2 TYR 44 HE2 TYR 44 -0.036 -5.466 -8.971 324 HH TYR 44 HH TYR 44 -3.137 -6.090 -10.241 325 H PHE 45 H PHE 45 -2.462 -9.460 -2.995 326 HA PHE 45 HA PHE 45 -3.816 -11.763 -3.737 327 HB2 PHE 45 2HB PHE 45 -5.181 -9.218 -2.765 328 HB3 PHE 45 1HB PHE 45 -5.762 -10.861 -2.563 329 HD1 PHE 45 HD1 PHE 45 -4.559 -12.406 -0.978 330 HD2 PHE 45 HD2 PHE 45 -3.638 -8.238 -1.197 331 HE1 PHE 45 HE1 PHE 45 -3.454 -12.532 1.211 332 HE2 PHE 45 HE2 PHE 45 -2.530 -8.371 0.996 333 HZ PHE 45 HZ PHE 45 -2.436 -10.519 2.204 334 H ASP 46 H ASP 46 -5.764 -12.134 -5.177 335 HA ASP 46 HA ASP 46 -5.155 -11.127 -7.780 336 HB2 ASP 46 2HB ASP 46 -5.907 -13.444 -7.384 337 HB3 ASP 46 1HB ASP 46 -7.466 -12.866 -6.808 338 HA PRO 47 HA PRO 47 -7.328 -7.245 -7.470 339 HB2 PRO 47 2HB PRO 47 -7.864 -7.557 -10.427 340 HB3 PRO 47 1HB PRO 47 -7.094 -6.213 -9.556 341 HG2 PRO 47 2HG PRO 47 -5.640 -7.913 -10.991 342 HG3 PRO 47 1HG PRO 47 -5.037 -7.281 -9.438 343 HD2 PRO 47 2HD PRO 47 -6.163 -9.990 -10.071 344 HD3 PRO 47 1HD PRO 47 -4.858 -9.539 -8.953 345 H ASP 48 H ASP 48 -9.278 -7.399 -6.375 346 HA ASP 48 HA ASP 48 -11.641 -8.413 -7.855 347 HB2 ASP 48 2HB ASP 48 -11.102 -9.625 -5.727 348 HB3 ASP 48 1HB ASP 48 -11.341 -8.120 -4.840 349 HA PRO 49 HA PRO 49 -12.784 -4.045 -7.888 350 HB2 PRO 49 2HB PRO 49 -15.066 -4.261 -9.364 351 HB3 PRO 49 1HB PRO 49 -13.461 -4.499 -10.082 352 HG2 PRO 49 2HG PRO 49 -15.432 -6.565 -9.156 353 HG3 PRO 49 1HG PRO 49 -14.490 -6.504 -10.666 354 HD2 PRO 49 2HD PRO 49 -13.731 -8.011 -8.522 355 HD3 PRO 49 1HD PRO 49 -12.563 -7.296 -9.656 356 H ASP 50 H ASP 50 -14.846 -6.610 -6.599 357 HA ASP 50 HA ASP 50 -16.858 -4.839 -5.513 358 HB2 ASP 50 2HB ASP 50 -16.374 -7.832 -5.245 359 HB3 ASP 50 1HB ASP 50 -17.709 -7.003 -4.447 360 H TYR 51 H TYR 51 -13.844 -6.126 -4.363 361 HA TYR 51 HA TYR 51 -14.508 -5.534 -1.560 362 HB2 TYR 51 2HB TYR 51 -12.976 -7.545 -2.391 363 HB3 TYR 51 1HB TYR 51 -11.702 -6.328 -2.394 364 HD1 TYR 51 HD1 TYR 51 -13.987 -8.302 -0.291 365 HD2 TYR 51 HD2 TYR 51 -10.967 -5.280 -0.223 366 HE1 TYR 51 HE1 TYR 51 -13.800 -8.543 2.136 367 HE2 TYR 51 HE2 TYR 51 -10.773 -5.540 2.210 368 HH TYR 51 HH TYR 51 -12.211 -8.113 3.925 369 H ARG 52 H ARG 52 -13.105 -4.067 -4.293 370 HA ARG 52 HA ARG 52 -11.532 -2.035 -3.250 371 HB2 ARG 52 2HB ARG 52 -11.600 -2.303 -5.619 372 HB3 ARG 52 1HB ARG 52 -13.351 -2.164 -5.677 373 HG2 ARG 52 2HG ARG 52 -13.244 0.210 -5.224 374 HG3 ARG 52 1HG ARG 52 -11.507 0.125 -4.926 375 HD2 ARG 52 2HD ARG 52 -11.985 1.052 -7.133 376 HD3 ARG 52 1HD ARG 52 -11.103 -0.469 -7.253 377 HE ARG 52 HE ARG 52 -14.023 -0.267 -7.694 378 HH11 ARG 52 1HH1 ARG 52 -10.848 -1.437 -8.681 379 HH12 ARG 52 2HH1 ARG 52 -11.468 -2.276 -10.070 380 HH21 ARG 52 1HH2 ARG 52 -14.794 -1.275 -9.576 381 HH22 ARG 52 2HH2 ARG 52 -13.702 -2.183 -10.575 382 H VAL 53 H VAL 53 -11.931 -0.170 -2.211 383 HA VAL 53 HA VAL 53 -14.697 0.831 -1.910 384 HB VAL 53 HB VAL 53 -14.089 1.780 0.260 385 HG11 VAL 53 1HG1 VAL 53 -13.761 -0.265 1.615 386 HG12 VAL 53 2HG1 VAL 53 -13.266 -1.153 0.170 387 HG13 VAL 53 3HG1 VAL 53 -14.914 -0.537 0.307 388 HG21 VAL 53 3HG2 VAL 53 -11.880 1.374 1.327 389 HG22 VAL 53 1HG2 VAL 53 -11.739 2.336 -0.145 390 HG23 VAL 53 2HG2 VAL 53 -11.305 0.625 -0.162 391 H GLU 54 H GLU 54 -14.930 3.067 -2.096 392 HA GLU 54 HA GLU 54 -12.761 4.598 -3.373 393 HB2 GLU 54 2HB GLU 54 -14.589 6.271 -3.784 394 HB3 GLU 54 1HB GLU 54 -14.948 4.688 -4.469 395 HG2 GLU 54 2HG GLU 54 -16.376 4.219 -2.433 396 HG3 GLU 54 1HG GLU 54 -16.102 5.879 -1.921 397 H ALA 55 H ALA 55 -11.857 6.462 -2.306 398 HA ALA 55 HA ALA 55 -12.659 6.922 0.504 399 HB1 ALA 55 3HB ALA 55 -9.816 6.314 -0.378 400 HB2 ALA 55 1HB ALA 55 -10.862 5.228 0.537 401 HB3 ALA 55 2HB ALA 55 -10.328 6.749 1.255 402 H THR 56 H THR 56 -12.482 9.019 1.135 403 HA THR 56 HA THR 56 -11.660 11.038 -0.819 404 HB THR 56 HB THR 56 -12.928 11.364 1.947 405 HG1 THR 56 HG1 THR 56 -14.083 10.315 -0.055 406 HG21 THR 56 3HG2 THR 56 -13.516 13.642 1.187 407 HG22 THR 56 1HG2 THR 56 -12.634 13.371 -0.326 408 HG23 THR 56 2HG2 THR 56 -11.770 13.418 1.209 409 H VAL 57 H VAL 57 -9.723 12.007 -0.702 410 HA VAL 57 HA VAL 57 -7.729 11.291 1.230 411 HB VAL 57 HB VAL 57 -7.591 13.508 -0.891 412 HG11 VAL 57 1HG1 VAL 57 -5.152 13.143 -0.812 413 HG12 VAL 57 2HG1 VAL 57 -5.364 11.916 0.441 414 HG13 VAL 57 3HG1 VAL 57 -5.779 13.598 0.774 415 HG21 VAL 57 3HG2 VAL 57 -6.855 10.573 -1.230 416 HG22 VAL 57 1HG2 VAL 57 -6.625 11.849 -2.430 417 HG23 VAL 57 2HG2 VAL 57 -8.253 11.374 -1.948 418 H THR 58 H THR 58 -7.275 12.314 3.073 419 HA THR 58 HA THR 58 -8.364 15.014 3.668 420 HB THR 58 HB THR 58 -7.996 12.694 5.634 421 HG1 THR 58 HG1 THR 58 -9.781 12.083 4.597 422 HG21 THR 58 3HG2 THR 58 -9.360 15.392 6.014 423 HG22 THR 58 1HG2 THR 58 -7.816 14.907 6.724 424 HG23 THR 58 2HG2 THR 58 -9.303 14.088 7.202 425 H VAL 59 H VAL 59 -6.557 16.232 3.409 426 HA VAL 59 HA VAL 59 -3.918 15.180 4.210 427 HB VAL 59 HB VAL 59 -4.607 17.485 2.315 428 HG11 VAL 59 1HG1 VAL 59 -1.852 16.451 3.133 429 HG12 VAL 59 2HG1 VAL 59 -2.531 18.034 3.518 430 HG13 VAL 59 3HG1 VAL 59 -2.167 17.621 1.845 431 HG21 VAL 59 3HG2 VAL 59 -3.615 16.025 0.588 432 HG22 VAL 59 1HG2 VAL 59 -4.996 15.253 1.367 433 HG23 VAL 59 2HG2 VAL 59 -3.355 14.760 1.793 434 H HIS 60 H HIS 60 -2.757 16.151 5.706 435 HA HIS 60 HA HIS 60 -4.064 18.021 7.532 436 HB2 HIS 60 2HB HIS 60 -1.705 16.098 7.868 437 HB3 HIS 60 1HB HIS 60 -2.250 17.208 9.128 438 HD1 HIS 60 HD1 HIS 60 -3.373 14.133 7.229 439 HD2 HIS 60 HD2 HIS 60 -4.477 16.350 10.569 440 HE1 HIS 60 HE1 HIS 60 -5.193 12.820 8.340 441 HE2 HIS 60 HE2 HIS 60 -6.001 14.291 10.211 442 H GLU 61 H GLU 61 -3.298 19.976 7.802 443 HA GLU 61 HA GLU 61 -1.166 21.059 6.184 444 HB2 GLU 61 2HB GLU 61 -1.706 23.201 7.343 445 HB3 GLU 61 1HB GLU 61 -3.123 22.432 6.638 446 HG2 GLU 61 2HG GLU 61 -3.744 21.563 8.888 447 HG3 GLU 61 1HG GLU 61 -2.355 22.407 9.569 448 H THR 62 H THR 62 -1.404 19.611 9.315 449 HA THR 62 HA THR 62 1.384 20.347 9.966 450 HB THR 62 HB THR 62 0.698 19.894 12.374 451 HG1 THR 62 HG1 THR 62 -1.173 18.730 12.134 452 HG21 THR 62 3HG2 THR 62 0.838 22.235 11.552 453 HG22 THR 62 1HG2 THR 62 -0.466 22.046 12.728 454 HG23 THR 62 2HG2 THR 62 -0.838 22.142 11.006 455 HA PRO 63 HA PRO 63 1.419 15.767 9.203 456 HB2 PRO 63 2HB PRO 63 3.727 15.641 7.800 457 HB3 PRO 63 1HB PRO 63 2.250 16.294 7.063 458 HG2 PRO 63 2HG PRO 63 4.603 17.764 8.193 459 HG3 PRO 63 1HG PRO 63 3.683 18.084 6.705 460 HD2 PRO 63 2HD PRO 63 3.286 19.420 9.108 461 HD3 PRO 63 1HD PRO 63 2.074 19.295 7.817 462 H GLU 64 H GLU 64 2.184 14.274 10.680 463 HA GLU 64 HA GLU 64 4.365 14.978 12.525 464 HB2 GLU 64 2HB GLU 64 3.580 13.035 13.848 465 HB3 GLU 64 1HB GLU 64 2.271 14.159 13.503 466 HG2 GLU 64 2HG GLU 64 1.414 12.697 11.751 467 HG3 GLU 64 1HG GLU 64 2.766 11.592 11.965 468 H SER 65 H SER 65 5.903 13.207 13.176 469 HA SER 65 HA SER 65 7.111 12.002 10.782 470 HB2 SER 65 2HB SER 65 9.105 11.719 12.308 471 HB3 SER 65 1HB SER 65 8.582 13.387 12.113 472 HG SER 65 HG SER 65 8.071 11.674 14.319 473 H VAL 66 H VAL 66 6.580 9.962 10.341 474 HA VAL 66 HA VAL 66 6.329 7.939 12.497 475 HB VAL 66 HB VAL 66 4.921 7.809 9.779 476 HG11 VAL 66 1HG1 VAL 66 4.410 6.252 12.345 477 HG12 VAL 66 2HG1 VAL 66 5.201 5.640 10.891 478 HG13 VAL 66 3HG1 VAL 66 3.499 6.097 10.839 479 HG21 VAL 66 3HG2 VAL 66 3.726 8.858 12.374 480 HG22 VAL 66 1HG2 VAL 66 2.825 8.523 10.891 481 HG23 VAL 66 2HG2 VAL 66 4.053 9.787 10.908 482 H ASP 67 H ASP 67 8.002 6.530 12.379 483 HA ASP 67 HA ASP 67 9.837 6.600 10.120 484 HB2 ASP 67 2HB ASP 67 9.994 4.986 12.700 485 HB3 ASP 67 1HB ASP 67 11.299 5.187 11.529 486 H LEU 68 H LEU 68 9.538 5.364 8.429 487 HA LEU 68 HA LEU 68 8.393 2.633 8.673 488 HB2 LEU 68 2HB LEU 68 8.029 4.437 6.248 489 HB3 LEU 68 1HB LEU 68 7.241 2.903 6.570 490 HG LEU 68 HG LEU 68 6.729 5.494 8.081 491 HD11 LEU 68 1HD1 LEU 68 4.579 5.550 6.962 492 HD12 LEU 68 2HD1 LEU 68 4.959 4.067 6.084 493 HD13 LEU 68 3HD1 LEU 68 5.878 5.541 5.773 494 HD21 LEU 68 3HD2 LEU 68 5.294 2.831 8.333 495 HD22 LEU 68 1HD2 LEU 68 4.834 4.337 9.128 496 HD23 LEU 68 2HD2 LEU 68 6.357 3.556 9.541 497 H GLU 69 H GLU 69 9.185 1.198 6.880 498 HA GLU 69 HA GLU 69 12.000 1.539 6.365 499 HB2 GLU 69 2HB GLU 69 11.832 -0.593 5.107 500 HB3 GLU 69 1HB GLU 69 11.139 -0.718 6.712 501 HG2 GLU 69 2HG GLU 69 8.875 -0.634 5.809 502 HG3 GLU 69 1HG GLU 69 9.495 -0.323 4.190 503 H THR 70 H THR 70 12.998 1.945 4.402 504 HA THR 70 HA THR 70 11.326 2.481 2.036 505 HB THR 70 HB THR 70 13.195 4.086 2.515 506 HG1 THR 70 HG1 THR 70 14.186 3.670 0.263 507 HG21 THR 70 3HG2 THR 70 15.533 3.452 2.082 508 HG22 THR 70 1HG2 THR 70 15.057 1.767 1.860 509 HG23 THR 70 2HG2 THR 70 14.888 2.533 3.443 510 H SER 71 H SER 71 12.153 1.414 0.008 511 HA SER 71 HA SER 71 11.717 -1.355 0.286 512 HB2 SER 71 2HB SER 71 12.255 -1.298 -2.260 513 HB3 SER 71 1HB SER 71 10.898 -0.330 -1.685 514 HG SER 71 HG SER 71 11.967 1.138 -2.809 515 H ASP 72 H ASP 72 14.787 0.452 -0.154 516 HA ASP 72 HA ASP 72 16.436 -1.870 -0.372 517 HB2 ASP 72 2HB ASP 72 16.913 0.454 -1.289 518 HB3 ASP 72 1HB ASP 72 17.222 0.990 0.364 519 H ASP 73 H ASP 73 14.802 -2.228 1.943 520 HA ASP 73 HA ASP 73 15.008 -3.279 3.929 521 HB2 ASP 73 2HB ASP 73 16.917 -4.388 2.774 522 HB3 ASP 73 1HB ASP 73 18.000 -3.152 3.392 523 H ARG 74 H ARG 74 15.792 -0.146 3.667 524 HA ARG 74 HA ARG 74 17.300 0.194 6.177 525 HB2 ARG 74 2HB ARG 74 17.917 1.086 3.676 526 HB3 ARG 74 1HB ARG 74 16.931 2.445 4.191 527 HG2 ARG 74 2HG ARG 74 18.437 2.862 6.075 528 HG3 ARG 74 1HG ARG 74 19.379 1.421 5.669 529 HD2 ARG 74 2HD ARG 74 19.081 3.898 3.919 530 HD3 ARG 74 1HD ARG 74 20.498 3.468 4.878 531 HE ARG 74 HE ARG 74 19.906 1.354 3.098 532 HH11 ARG 74 1HH1 ARG 74 21.184 4.641 2.972 533 HH12 ARG 74 2HH1 ARG 74 22.125 4.344 1.547 534 HH21 ARG 74 1HH2 ARG 74 21.171 0.982 1.241 535 HH22 ARG 74 2HH2 ARG 74 22.121 2.291 0.569 536 H THR 75 H THR 75 16.691 2.740 6.941 537 HA THR 75 HA THR 75 13.769 2.736 7.417 538 HB THR 75 HB THR 75 15.905 3.220 9.553 539 HG1 THR 75 HG1 THR 75 15.165 0.953 8.767 540 HG21 THR 75 3HG2 THR 75 13.929 4.674 9.905 541 HG22 THR 75 1HG2 THR 75 13.992 3.410 11.133 542 HG23 THR 75 2HG2 THR 75 12.861 3.274 9.787 543 H VAL 76 H VAL 76 12.868 4.711 7.356 544 HA VAL 76 HA VAL 76 14.435 7.157 7.260 545 HB VAL 76 HB VAL 76 13.232 7.854 5.063 546 HG11 VAL 76 1HG1 VAL 76 14.990 6.926 3.603 547 HG12 VAL 76 2HG1 VAL 76 15.413 5.744 4.845 548 HG13 VAL 76 3HG1 VAL 76 15.662 7.463 5.144 549 HG21 VAL 76 3HG2 VAL 76 12.963 4.840 4.726 550 HG22 VAL 76 1HG2 VAL 76 12.599 6.065 3.503 551 HG23 VAL 76 2HG2 VAL 76 11.635 5.972 4.975 552 H ARG 77 H ARG 77 13.232 8.941 7.765 553 HA ARG 77 HA ARG 77 10.739 8.560 9.141 554 HB2 ARG 77 2HB ARG 77 12.425 10.149 9.933 555 HB3 ARG 77 1HB ARG 77 12.341 11.060 8.439 556 HG2 ARG 77 2HG ARG 77 9.859 10.805 10.136 557 HG3 ARG 77 1HG ARG 77 11.136 11.902 10.643 558 HD2 ARG 77 2HD ARG 77 9.626 12.027 8.007 559 HD3 ARG 77 1HD ARG 77 9.414 13.109 9.384 560 HE ARG 77 HE ARG 77 11.874 12.937 7.732 561 HH11 ARG 77 1HH1 ARG 77 9.668 14.881 9.665 562 HH12 ARG 77 2HH1 ARG 77 10.547 16.349 9.397 563 HH21 ARG 77 1HH2 ARG 77 13.020 14.862 7.414 564 HH22 ARG 77 2HH2 ARG 77 12.450 16.341 8.121 565 H TYR 78 H TYR 78 8.783 8.697 8.309 566 HA TYR 78 HA TYR 78 8.245 10.109 5.769 567 HB2 TYR 78 2HB TYR 78 6.816 7.861 7.217 568 HB3 TYR 78 1HB TYR 78 5.973 8.841 6.025 569 HD1 TYR 78 HD2 TYR 78 9.221 6.924 6.300 570 HD2 TYR 78 HD1 TYR 78 5.886 7.964 3.848 571 HE1 TYR 78 HE2 TYR 78 10.027 5.417 4.535 572 HE2 TYR 78 HE1 TYR 78 6.692 6.458 2.093 573 HH TYR 78 HH TYR 78 9.113 4.136 2.621 574 H LEU 79 H LEU 79 6.465 11.513 5.682 575 HA LEU 79 HA LEU 79 5.563 12.653 8.258 576 HB2 LEU 79 2HB LEU 79 5.725 13.877 5.473 577 HB3 LEU 79 1HB LEU 79 4.857 14.633 6.800 578 HG LEU 79 HG LEU 79 7.850 14.079 6.736 579 HD11 LEU 79 1HD1 LEU 79 8.114 16.516 6.638 580 HD12 LEU 79 2HD1 LEU 79 6.362 16.723 6.587 581 HD13 LEU 79 3HD1 LEU 79 7.198 15.927 5.253 582 HD21 LEU 79 3HD2 LEU 79 7.960 15.332 8.864 583 HD22 LEU 79 1HD2 LEU 79 6.997 13.866 9.026 584 HD23 LEU 79 2HD2 LEU 79 6.197 15.434 8.902 585 H HIS 80 H HIS 80 3.538 12.236 8.852 586 HA HIS 80 HA HIS 80 1.619 10.949 7.156 587 HB2 HIS 80 2HB HIS 80 1.580 10.512 9.568 588 HB3 HIS 80 1HB HIS 80 1.336 12.221 9.912 589 HD2 HIS 80 HD2 HIS 80 -0.792 10.025 7.396 590 HE1 HIS 80 HE1 HIS 80 -3.292 11.657 10.383 591 HE2 HIS 80 HE2 HIS 80 -3.134 9.986 8.494 592 H VAL 81 H VAL 81 1.165 12.165 5.463 593 HA VAL 81 HA VAL 81 0.293 14.949 5.787 594 HB VAL 81 HB VAL 81 0.366 15.034 3.272 595 HG11 VAL 81 1HG1 VAL 81 2.292 15.792 4.587 596 HG12 VAL 81 2HG1 VAL 81 2.851 15.019 3.103 597 HG13 VAL 81 3HG1 VAL 81 2.945 14.152 4.640 598 HG21 VAL 81 3HG2 VAL 81 1.580 12.247 3.470 599 HG22 VAL 81 1HG2 VAL 81 1.446 13.227 2.008 600 HG23 VAL 81 2HG2 VAL 81 -0.007 12.630 2.800 601 H ALA 82 H ALA 82 -0.902 11.891 4.263 602 HA ALA 82 HA ALA 82 -3.603 13.148 4.233 603 HB1 ALA 82 3HB ALA 82 -2.452 11.107 2.295 604 HB2 ALA 82 1HB ALA 82 -2.700 12.824 1.978 605 HB3 ALA 82 2HB ALA 82 -4.087 11.770 2.248 606 H THR 83 H THR 83 -5.395 11.826 4.606 607 HA THR 83 HA THR 83 -5.001 9.064 5.535 608 HB THR 83 HB THR 83 -6.884 11.061 6.924 609 HG1 THR 83 HG1 THR 83 -4.207 10.604 7.271 610 HG21 THR 83 3HG2 THR 83 -7.071 9.308 8.654 611 HG22 THR 83 1HG2 THR 83 -5.999 8.254 7.725 612 HG23 THR 83 2HG2 THR 83 -7.589 8.681 7.090 613 H LEU 84 H LEU 84 -6.403 7.765 4.490 614 HA LEU 84 HA LEU 84 -8.192 8.966 2.501 615 HB2 LEU 84 2HB LEU 84 -7.285 6.058 2.709 616 HB3 LEU 84 1HB LEU 84 -8.004 6.857 1.320 617 HG LEU 84 HG LEU 84 -5.195 7.255 2.421 618 HD11 LEU 84 1HD1 LEU 84 -4.427 6.401 0.268 619 HD12 LEU 84 2HD1 LEU 84 -6.092 6.234 -0.289 620 HD13 LEU 84 3HD1 LEU 84 -5.504 5.238 1.043 621 HD21 LEU 84 3HD2 LEU 84 -4.782 8.885 0.601 622 HD22 LEU 84 1HD2 LEU 84 -5.990 9.467 1.749 623 HD23 LEU 84 2HD2 LEU 84 -6.495 8.843 0.178 624 H SER 85 H SER 85 -10.078 9.329 3.441 625 HA SER 85 HA SER 85 -11.169 7.775 5.609 626 HB2 SER 85 2HB SER 85 -12.245 10.222 4.142 627 HB3 SER 85 1HB SER 85 -12.827 9.601 5.692 628 HG SER 85 HG SER 85 -11.048 10.308 6.662 629 H PHE 86 H PHE 86 -12.628 6.165 5.389 630 HA PHE 86 HA PHE 86 -14.693 6.126 3.392 631 HB2 PHE 86 2HB PHE 86 -14.030 3.975 2.322 632 HB3 PHE 86 1HB PHE 86 -12.870 5.248 1.999 633 HD1 PHE 86 HD1 PHE 86 -10.601 5.157 2.979 634 HD2 PHE 86 HD2 PHE 86 -13.391 1.988 3.634 635 HE1 PHE 86 HE1 PHE 86 -8.772 3.699 3.726 636 HE2 PHE 86 HE2 PHE 86 -11.553 0.535 4.384 637 HZ PHE 86 HZ PHE 86 -9.245 1.390 4.436 638 H ASP 87 H ASP 87 -15.646 3.647 3.555 639 HA ASP 87 HA ASP 87 -15.577 2.750 6.376 640 HB2 ASP 87 2HB ASP 87 -17.939 2.323 6.395 641 HB3 ASP 87 1HB ASP 87 -17.730 3.974 5.845 642 H LEU 88 H LEU 88 -15.625 0.539 6.694 643 HA LEU 88 HA LEU 88 -15.827 -1.301 4.435 644 HB2 LEU 88 2HB LEU 88 -13.415 -0.652 4.442 645 HB3 LEU 88 1HB LEU 88 -13.290 -1.118 6.127 646 HG LEU 88 HG LEU 88 -13.869 -3.497 5.417 647 HD11 LEU 88 1HD1 LEU 88 -13.558 -4.131 3.059 648 HD12 LEU 88 2HD1 LEU 88 -13.400 -2.429 2.615 649 HD13 LEU 88 3HD1 LEU 88 -14.926 -3.038 3.260 650 HD21 LEU 88 3HD2 LEU 88 -11.601 -4.017 4.644 651 HD22 LEU 88 1HD2 LEU 88 -11.576 -2.832 5.949 652 HD23 LEU 88 2HD2 LEU 88 -11.321 -2.312 4.281 653 H ASP 89 H ASP 89 -16.673 -3.193 5.089 654 HA ASP 89 HA ASP 89 -17.438 -4.923 6.299 655 HB2 ASP 89 2HB ASP 89 -15.232 -5.077 7.371 656 HB3 ASP 89 1HB ASP 89 -15.689 -3.859 8.562 657 H GLY 90 H GLY 90 -17.220 -2.542 8.924 658 HA2 GLY 90 2HA GLY 90 -20.016 -1.869 8.942 659 HA3 GLY 90 1HA GLY 90 -19.577 -3.013 10.213 660 H GLU 91 H GLU 91 -17.216 -0.753 9.114 661 HA GLU 91 HA GLU 91 -17.620 1.122 11.338 662 HB2 GLU 91 2HB GLU 91 -15.257 0.808 12.095 663 HB3 GLU 91 1HB GLU 91 -16.233 -0.641 12.318 664 HG2 GLU 91 2HG GLU 91 -15.269 -1.618 10.273 665 HG3 GLU 91 1HG GLU 91 -14.294 -0.174 10.035 666 H SER 92 H SER 92 -16.448 3.052 11.165 667 HA SER 92 HA SER 92 -15.915 4.072 8.537 668 HB2 SER 92 2HB SER 92 -16.889 5.489 10.317 669 HB3 SER 92 1HB SER 92 -15.436 5.297 11.300 670 HG SER 92 HG SER 92 -14.324 6.566 9.926 671 H ARG 93 H ARG 93 -14.224 2.915 7.656 672 HA ARG 93 HA ARG 93 -11.711 2.666 9.105 673 HB2 ARG 93 2HB ARG 93 -12.755 1.382 6.591 674 HB3 ARG 93 1HB ARG 93 -11.042 1.317 6.963 675 HG2 ARG 93 2HG ARG 93 -13.223 0.274 8.793 676 HG3 ARG 93 1HG ARG 93 -12.317 -0.716 7.649 677 HD2 ARG 93 2HD ARG 93 -11.337 -1.026 9.811 678 HD3 ARG 93 1HD ARG 93 -10.207 -0.062 8.862 679 HE ARG 93 HE ARG 93 -12.015 1.006 10.956 680 HH11 ARG 93 1HH1 ARG 93 -8.906 1.099 9.277 681 HH12 ARG 93 2HH1 ARG 93 -8.277 2.396 10.234 682 HH21 ARG 93 1HH2 ARG 93 -11.192 2.828 12.138 683 HH22 ARG 93 2HH2 ARG 93 -9.567 3.380 11.852 684 H ASP 94 H ASP 94 -9.772 3.394 8.513 685 HA ASP 94 HA ASP 94 -9.465 5.170 6.197 686 HB2 ASP 94 2HB ASP 94 -8.432 6.940 7.571 687 HB3 ASP 94 1HB ASP 94 -10.100 6.660 8.048 688 H LEU 95 H LEU 95 -7.446 5.326 5.397 689 HA LEU 95 HA LEU 95 -5.257 3.732 6.633 690 HB2 LEU 95 2HB LEU 95 -5.860 4.117 3.665 691 HB3 LEU 95 1HB LEU 95 -4.415 3.346 4.302 692 HG LEU 95 HG LEU 95 -7.263 2.309 4.425 693 HD11 LEU 95 1HD1 LEU 95 -6.334 0.392 3.195 694 HD12 LEU 95 2HD1 LEU 95 -4.741 1.152 3.197 695 HD13 LEU 95 3HD1 LEU 95 -6.078 1.902 2.324 696 HD21 LEU 95 3HD2 LEU 95 -6.270 1.878 6.622 697 HD22 LEU 95 1HD2 LEU 95 -4.842 1.163 5.865 698 HD23 LEU 95 2HD2 LEU 95 -6.415 0.376 5.715 699 H HIS 96 H HIS 96 -3.333 4.793 6.899 700 HA HIS 96 HA HIS 96 -3.393 7.693 6.438 701 HB2 HIS 96 2HB HIS 96 -1.534 5.924 8.092 702 HB3 HIS 96 1HB HIS 96 -1.422 7.683 7.992 703 HD2 HIS 96 HD2 HIS 96 -4.223 5.098 9.087 704 HE1 HIS 96 HE1 HIS 96 -4.484 8.600 11.417 705 HE2 HIS 96 HE2 HIS 96 -5.632 6.449 10.764 706 H ALA 97 H ALA 97 -2.344 8.565 4.800 707 HA ALA 97 HA ALA 97 -0.487 6.974 3.158 708 HB1 ALA 97 3HB ALA 97 -2.476 7.857 2.004 709 HB2 ALA 97 1HB ALA 97 -1.013 8.622 1.384 710 HB3 ALA 97 2HB ALA 97 -2.064 9.496 2.501 711 H PHE 98 H PHE 98 1.580 7.418 3.373 712 HA PHE 98 HA PHE 98 2.470 10.004 4.517 713 HB2 PHE 98 2HB PHE 98 3.979 7.358 4.672 714 HB3 PHE 98 1HB PHE 98 4.281 8.842 5.562 715 HD1 PHE 98 HD1 PHE 98 2.871 9.450 7.484 716 HD2 PHE 98 HD2 PHE 98 2.350 5.729 5.465 717 HE1 PHE 98 HE1 PHE 98 1.623 8.578 9.404 718 HE2 PHE 98 HE2 PHE 98 1.102 4.864 7.400 719 HZ PHE 98 HZ PHE 98 0.737 6.294 9.364 720 H ARG 99 H ARG 99 4.636 10.591 3.903 721 HA ARG 99 HA ARG 99 6.083 9.314 1.802 722 HB2 ARG 99 2HB ARG 99 6.073 11.209 0.216 723 HB3 ARG 99 1HB ARG 99 4.491 10.480 0.377 724 HG2 ARG 99 2HG ARG 99 4.405 12.572 2.224 725 HG3 ARG 99 1HG ARG 99 5.351 13.248 0.901 726 HD2 ARG 99 2HD ARG 99 2.585 12.012 0.672 727 HD3 ARG 99 1HD ARG 99 2.947 13.733 0.656 728 HE ARG 99 HE ARG 99 4.237 12.197 -1.445 729 HH11 ARG 99 1HH1 ARG 99 1.354 14.021 -0.577 730 HH12 ARG 99 2HH1 ARG 99 0.909 14.334 -2.226 731 HH21 ARG 99 1HH2 ARG 99 3.631 12.620 -3.604 732 HH22 ARG 99 2HH2 ARG 99 2.183 13.550 -3.930 733 H GLN 100 H GLN 100 8.259 10.149 1.736 734 HA GLN 100 HA GLN 100 9.170 10.277 4.310 735 HB2 GLN 100 2HB GLN 100 10.689 10.979 1.791 736 HB3 GLN 100 1HB GLN 100 11.445 10.720 3.360 737 HG2 GLN 100 2HG GLN 100 10.425 8.394 3.367 738 HG3 GLN 100 1HG GLN 100 9.931 8.686 1.701 739 HE21 GLN 100 1HE2 GLN 100 12.998 9.736 3.137 740 HE22 GLN 100 2HE2 GLN 100 13.998 8.706 2.182 741 H ALA 101 H ALA 101 9.945 13.039 2.117 742 HA ALA 101 HA ALA 101 9.530 14.876 4.414 743 HB1 ALA 101 3HB ALA 101 11.220 16.354 3.407 744 HB2 ALA 101 1HB ALA 101 11.432 15.223 2.067 745 HB3 ALA 101 2HB ALA 101 11.886 14.749 3.705 746 H ALA 102 H ALA 102 9.805 15.415 0.874 747 HA ALA 102 HA ALA 102 7.231 16.879 0.875 748 HB1 ALA 102 3HB ALA 102 8.311 18.758 -0.293 749 HB2 ALA 102 1HB ALA 102 9.870 17.931 -0.223 750 HB3 ALA 102 2HB ALA 102 9.090 18.476 1.264 751 H ASP 103 H ASP 103 7.440 14.321 -0.111 752 HA ASP 103 HA ASP 103 8.483 13.778 -2.607 753 HB2 ASP 103 2HB ASP 103 7.668 11.979 -1.251 754 HB3 ASP 103 1HB ASP 103 6.045 12.658 -1.198 755 H GLU 104 H GLU 104 8.026 14.255 -4.617 756 HA GLU 104 HA GLU 104 5.435 15.450 -5.416 757 HB2 GLU 104 2HB GLU 104 8.182 15.686 -6.725 758 HB3 GLU 104 1HB GLU 104 6.711 16.488 -7.273 759 HG2 GLU 104 2HG GLU 104 6.619 17.740 -5.134 760 HG3 GLU 104 1HG GLU 104 8.123 16.972 -4.632 761 H SER 105 H SER 105 7.118 12.579 -5.479 762 HA SER 105 HA SER 105 6.621 11.709 -8.200 763 HB2 SER 105 2HB SER 105 8.686 11.105 -6.871 764 HB3 SER 105 1HB SER 105 7.673 10.109 -5.828 765 HG SER 105 HG SER 105 7.283 8.746 -7.496 766 H ARG 106 H ARG 106 4.441 12.204 -5.992 767 HA ARG 106 HA ARG 106 2.236 11.666 -5.769 768 HB2 ARG 106 2HB ARG 106 2.552 9.582 -7.976 769 HB3 ARG 106 1HB ARG 106 1.085 10.428 -7.507 770 HG2 ARG 106 2HG ARG 106 3.495 11.659 -8.875 771 HG3 ARG 106 1HG ARG 106 1.967 11.256 -9.650 772 HD2 ARG 106 2HD ARG 106 0.843 13.072 -8.667 773 HD3 ARG 106 1HD ARG 106 1.987 13.179 -7.325 774 HE ARG 106 HE ARG 106 3.383 14.482 -8.588 775 HH11 ARG 106 1HH1 ARG 106 0.922 13.222 -10.762 776 HH12 ARG 106 2HH1 ARG 106 1.399 14.255 -12.067 777 HH21 ARG 106 1HH2 ARG 106 4.009 15.765 -10.324 778 HH22 ARG 106 2HH2 ARG 106 3.141 15.690 -11.823 779 H THR 107 H THR 107 4.519 10.051 -4.502 780 HA THR 107 HA THR 107 3.530 7.348 -4.252 781 HB THR 107 HB THR 107 5.933 8.717 -2.958 782 HG1 THR 107 HG1 THR 107 5.445 7.721 -5.498 783 HG21 THR 107 3HG2 THR 107 6.822 6.419 -2.663 784 HG22 THR 107 1HG2 THR 107 5.312 5.749 -3.309 785 HG23 THR 107 2HG2 THR 107 5.315 6.621 -1.779 786 H LEU 108 H LEU 108 1.617 7.510 -3.140 787 HA LEU 108 HA LEU 108 1.620 8.409 -0.331 788 HB2 LEU 108 2HB LEU 108 -0.661 7.388 -2.086 789 HB3 LEU 108 1HB LEU 108 -0.828 7.971 -0.436 790 HG LEU 108 HG LEU 108 -0.024 9.639 -2.850 791 HD11 LEU 108 1HD1 LEU 108 -2.169 10.793 -2.505 792 HD12 LEU 108 2HD1 LEU 108 -2.550 9.706 -1.168 793 HD13 LEU 108 3HD1 LEU 108 -2.413 9.072 -2.809 794 HD21 LEU 108 3HD2 LEU 108 -0.330 10.513 0.050 795 HD22 LEU 108 1HD2 LEU 108 -0.070 11.592 -1.327 796 HD23 LEU 108 2HD2 LEU 108 1.179 10.441 -0.863 797 H PHE 109 H PHE 109 2.393 6.927 1.014 798 HA PHE 109 HA PHE 109 2.186 4.044 0.392 799 HB2 PHE 109 2HB PHE 109 4.446 5.043 0.850 800 HB3 PHE 109 1HB PHE 109 3.896 5.536 2.446 801 HD1 PHE 109 HD1 PHE 109 4.533 2.520 0.308 802 HD2 PHE 109 HD2 PHE 109 4.060 4.012 4.289 803 HE1 PHE 109 HE1 PHE 109 5.284 0.357 1.219 804 HE2 PHE 109 HE2 PHE 109 4.817 1.850 5.189 805 HZ PHE 109 HZ PHE 109 5.428 0.020 3.658 806 H VAL 110 H VAL 110 0.350 3.154 1.277 807 HA VAL 110 HA VAL 110 -0.493 4.029 3.979 808 HB VAL 110 HB VAL 110 -2.817 3.289 3.492 809 HG11 VAL 110 1HG1 VAL 110 -1.842 5.378 1.527 810 HG12 VAL 110 2HG1 VAL 110 -2.247 5.648 3.221 811 HG13 VAL 110 3HG1 VAL 110 -3.504 5.167 2.088 812 HG21 VAL 110 3HG2 VAL 110 -2.456 1.664 1.693 813 HG22 VAL 110 1HG2 VAL 110 -1.930 2.948 0.605 814 HG23 VAL 110 2HG2 VAL 110 -3.600 2.900 1.180 815 HA PRO 111 HA PRO 111 0.523 -0.357 4.825 816 HB2 PRO 111 2HB PRO 111 1.073 0.055 7.505 817 HB3 PRO 111 1HB PRO 111 2.294 0.266 6.234 818 HG2 PRO 111 2HG PRO 111 0.670 2.345 7.649 819 HG3 PRO 111 1HG PRO 111 2.392 2.368 7.198 820 HD2 PRO 111 2HD PRO 111 0.470 3.655 5.743 821 HD3 PRO 111 1HD PRO 111 1.950 3.001 5.011 822 H PHE 112 H PHE 112 -0.942 -1.799 5.736 823 HA PHE 112 HA PHE 112 -2.927 -0.868 7.652 824 HB2 PHE 112 2HB PHE 112 -4.876 -1.571 6.507 825 HB3 PHE 112 1HB PHE 112 -3.980 -0.646 5.321 826 HD1 PHE 112 HD1 PHE 112 -2.917 -1.817 3.371 827 HD2 PHE 112 HD2 PHE 112 -5.351 -3.922 6.186 828 HE1 PHE 112 HE1 PHE 112 -3.196 -3.664 1.775 829 HE2 PHE 112 HE2 PHE 112 -5.616 -5.760 4.585 830 HZ PHE 112 HZ PHE 112 -4.547 -5.642 2.379 831 H ARG 113 H ARG 113 -3.732 -2.561 8.944 832 HA ARG 113 HA ARG 113 -2.627 -5.255 8.436 833 HB2 ARG 113 2HB ARG 113 -1.213 -4.035 10.135 834 HB3 ARG 113 1HB ARG 113 -2.636 -3.892 11.163 835 HG2 ARG 113 2HG ARG 113 -2.786 -6.447 11.087 836 HG3 ARG 113 1HG ARG 113 -1.181 -6.425 10.354 837 HD2 ARG 113 2HD ARG 113 -0.281 -5.297 12.344 838 HD3 ARG 113 1HD ARG 113 -1.891 -5.247 13.063 839 HE ARG 113 HE ARG 113 -0.066 -7.385 13.171 840 HH11 ARG 113 1HH1 ARG 113 -3.550 -6.908 12.767 841 HH12 ARG 113 2HH1 ARG 113 -3.940 -8.463 13.431 842 HH21 ARG 113 1HH2 ARG 113 -0.626 -9.383 14.051 843 HH22 ARG 113 2HH2 ARG 113 -2.290 -9.856 14.152 844 H ASP 114 H ASP 114 -4.078 -6.841 8.758 845 HA ASP 114 HA ASP 114 -6.782 -6.120 9.692 846 HB2 ASP 114 2HB ASP 114 -7.593 -7.714 7.886 847 HB3 ASP 114 1HB ASP 114 -6.836 -6.242 7.273 848 H LYS 115 H LYS 115 -7.981 -8.498 9.745 849 HA LYS 115 HA LYS 115 -6.648 -9.709 12.061 850 HB2 LYS 115 2HB LYS 115 -9.461 -10.291 11.070 851 HB3 LYS 115 1HB LYS 115 -8.806 -10.591 12.676 852 HG2 LYS 115 2HG LYS 115 -9.316 -7.870 11.443 853 HG3 LYS 115 1HG LYS 115 -10.342 -8.660 12.631 854 HD2 LYS 115 2HD LYS 115 -7.447 -7.980 13.245 855 HD3 LYS 115 1HD LYS 115 -8.730 -6.787 13.420 856 HE2 LYS 115 2HE LYS 115 -8.358 -7.749 15.586 857 HE3 LYS 115 1HE LYS 115 -9.893 -8.387 14.996 858 HZ1 LYS 115 3HZ LYS 115 -8.783 -10.429 14.404 859 HZ2 LYS 115 1HZ LYS 115 -8.514 -10.076 16.035 860 HZ3 LYS 115 2HZ LYS 115 -7.289 -9.811 14.899 861 H THR 116 H THR 116 -7.171 -10.476 8.731 862 HA THR 116 HA THR 116 -6.729 -13.345 9.089 863 HB THR 116 HB THR 116 -6.557 -13.214 6.447 864 HG1 THR 116 HG1 THR 116 -6.469 -10.988 6.192 865 HG21 THR 116 3HG2 THR 116 -9.009 -13.310 6.222 866 HG22 THR 116 1HG2 THR 116 -9.193 -12.660 7.853 867 HG23 THR 116 2HG2 THR 116 -8.466 -14.250 7.610 868 H THR 117 H THR 117 -4.816 -10.480 8.730 869 HA THR 117 HA THR 117 -2.392 -11.656 7.810 870 HB THR 117 HB THR 117 -2.933 -9.141 9.451 871 HG1 THR 117 HG1 THR 117 -3.457 -9.085 7.224 872 HG21 THR 117 3HG2 THR 117 -0.673 -9.966 10.107 873 HG22 THR 117 1HG2 THR 117 -0.575 -8.483 9.154 874 HG23 THR 117 2HG2 THR 117 -0.210 -10.037 8.405 875 H GLY 118 H GLY 118 -0.858 -12.803 8.885 876 HA2 GLY 118 2HA GLY 118 0.277 -13.919 10.539 877 HA3 GLY 118 1HA GLY 118 -0.599 -12.984 11.735 878 H GLN 119 H GLN 119 -2.937 -14.359 9.873 879 HA GLN 119 HA GLN 119 -3.238 -16.694 11.680 880 HB2 GLN 119 2HB GLN 119 -5.428 -14.848 10.607 881 HB3 GLN 119 1HB GLN 119 -5.694 -16.259 11.622 882 HG2 GLN 119 2HG GLN 119 -4.184 -13.763 12.466 883 HG3 GLN 119 1HG GLN 119 -5.861 -14.107 12.858 884 HE21 GLN 119 1HE2 GLN 119 -2.544 -14.860 13.597 885 HE22 GLN 119 2HE2 GLN 119 -2.858 -15.817 15.000 886 H GLN 120 H GLN 120 -4.820 -15.394 8.764 887 HA GLN 120 HA GLN 120 -4.669 -18.010 7.406 888 HB2 GLN 120 2HB GLN 120 -6.327 -15.524 6.804 889 HB3 GLN 120 1HB GLN 120 -6.385 -17.026 5.885 890 HG2 GLN 120 2HG GLN 120 -7.197 -18.223 7.903 891 HG3 GLN 120 1HG GLN 120 -7.153 -16.704 8.800 892 HE21 GLN 120 1HE2 GLN 120 -9.371 -16.852 9.236 893 HE22 GLN 120 2HE2 GLN 120 -10.564 -16.528 8.031 894 H SER 121 H SER 121 -2.519 -15.883 7.700 895 HA SER 121 HA SER 121 -1.218 -16.178 5.212 896 HB2 SER 121 2HB SER 121 -1.161 -13.819 4.426 897 HB3 SER 121 1HB SER 121 -2.828 -14.396 4.477 898 HG SER 121 HG SER 121 -3.242 -13.148 6.180 899 H TYR 122 H TYR 122 0.813 -14.643 5.209 900 HA TYR 122 HA TYR 122 2.388 -14.990 7.468 901 HB2 TYR 122 2HB TYR 122 2.592 -13.200 5.047 902 HB3 TYR 122 1HB TYR 122 3.738 -12.967 6.357 903 HD1 TYR 122 HD1 TYR 122 5.073 -15.023 7.156 904 HD2 TYR 122 HD2 TYR 122 3.085 -14.856 3.377 905 HE1 TYR 122 HE1 TYR 122 6.538 -16.785 6.307 906 HE2 TYR 122 HE2 TYR 122 4.558 -16.638 2.528 907 HH TYR 122 HH TYR 122 6.748 -17.618 3.035 908 H ASP 123 H ASP 123 3.203 -13.596 9.031 909 HA ASP 123 HA ASP 123 1.377 -11.540 10.033 910 HB2 ASP 123 2HB ASP 123 2.706 -11.653 12.098 911 HB3 ASP 123 1HB ASP 123 2.232 -13.265 11.582 912 H GLY 124 H GLY 124 3.091 -9.842 11.414 913 HA2 GLY 124 2HA GLY 124 4.742 -8.181 11.154 914 HA3 GLY 124 1HA GLY 124 4.858 -8.551 9.442 915 H GLY 125 H GLY 125 2.204 -8.466 8.722 916 HA2 GLY 125 2HA GLY 125 0.310 -6.847 8.914 917 HA3 GLY 125 1HA GLY 125 1.537 -5.579 8.961 918 H ARG 126 H ARG 126 -0.258 -5.283 7.036 919 HA ARG 126 HA ARG 126 1.050 -6.183 4.521 920 HB2 ARG 126 2HB ARG 126 -1.792 -5.090 4.870 921 HB3 ARG 126 1HB ARG 126 -1.077 -5.662 3.374 922 HG2 ARG 126 2HG ARG 126 -1.729 -7.393 5.773 923 HG3 ARG 126 1HG ARG 126 -2.724 -7.234 4.328 924 HD2 ARG 126 2HD ARG 126 -1.567 -9.255 4.001 925 HD3 ARG 126 1HD ARG 126 -0.645 -8.098 3.040 926 HE ARG 126 HE ARG 126 1.032 -8.054 4.779 927 HH11 ARG 126 1HH1 ARG 126 -1.330 -10.651 5.102 928 HH12 ARG 126 2HH1 ARG 126 -0.307 -11.615 6.116 929 HH21 ARG 126 1HH2 ARG 126 2.324 -9.296 6.169 930 HH22 ARG 126 2HH2 ARG 126 1.767 -10.844 6.722 931 H TYR 127 H TYR 127 1.330 -4.465 2.891 932 HA TYR 127 HA TYR 127 0.416 -1.819 3.628 933 HB2 TYR 127 2HB TYR 127 2.786 -0.899 2.752 934 HB3 TYR 127 1HB TYR 127 2.442 -1.212 4.437 935 HD1 TYR 127 HD2 TYR 127 3.379 -3.274 5.546 936 HD2 TYR 127 HD1 TYR 127 4.583 -2.099 1.615 937 HE1 TYR 127 HE2 TYR 127 5.436 -4.589 5.781 938 HE2 TYR 127 HE1 TYR 127 6.633 -3.412 1.864 939 HH TYR 127 HH TYR 127 8.071 -4.235 3.863 940 H MET 128 H MET 128 -0.463 -0.840 2.146 941 HA MET 128 HA MET 128 -0.318 -1.551 -0.688 942 HB2 MET 128 2HB MET 128 -2.211 -0.029 1.135 943 HB3 MET 128 1HB MET 128 -2.241 0.331 -0.582 944 HG2 MET 128 2HG MET 128 -2.551 -2.510 0.322 945 HG3 MET 128 1HG MET 128 -3.910 -1.396 0.446 946 HE1 MET 128 3HE MET 128 -5.087 -0.246 -1.532 947 HE2 MET 128 1HE MET 128 -4.642 -0.441 -3.232 948 HE3 MET 128 2HE MET 128 -3.592 0.472 -2.148 949 H GLU 129 H GLU 129 0.174 0.083 -2.257 950 HA GLU 129 HA GLU 129 1.116 2.712 -1.361 951 HB2 GLU 129 2HB GLU 129 3.116 1.265 -1.323 952 HB3 GLU 129 1HB GLU 129 2.809 0.738 -2.973 953 HG2 GLU 129 2HG GLU 129 3.251 2.992 -3.805 954 HG3 GLU 129 1HG GLU 129 3.466 3.585 -2.155 955 H LEU 130 H LEU 130 0.134 4.149 -2.601 956 HA LEU 130 HA LEU 130 -0.860 3.427 -5.296 957 HB2 LEU 130 2HB LEU 130 -2.036 5.758 -3.755 958 HB3 LEU 130 1HB LEU 130 -2.767 4.750 -4.986 959 HG LEU 130 HG LEU 130 -2.625 2.868 -3.084 960 HD11 LEU 130 1HD1 LEU 130 -2.630 5.425 -1.452 961 HD12 LEU 130 2HD1 LEU 130 -1.388 4.170 -1.458 962 HD13 LEU 130 3HD1 LEU 130 -2.993 3.812 -0.832 963 HD21 LEU 130 3HD2 LEU 130 -4.900 3.387 -2.393 964 HD22 LEU 130 1HD2 LEU 130 -4.716 3.681 -4.120 965 HD23 LEU 130 2HD2 LEU 130 -4.742 5.036 -2.991 966 H GLU 131 H GLU 131 -0.439 4.802 -6.963 967 HA GLU 131 HA GLU 131 0.897 7.376 -6.486 968 HB2 GLU 131 2HB GLU 131 1.897 5.218 -8.403 969 HB3 GLU 131 1HB GLU 131 2.413 6.900 -8.486 970 HG2 GLU 131 2HG GLU 131 3.300 6.718 -6.166 971 HG3 GLU 131 1HG GLU 131 2.843 5.018 -6.143 972 HA PRO 132 HA PRO 132 -2.921 7.942 -9.110 973 HB2 PRO 132 2HB PRO 132 -3.262 10.580 -8.305 974 HB3 PRO 132 1HB PRO 132 -3.865 9.195 -7.375 975 HG2 PRO 132 2HG PRO 132 -1.301 10.727 -7.009 976 HG3 PRO 132 1HG PRO 132 -2.507 10.258 -5.788 977 HD2 PRO 132 2HD PRO 132 -0.296 8.828 -6.050 978 HD3 PRO 132 1HD PRO 132 -1.853 8.004 -5.810 979 H ASP 133 H ASP 133 -3.447 9.646 -10.742 980 HA ASP 133 HA ASP 133 -1.385 10.049 -12.634 981 HB2 ASP 133 2HB ASP 133 -3.708 9.881 -13.353 982 HB3 ASP 133 1HB ASP 133 -4.172 11.282 -12.397 983 H ARG 134 H ARG 134 -3.198 12.445 -10.700 984 HA ARG 134 HA ARG 134 -0.822 14.216 -10.669 985 HB2 ARG 134 2HB ARG 134 -2.403 16.094 -10.367 986 HB3 ARG 134 1HB ARG 134 -2.715 15.218 -11.854 987 HG2 ARG 134 2HG ARG 134 -4.893 15.337 -11.201 988 HG3 ARG 134 1HG ARG 134 -4.487 13.963 -10.182 989 HD2 ARG 134 2HD ARG 134 -4.058 15.495 -8.295 990 HD3 ARG 134 1HD ARG 134 -4.459 16.878 -9.312 991 HE ARG 134 HE ARG 134 -6.269 15.106 -7.959 992 HH11 ARG 134 1HH1 ARG 134 -6.066 17.261 -10.743 993 HH12 ARG 134 2HH1 ARG 134 -7.780 17.518 -10.801 994 HH21 ARG 134 1HH2 ARG 134 -8.477 15.488 -8.033 995 HH22 ARG 134 2HH2 ARG 134 -9.147 16.514 -9.265 996 H ASP 135 H ASP 135 -1.218 15.798 -8.561 997 HA ASP 135 HA ASP 135 -0.762 13.961 -6.329 998 HB2 ASP 135 2HB ASP 135 0.866 15.760 -6.663 999 HB3 ASP 135 1HB ASP 135 -0.400 16.978 -6.569 1000 H LEU 136 H LEU 136 -1.959 14.032 -4.368 1001 HA LEU 136 HA LEU 136 -4.746 14.958 -4.756 1002 HB2 LEU 136 2HB LEU 136 -3.677 12.730 -2.977 1003 HB3 LEU 136 1HB LEU 136 -5.369 13.160 -3.186 1004 HG LEU 136 HG LEU 136 -3.551 12.029 -5.346 1005 HD11 LEU 136 1HD1 LEU 136 -4.146 10.360 -3.662 1006 HD12 LEU 136 2HD1 LEU 136 -4.931 10.007 -5.197 1007 HD13 LEU 136 3HD1 LEU 136 -5.859 10.725 -3.877 1008 HD21 LEU 136 3HD2 LEU 136 -5.192 13.545 -6.355 1009 HD22 LEU 136 1HD2 LEU 136 -6.506 12.712 -5.518 1010 HD23 LEU 136 2HD2 LEU 136 -5.572 11.874 -6.760 1011 H SER 137 H SER 137 -5.820 15.991 -3.160 1012 HA SER 137 HA SER 137 -4.345 17.086 -0.845 1013 HB2 SER 137 2HB SER 137 -6.104 18.667 -2.794 1014 HB3 SER 137 1HB SER 137 -5.376 19.311 -1.314 1015 HG SER 137 HG SER 137 -3.993 18.250 -3.552 1016 H ASP 138 H ASP 138 -6.060 18.277 0.619 1017 HA ASP 138 HA ASP 138 -8.052 16.431 1.444 1018 HB2 ASP 138 2HB ASP 138 -8.795 18.285 3.008 1019 HB3 ASP 138 1HB ASP 138 -7.099 17.862 3.125 1020 H GLY 139 H GLY 139 -9.577 15.951 -0.036 1021 HA2 GLY 139 2HA GLY 139 -11.938 16.836 -0.510 1022 HA3 GLY 139 1HA GLY 139 -11.111 18.136 -1.358 1023 H ASP 140 H ASP 140 -9.020 16.070 -2.195 1024 HA ASP 140 HA ASP 140 -10.200 15.048 -4.594 1025 HB2 ASP 140 2HB ASP 140 -7.549 14.463 -3.208 1026 HB3 ASP 140 1HB ASP 140 -8.013 13.705 -4.729 1027 H GLU 141 H GLU 141 -10.368 12.741 -5.136 1028 HA GLU 141 HA GLU 141 -10.676 10.915 -2.814 1029 HB2 GLU 141 2HB GLU 141 -12.232 11.037 -5.436 1030 HB3 GLU 141 1HB GLU 141 -12.323 9.676 -4.320 1031 HG2 GLU 141 2HG GLU 141 -13.343 11.000 -2.615 1032 HG3 GLU 141 1HG GLU 141 -12.954 12.501 -3.455 1033 H ILE 142 H ILE 142 -10.382 8.565 -3.508 1034 HA ILE 142 HA ILE 142 -8.371 8.065 -5.523 1035 HB ILE 142 HB ILE 142 -6.984 9.026 -3.741 1036 HG12 ILE 142 2HG1 ILE 142 -5.388 7.126 -3.353 1037 HG13 ILE 142 1HG1 ILE 142 -6.612 6.000 -3.922 1038 HG21 ILE 142 1HG2 ILE 142 -6.809 8.026 -1.492 1039 HG22 ILE 142 2HG2 ILE 142 -8.120 6.914 -1.881 1040 HG23 ILE 142 3HG2 ILE 142 -8.429 8.649 -1.813 1041 HD11 ILE 142 3HD1 ILE 142 -4.902 6.467 -5.613 1042 HD12 ILE 142 1HD1 ILE 142 -5.333 8.178 -5.591 1043 HD13 ILE 142 2HD1 ILE 142 -6.501 6.978 -6.153 1044 H THR 143 H THR 143 -8.037 5.838 -5.849 1045 HA THR 143 HA THR 143 -10.306 4.139 -5.134 1046 HB THR 143 HB THR 143 -8.085 3.710 -7.193 1047 HG1 THR 143 HG1 THR 143 -10.507 5.173 -7.303 1048 HG21 THR 143 3HG2 THR 143 -9.767 2.278 -8.308 1049 HG22 THR 143 1HG2 THR 143 -10.880 2.555 -6.943 1050 HG23 THR 143 2HG2 THR 143 -9.365 1.682 -6.702 1051 H LEU 144 H LEU 144 -10.067 2.246 -3.838 1052 HA LEU 144 HA LEU 144 -7.370 1.515 -2.875 1053 HB2 LEU 144 2HB LEU 144 -9.821 2.251 -1.258 1054 HB3 LEU 144 1HB LEU 144 -8.754 1.019 -0.630 1055 HG LEU 144 HG LEU 144 -8.295 3.173 0.416 1056 HD11 LEU 144 1HD1 LEU 144 -5.867 3.285 0.094 1057 HD12 LEU 144 2HD1 LEU 144 -6.005 2.334 -1.386 1058 HD13 LEU 144 3HD1 LEU 144 -6.424 1.614 0.167 1059 HD21 LEU 144 3HD2 LEU 144 -9.031 4.653 -1.433 1060 HD22 LEU 144 1HD2 LEU 144 -7.558 4.256 -2.324 1061 HD23 LEU 144 2HD2 LEU 144 -7.460 5.109 -0.784 1062 H ASP 145 H ASP 145 -7.462 -0.292 -4.298 1063 HA ASP 145 HA ASP 145 -9.328 -2.464 -3.552 1064 HB2 ASP 145 2HB ASP 145 -7.057 -2.538 -5.588 1065 HB3 ASP 145 1HB ASP 145 -8.292 -3.767 -5.352 1066 H PHE 146 H PHE 146 -8.706 -3.286 -1.613 1067 HA PHE 146 HA PHE 146 -6.046 -3.341 -0.591 1068 HB2 PHE 146 2HB PHE 146 -8.400 -5.024 0.371 1069 HB3 PHE 146 1HB PHE 146 -6.957 -4.596 1.297 1070 HD1 PHE 146 HD2 PHE 146 -6.565 -1.769 0.870 1071 HD2 PHE 146 HD1 PHE 146 -10.244 -3.904 1.313 1072 HE1 PHE 146 HE2 PHE 146 -7.674 0.289 1.607 1073 HE2 PHE 146 HE1 PHE 146 -11.348 -1.832 2.050 1074 HZ PHE 146 HZ PHE 146 -10.063 0.260 2.201 1075 H ASN 147 H ASN 147 -7.525 -5.312 -2.841 1076 HA ASN 147 HA ASN 147 -6.019 -7.708 -2.486 1077 HB2 ASN 147 2HB ASN 147 -7.379 -6.643 -5.000 1078 HB3 ASN 147 1HB ASN 147 -6.759 -8.280 -4.783 1079 HD21 ASN 147 1HD2 ASN 147 -8.427 -9.650 -4.505 1080 HD22 ASN 147 2HD2 ASN 147 -9.853 -9.343 -3.581 1081 H LEU 148 H LEU 148 -5.383 -4.612 -4.019 1082 HA LEU 148 HA LEU 148 -3.078 -5.495 -5.540 1083 HB2 LEU 148 2HB LEU 148 -3.922 -2.647 -4.867 1084 HB3 LEU 148 1HB LEU 148 -2.794 -3.132 -6.122 1085 HG LEU 148 HG LEU 148 -5.795 -3.588 -6.085 1086 HD11 LEU 148 1HD1 LEU 148 -4.121 -1.917 -7.975 1087 HD12 LEU 148 2HD1 LEU 148 -5.156 -1.305 -6.687 1088 HD13 LEU 148 3HD1 LEU 148 -5.870 -2.149 -8.058 1089 HD21 LEU 148 3HD2 LEU 148 -5.603 -4.638 -8.300 1090 HD22 LEU 148 1HD2 LEU 148 -4.787 -5.580 -7.052 1091 HD23 LEU 148 2HD2 LEU 148 -3.842 -4.594 -8.171 1092 H ALA 149 H ALA 149 -3.381 -5.415 -2.340 1093 HA ALA 149 HA ALA 149 -1.150 -3.955 -1.386 1094 HB1 ALA 149 3HB ALA 149 -3.004 -4.636 0.089 1095 HB2 ALA 149 1HB ALA 149 -1.464 -5.239 0.704 1096 HB3 ALA 149 2HB ALA 149 -2.576 -6.333 -0.127 1097 H TYR 150 H TYR 150 0.932 -4.432 -1.446 1098 HA TYR 150 HA TYR 150 1.772 -6.641 -3.156 1099 HB2 TYR 150 2HB TYR 150 3.524 -4.486 -1.891 1100 HB3 TYR 150 1HB TYR 150 3.911 -5.480 -3.297 1101 HD1 TYR 150 HD1 TYR 150 2.069 -5.283 -5.276 1102 HD2 TYR 150 HD2 TYR 150 2.807 -2.275 -2.329 1103 HE1 TYR 150 HE1 TYR 150 1.053 -3.597 -6.733 1104 HE2 TYR 150 HE2 TYR 150 1.807 -0.584 -3.806 1105 HH TYR 150 HH TYR 150 1.255 -0.192 -6.079 1106 H SER 151 H SER 151 2.945 -8.405 -2.544 1107 HA SER 151 HA SER 151 2.911 -9.532 -0.095 1108 HB2 SER 151 2HB SER 151 4.788 -11.018 -0.981 1109 HB3 SER 151 1HB SER 151 3.403 -10.856 -2.058 1110 HG SER 151 HG SER 151 5.748 -9.288 -2.252 1111 HA PRO 152 HA PRO 152 5.368 -6.434 1.972 1112 HB2 PRO 152 2HB PRO 152 5.209 -7.443 4.553 1113 HB3 PRO 152 1HB PRO 152 3.891 -6.568 3.752 1114 HG2 PRO 152 2HG PRO 152 4.274 -9.512 4.080 1115 HG3 PRO 152 1HG PRO 152 2.794 -8.541 4.252 1116 HD2 PRO 152 2HD PRO 152 3.291 -9.989 2.023 1117 HD3 PRO 152 1HD PRO 152 2.431 -8.438 1.965 1118 H PHE 153 H PHE 153 7.519 -6.277 1.788 1119 HA PHE 153 HA PHE 153 9.559 -7.983 1.701 1120 HB2 PHE 153 2HB PHE 153 9.635 -5.348 3.224 1121 HB3 PHE 153 1HB PHE 153 11.033 -6.193 2.583 1122 HD1 PHE 153 HD1 PHE 153 7.927 -4.375 1.568 1123 HD2 PHE 153 HD2 PHE 153 11.785 -5.744 0.361 1124 HE1 PHE 153 HE1 PHE 153 7.797 -2.968 -0.445 1125 HE2 PHE 153 HE2 PHE 153 11.650 -4.342 -1.651 1126 HZ PHE 153 HZ PHE 153 9.659 -2.950 -2.058 1127 H CYS 154 H CYS 154 8.233 -6.713 4.752 1128 HA CYS 154 HA CYS 154 10.036 -7.739 6.594 1129 HB2 CYS 154 2HB CYS 154 7.041 -7.382 7.015 1130 HB3 CYS 154 1HB CYS 154 8.283 -7.386 8.265 1131 HG CYS 154 HG CYS 154 9.304 -5.080 6.368 1132 H ALA 155 H ALA 155 7.007 -9.174 5.420 1133 HA ALA 155 HA ALA 155 7.029 -11.478 7.079 1134 HB1 ALA 155 3HB ALA 155 5.187 -12.234 5.638 1135 HB2 ALA 155 1HB ALA 155 5.554 -10.951 4.487 1136 HB3 ALA 155 2HB ALA 155 4.994 -10.547 6.113 1137 H TYR 156 H TYR 156 8.522 -10.804 4.015 1138 HA TYR 156 HA TYR 156 9.099 -13.654 3.502 1139 HB2 TYR 156 2HB TYR 156 9.195 -11.207 1.699 1140 HB3 TYR 156 1HB TYR 156 9.856 -12.769 1.216 1141 HD1 TYR 156 HD1 TYR 156 6.717 -10.939 1.963 1142 HD2 TYR 156 HD2 TYR 156 8.382 -14.655 0.702 1143 HE1 TYR 156 HE1 TYR 156 4.487 -11.707 1.293 1144 HE2 TYR 156 HE2 TYR 156 6.156 -15.424 0.014 1145 HH TYR 156 HH TYR 156 3.608 -13.516 -0.490 1146 H SER 157 H SER 157 10.595 -10.825 4.689 1147 HA SER 157 HA SER 157 13.074 -12.273 5.161 1148 HB2 SER 157 2HB SER 157 13.027 -9.595 3.701 1149 HB3 SER 157 1HB SER 157 14.478 -10.354 4.352 1150 HG SER 157 HG SER 157 13.237 -12.132 2.816 1151 H ASP 158 H ASP 158 13.276 -12.067 7.293 1152 HA ASP 158 HA ASP 158 11.834 -10.159 8.872 1153 HB2 ASP 158 2HB ASP 158 13.977 -12.149 9.733 1154 HB3 ASP 158 1HB ASP 158 12.869 -11.299 10.809 1155 H THR 159 H THR 159 14.833 -9.995 7.341 1156 HA THR 159 HA THR 159 16.302 -8.310 9.092 1157 HB THR 159 HB THR 159 17.508 -9.497 7.360 1158 HG1 THR 159 HG1 THR 159 17.603 -6.764 6.555 1159 HG21 THR 159 3HG2 THR 159 15.916 -7.915 5.315 1160 HG22 THR 159 1HG2 THR 159 15.740 -9.638 5.641 1161 HG23 THR 159 2HG2 THR 159 17.243 -9.020 4.948 1162 H PHE 160 H PHE 160 13.543 -7.636 7.105 1163 HA PHE 160 HA PHE 160 14.216 -4.865 6.515 1164 HB2 PHE 160 2HB PHE 160 11.838 -6.644 5.904 1165 HB3 PHE 160 1HB PHE 160 11.701 -4.899 5.713 1166 HD1 PHE 160 HD2 PHE 160 13.745 -7.836 4.617 1167 HD2 PHE 160 HD1 PHE 160 12.508 -3.841 3.741 1168 HE1 PHE 160 HE2 PHE 160 14.825 -7.977 2.414 1169 HE2 PHE 160 HE1 PHE 160 13.607 -3.990 1.545 1170 HZ PHE 160 HZ PHE 160 14.762 -6.057 0.875 1171 H SER 161 H SER 161 13.708 -3.193 7.714 1172 HA SER 161 HA SER 161 12.745 -3.473 10.397 1173 HB2 SER 161 2HB SER 161 13.264 -0.911 8.805 1174 HB3 SER 161 1HB SER 161 13.235 -1.082 10.561 1175 HG SER 161 HG SER 161 14.983 -2.833 9.637 1176 H CYS 162 H CYS 162 10.518 -3.789 10.748 1177 HA CYS 162 HA CYS 162 8.645 -3.504 8.677 1178 HB2 CYS 162 2HB CYS 162 8.417 -5.158 10.498 1179 HB3 CYS 162 1HB CYS 162 8.182 -3.864 11.670 1180 HG CYS 162 HG CYS 162 6.007 -5.360 9.690 1181 HA PRO 163 HA PRO 163 7.806 0.869 9.075 1182 HB2 PRO 163 2HB PRO 163 5.422 1.027 7.675 1183 HB3 PRO 163 1HB PRO 163 7.002 0.842 6.888 1184 HG2 PRO 163 2HG PRO 163 4.933 -1.237 7.475 1185 HG3 PRO 163 1HG PRO 163 5.923 -0.999 6.016 1186 HD2 PRO 163 2HD PRO 163 6.542 -2.875 7.886 1187 HD3 PRO 163 1HD PRO 163 7.786 -2.035 6.935 1188 H LEU 164 H LEU 164 7.250 1.629 11.059 1189 HA LEU 164 HA LEU 164 5.490 0.673 12.908 1190 HB2 LEU 164 2HB LEU 164 7.280 2.484 13.132 1191 HB3 LEU 164 1HB LEU 164 6.111 3.632 12.522 1192 HG LEU 164 HG LEU 164 6.449 3.661 15.038 1193 HD11 LEU 164 1HD1 LEU 164 4.093 3.889 15.676 1194 HD12 LEU 164 2HD1 LEU 164 3.589 3.060 14.204 1195 HD13 LEU 164 3HD1 LEU 164 4.385 4.631 14.102 1196 HD21 LEU 164 3HD2 LEU 164 5.455 1.896 16.425 1197 HD22 LEU 164 1HD2 LEU 164 6.727 1.241 15.395 1198 HD23 LEU 164 2HD2 LEU 164 5.032 0.974 14.982 1199 HA PRO 165 HA PRO 165 1.650 1.936 10.787 1200 HB2 PRO 165 2HB PRO 165 0.054 -0.090 11.648 1201 HB3 PRO 165 1HB PRO 165 1.314 -0.356 10.426 1202 HG2 PRO 165 2HG PRO 165 1.264 -1.168 13.273 1203 HG3 PRO 165 1HG PRO 165 2.111 -1.912 11.902 1204 HD2 PRO 165 2HD PRO 165 3.210 -0.117 13.868 1205 HD3 PRO 165 1HD PRO 165 4.029 -0.799 12.448 1206 HA PRO 166 HA PRO 166 -0.023 4.233 14.461 1207 HB2 PRO 166 2HB PRO 166 -1.761 5.797 12.966 1208 HB3 PRO 166 1HB PRO 166 -0.040 6.185 13.160 1209 HG2 PRO 166 2HG PRO 166 -1.409 4.799 10.883 1210 HG3 PRO 166 1HG PRO 166 -0.179 6.085 10.842 1211 HD2 PRO 166 2HD PRO 166 0.491 3.516 10.417 1212 HD3 PRO 166 1HD PRO 166 1.574 4.611 11.301 1213 H GLU 167 H GLU 167 -1.775 3.490 15.657 1214 HA GLU 167 HA GLU 167 -2.951 1.075 14.976 1215 HB2 GLU 167 2HB GLU 167 -3.983 3.043 17.053 1216 HB3 GLU 167 1HB GLU 167 -4.329 1.313 17.000 1217 HG2 GLU 167 2HG GLU 167 -1.862 0.885 17.277 1218 HG3 GLU 167 1HG GLU 167 -1.642 2.620 17.507 1219 H SER 168 H SER 168 -4.114 4.171 14.046 1220 HA SER 168 HA SER 168 -6.899 3.529 13.663 1221 HB2 SER 168 2HB SER 168 -5.294 5.867 12.558 1222 HB3 SER 168 1HB SER 168 -7.050 5.785 12.753 1223 HG SER 168 HG SER 168 -5.134 6.436 14.563 1224 H ASN 169 H ASN 169 -4.143 2.736 11.839 1225 HA ASN 169 HA ASN 169 -5.473 2.754 9.210 1226 HB2 ASN 169 2HB ASN 169 -3.349 2.319 8.212 1227 HB3 ASN 169 1HB ASN 169 -3.015 3.483 9.481 1228 HD21 ASN 169 1HD2 ASN 169 -1.145 1.643 8.205 1229 HD22 ASN 169 2HD2 ASN 169 -0.476 0.672 9.458 1230 H TRP 170 H TRP 170 -5.262 0.766 11.866 1231 HA TRP 170 HA TRP 170 -4.951 -1.804 10.592 1232 HB2 TRP 170 2HB TRP 170 -5.915 -1.067 13.392 1233 HB3 TRP 170 1HB TRP 170 -5.673 -2.719 12.835 1234 HD1 TRP 170 HD1 TRP 170 -2.774 -1.476 11.339 1235 HE1 TRP 170 HE1 TRP 170 -0.733 -1.438 12.891 1236 HE3 TRP 170 HE3 TRP 170 -5.148 -1.894 15.851 1237 HZ2 TRP 170 HZ2 TRP 170 -0.177 -1.580 15.649 1238 HZ3 TRP 170 HZ3 TRP 170 -3.783 -1.953 17.902 1239 HH2 TRP 170 HH2 TRP 170 -1.345 -1.800 17.802 1240 H LEU 171 H LEU 171 -6.525 -2.759 9.446 1241 HA LEU 171 HA LEU 171 -9.301 -1.930 9.621 1242 HB2 LEU 171 2HB LEU 171 -8.147 -4.299 8.086 1243 HB3 LEU 171 1HB LEU 171 -9.712 -3.544 7.841 1244 HG LEU 171 HG LEU 171 -6.989 -2.378 7.137 1245 HD11 LEU 171 1HD1 LEU 171 -7.819 -4.089 5.566 1246 HD12 LEU 171 2HD1 LEU 171 -7.740 -2.495 4.819 1247 HD13 LEU 171 3HD1 LEU 171 -9.297 -3.150 5.324 1248 HD21 LEU 171 3HD2 LEU 171 -8.157 -0.426 6.201 1249 HD22 LEU 171 1HD2 LEU 171 -8.394 -0.546 7.944 1250 HD23 LEU 171 2HD2 LEU 171 -9.691 -1.022 6.842 1251 H GLU 172 H GLU 172 -10.505 -2.663 11.346 1252 HA GLU 172 HA GLU 172 -9.613 -5.017 12.837 1253 HB2 GLU 172 2HB GLU 172 -10.218 -2.805 13.936 1254 HB3 GLU 172 1HB GLU 172 -11.894 -3.085 13.470 1255 HG2 GLU 172 2HG GLU 172 -12.018 -5.046 14.902 1256 HG3 GLU 172 1HG GLU 172 -10.294 -4.954 15.262 1257 H THR 173 H THR 173 -10.300 -5.870 10.527 1258 HA THR 173 HA THR 173 -12.626 -7.538 10.887 1259 HB THR 173 HB THR 173 -13.639 -5.635 9.729 1260 HG1 THR 173 HG1 THR 173 -14.612 -7.335 8.911 1261 HG21 THR 173 3HG2 THR 173 -11.619 -4.652 8.652 1262 HG22 THR 173 1HG2 THR 173 -12.936 -4.883 7.504 1263 HG23 THR 173 2HG2 THR 173 -11.577 -6.010 7.521 1264 H ALA 174 H ALA 174 -12.550 -9.356 9.482 1265 HA ALA 174 HA ALA 174 -9.886 -10.232 8.743 1266 HB1 ALA 174 3HB ALA 174 -12.607 -11.568 8.438 1267 HB2 ALA 174 1HB ALA 174 -11.487 -11.794 9.782 1268 HB3 ALA 174 2HB ALA 174 -11.048 -12.349 8.167 1269 H VAL 175 H VAL 175 -9.011 -9.832 6.744 1270 HA VAL 175 HA VAL 175 -10.785 -9.024 4.512 1271 HB VAL 175 HB VAL 175 -7.768 -8.551 4.899 1272 HG11 VAL 175 1HG1 VAL 175 -9.520 -7.726 2.546 1273 HG12 VAL 175 2HG1 VAL 175 -8.214 -8.910 2.512 1274 HG13 VAL 175 3HG1 VAL 175 -7.851 -7.211 2.808 1275 HG21 VAL 175 3HG2 VAL 175 -10.104 -6.586 4.864 1276 HG22 VAL 175 1HG2 VAL 175 -8.400 -6.160 5.056 1277 HG23 VAL 175 2HG2 VAL 175 -9.218 -7.108 6.298 1278 H THR 176 H THR 176 -11.459 -11.132 4.031 1279 HA THR 176 HA THR 176 -9.522 -12.924 2.745 1280 HB THR 176 HB THR 176 -11.620 -14.396 2.439 1281 HG1 THR 176 HG1 THR 176 -13.089 -12.542 2.869 1282 HG21 THR 176 3HG2 THR 176 -10.825 -13.712 5.297 1283 HG22 THR 176 1HG2 THR 176 -9.969 -14.835 4.236 1284 HG23 THR 176 2HG2 THR 176 -11.610 -15.201 4.769 1285 H ALA 177 H ALA 177 -8.961 -11.880 0.944 1286 HA ALA 177 HA ALA 177 -10.800 -11.691 -1.284 1287 HB1 ALA 177 3HB ALA 177 -11.130 -9.475 -0.232 1288 HB2 ALA 177 1HB ALA 177 -10.288 -9.314 -1.774 1289 HB3 ALA 177 2HB ALA 177 -9.390 -9.188 -0.259 1290 H GLY 178 H GLY 178 -9.636 -11.718 -3.259 1291 HA2 GLY 178 2HA GLY 178 -8.021 -12.611 -4.588 1292 HA3 GLY 178 1HA GLY 178 -6.910 -11.625 -3.652 1293 H GLU 179 H GLU 179 -5.229 -13.065 -3.585 1294 HA GLU 179 HA GLU 179 -5.191 -15.798 -3.351 1295 HB2 GLU 179 2HB GLU 179 -3.123 -13.891 -2.180 1296 HB3 GLU 179 1HB GLU 179 -2.846 -15.574 -2.614 1297 HG2 GLU 179 2HG GLU 179 -3.452 -13.283 -4.506 1298 HG3 GLU 179 1HG GLU 179 -1.908 -14.108 -4.306 1299 H ARG 180 H ARG 180 -5.817 -17.147 -1.869 1300 HA ARG 180 HA ARG 180 -6.684 -16.324 0.772 1301 HB2 ARG 180 2HB ARG 180 -6.861 -19.049 -0.617 1302 HB3 ARG 180 1HB ARG 180 -7.630 -18.631 0.909 1303 HG2 ARG 180 2HG ARG 180 -9.377 -18.486 -0.647 1304 HG3 ARG 180 1HG ARG 180 -8.889 -16.808 -0.412 1305 HD2 ARG 180 2HD ARG 180 -7.512 -16.974 -2.505 1306 HD3 ARG 180 1HD ARG 180 -8.163 -18.596 -2.760 1307 HE ARG 180 HE ARG 180 -10.387 -17.039 -2.524 1308 HH11 ARG 180 1HH1 ARG 180 -7.544 -16.846 -4.608 1309 HH12 ARG 180 2HH1 ARG 180 -8.408 -16.093 -5.912 1310 HH21 ARG 180 1HH2 ARG 180 -11.489 -16.060 -4.230 1311 HH22 ARG 180 2HH2 ARG 180 -10.654 -15.645 -5.694 1312 H THR 181 H THR 181 -6.374 -18.658 2.219 1313 HA THR 181 HA THR 181 -3.725 -18.583 3.239 1314 HB THR 181 HB THR 181 -5.860 -20.735 3.686 1315 HG1 THR 181 HG1 THR 181 -5.678 -18.076 4.552 1316 HG21 THR 181 3HG2 THR 181 -3.693 -19.717 5.573 1317 HG22 THR 181 1HG2 THR 181 -3.614 -21.239 4.683 1318 HG23 THR 181 2HG2 THR 181 -4.857 -20.998 5.911 1319 H ASP 182 H ASP 182 -1.965 -19.898 2.682 1320 HA ASP 182 HA ASP 182 -2.126 -21.656 0.394 1321 HB2 ASP 182 2HB ASP 182 0.279 -21.886 0.602 1322 HB3 ASP 182 1HB ASP 182 -0.128 -20.202 0.901 1323 H LEU 183 H LEU 183 -0.689 -23.805 0.773 1324 HA LEU 183 HA LEU 183 -2.396 -25.503 2.294 1325 HB2 LEU 183 2HB LEU 183 -1.158 -27.382 1.479 1326 HB3 LEU 183 1HB LEU 183 -1.426 -26.269 0.161 1327 HG LEU 183 HG LEU 183 1.233 -26.582 1.608 1328 HD11 LEU 183 1HD1 LEU 183 1.996 -27.881 -0.336 1329 HD12 LEU 183 2HD1 LEU 183 0.377 -27.803 -1.039 1330 HD13 LEU 183 3HD1 LEU 183 0.645 -28.681 0.470 1331 HD21 LEU 183 3HD2 LEU 183 0.572 -25.174 -0.999 1332 HD22 LEU 183 1HD2 LEU 183 2.195 -25.423 -0.347 1333 HD23 LEU 183 2HD2 LEU 183 1.046 -24.403 0.517 1334 H GLU 184 H GLU 184 1.160 -24.870 2.710 1335 HA GLU 184 HA GLU 184 1.112 -25.102 5.564 1336 HB2 GLU 184 2HB GLU 184 2.012 -27.553 3.990 1337 HB3 GLU 184 1HB GLU 184 2.639 -27.219 5.598 1338 HG2 GLU 184 2HG GLU 184 0.342 -27.349 6.514 1339 HG3 GLU 184 1HG GLU 184 -0.266 -27.707 4.901 1340 H HIS 185 H HIS 185 2.459 -23.312 5.630 1341 HA HIS 185 HA HIS 185 5.066 -23.994 6.190 1342 HB2 HIS 185 2HB HIS 185 6.505 -22.887 4.615 1343 HB3 HIS 185 1HB HIS 185 5.430 -23.886 3.649 1344 HD1 HIS 185 HD1 HIS 185 3.071 -22.030 3.256 1345 HD2 HIS 185 HD2 HIS 185 6.981 -20.719 3.105 1346 HE1 HIS 185 HE1 HIS 185 2.992 -19.884 1.946 1347 HE2 HIS 185 HE2 HIS 185 5.367 -19.104 1.927 Start of MODEL 9 1 H1 MET 1 1H MET 1 -20.915 0.948 -19.063 2 H2 MET 1 2H MET 1 -21.903 2.317 -19.025 3 H3 MET 1 3H MET 1 -20.865 1.989 -17.732 4 HA MET 1 HA MET 1 -20.023 2.628 -20.492 5 HB2 MET 1 2HB MET 1 -19.886 4.340 -17.963 6 HB3 MET 1 1HB MET 1 -19.258 4.804 -19.543 7 HG2 MET 1 2HG MET 1 -22.174 4.368 -18.823 8 HG3 MET 1 1HG MET 1 -21.386 5.917 -19.135 9 HE1 MET 1 3HE MET 1 -23.788 5.379 -22.258 10 HE2 MET 1 1HE MET 1 -23.421 6.431 -20.891 11 HE3 MET 1 2HE MET 1 -24.110 4.831 -20.612 12 H ASP 2 H ASP 2 -19.054 0.401 -19.880 13 HA ASP 2 HA ASP 2 -17.171 0.123 -17.808 14 HB2 ASP 2 2HB ASP 2 -17.671 -1.550 -20.296 15 HB3 ASP 2 1HB ASP 2 -16.459 -1.995 -19.097 16 H GLU 3 H GLU 3 -16.753 1.447 -21.011 17 HA GLU 3 HA GLU 3 -14.007 1.094 -21.443 18 HB2 GLU 3 2HB GLU 3 -15.718 3.515 -22.148 19 HB3 GLU 3 1HB GLU 3 -14.110 3.198 -22.799 20 HG2 GLU 3 2HG GLU 3 -14.914 1.168 -23.895 21 HG3 GLU 3 1HG GLU 3 -16.513 1.386 -23.189 22 H ASP 4 H ASP 4 -15.684 3.532 -19.521 23 HA ASP 4 HA ASP 4 -13.413 5.070 -18.721 24 HB2 ASP 4 2HB ASP 4 -15.757 5.929 -18.727 25 HB3 ASP 4 1HB ASP 4 -16.182 4.799 -17.452 26 H THR 5 H THR 5 -15.069 2.243 -17.427 27 HA THR 5 HA THR 5 -13.858 2.245 -14.828 28 HB THR 5 HB THR 5 -15.284 -0.046 -16.265 29 HG1 THR 5 HG1 THR 5 -16.264 2.197 -14.826 30 HG21 THR 5 3HG2 THR 5 -15.843 -0.842 -13.995 31 HG22 THR 5 1HG2 THR 5 -14.929 0.492 -13.285 32 HG23 THR 5 2HG2 THR 5 -14.094 -0.763 -14.202 33 H GLU 6 H GLU 6 -13.215 0.491 -17.873 34 HA GLU 6 HA GLU 6 -11.251 -1.290 -16.730 35 HB2 GLU 6 2HB GLU 6 -11.048 -2.210 -18.983 36 HB3 GLU 6 1HB GLU 6 -12.750 -1.969 -18.599 37 HG2 GLU 6 2HG GLU 6 -12.622 0.221 -19.889 38 HG3 GLU 6 1HG GLU 6 -11.024 -0.285 -20.430 39 H ASP 7 H ASP 7 -11.156 1.904 -17.708 40 HA ASP 7 HA ASP 7 -8.551 2.231 -18.715 41 HB2 ASP 7 2HB ASP 7 -10.269 4.028 -18.637 42 HB3 ASP 7 1HB ASP 7 -10.124 4.101 -16.885 43 H TRP 8 H TRP 8 -9.736 1.914 -15.405 44 HA TRP 8 HA TRP 8 -7.632 2.004 -13.763 45 HB2 TRP 8 2HB TRP 8 -9.860 1.253 -13.071 46 HB3 TRP 8 1HB TRP 8 -9.654 -0.260 -13.936 47 HD1 TRP 8 HD1 TRP 8 -7.649 1.528 -11.068 48 HE1 TRP 8 HE1 TRP 8 -7.182 -0.225 -9.247 49 HE3 TRP 8 HE3 TRP 8 -9.775 -2.585 -13.281 50 HZ2 TRP 8 HZ2 TRP 8 -7.634 -2.955 -8.797 51 HZ3 TRP 8 HZ3 TRP 8 -9.708 -4.732 -12.074 52 HH2 TRP 8 HH2 TRP 8 -8.655 -4.909 -9.878 53 H GLU 9 H GLU 9 -8.320 -0.987 -15.674 54 HA GLU 9 HA GLU 9 -5.881 -2.257 -14.865 55 HB2 GLU 9 2HB GLU 9 -6.510 -4.127 -16.253 56 HB3 GLU 9 1HB GLU 9 -7.956 -3.547 -15.430 57 HG2 GLU 9 2HG GLU 9 -8.681 -2.401 -17.484 58 HG3 GLU 9 1HG GLU 9 -7.213 -2.921 -18.305 59 H THR 10 H THR 10 -6.622 -0.007 -17.326 60 HA THR 10 HA THR 10 -4.829 -0.779 -19.381 61 HB THR 10 HB THR 10 -5.984 1.981 -18.749 62 HG1 THR 10 HG1 THR 10 -7.179 -0.259 -19.565 63 HG21 THR 10 3HG2 THR 10 -4.097 2.135 -20.353 64 HG22 THR 10 1HG2 THR 10 -5.637 2.478 -21.146 65 HG23 THR 10 2HG2 THR 10 -4.857 0.910 -21.371 66 H GLN 11 H GLN 11 -4.533 1.847 -16.863 67 HA GLN 11 HA GLN 11 -1.716 2.101 -17.219 68 HB2 GLN 11 2HB GLN 11 -1.698 3.418 -15.153 69 HB3 GLN 11 1HB GLN 11 -3.015 3.923 -16.203 70 HG2 GLN 11 2HG GLN 11 -4.660 2.911 -14.795 71 HG3 GLN 11 1HG GLN 11 -3.441 2.038 -13.867 72 HE21 GLN 11 1HE2 GLN 11 -5.502 3.861 -12.902 73 HE22 GLN 11 2HE2 GLN 11 -4.667 5.119 -12.062 74 H LEU 12 H LEU 12 -3.735 0.041 -15.197 75 HA LEU 12 HA LEU 12 -1.903 -0.478 -13.117 76 HB2 LEU 12 2HB LEU 12 -4.319 -0.747 -12.880 77 HB3 LEU 12 1HB LEU 12 -4.309 -2.061 -14.039 78 HG LEU 12 HG LEU 12 -3.035 -3.479 -12.477 79 HD11 LEU 12 1HD1 LEU 12 -3.168 -1.167 -10.522 80 HD12 LEU 12 2HD1 LEU 12 -1.719 -1.780 -11.324 81 HD13 LEU 12 3HD1 LEU 12 -2.581 -2.797 -10.175 82 HD21 LEU 12 3HD2 LEU 12 -5.516 -2.266 -11.226 83 HD22 LEU 12 1HD2 LEU 12 -4.790 -3.815 -10.791 84 HD23 LEU 12 2HD2 LEU 12 -5.463 -3.583 -12.402 85 H GLN 13 H GLN 13 -2.364 -2.109 -16.218 86 HA GLN 13 HA GLN 13 -1.007 -4.503 -15.769 87 HB2 GLN 13 2HB GLN 13 -0.548 -4.534 -18.193 88 HB3 GLN 13 1HB GLN 13 -2.197 -4.018 -17.863 89 HG2 GLN 13 2HG GLN 13 -1.465 -1.646 -18.182 90 HG3 GLN 13 1HG GLN 13 0.126 -2.240 -18.651 91 HE21 GLN 13 1HE2 GLN 13 -2.962 -3.746 -19.558 92 HE22 GLN 13 2HE2 GLN 13 -2.811 -3.405 -21.245 93 H ALA 14 H ALA 14 0.260 -1.264 -16.301 94 HA ALA 14 HA ALA 14 3.065 -2.088 -16.290 95 HB1 ALA 14 3HB ALA 14 3.502 0.300 -16.707 96 HB2 ALA 14 1HB ALA 14 1.785 0.669 -16.479 97 HB3 ALA 14 2HB ALA 14 2.307 -0.326 -17.839 98 H ASN 15 H ASN 15 0.748 -0.302 -14.234 99 HA ASN 15 HA ASN 15 2.487 0.657 -12.255 100 HB2 ASN 15 2HB ASN 15 -0.484 -0.017 -12.074 101 HB3 ASN 15 1HB ASN 15 0.399 0.782 -10.776 102 HD21 ASN 15 1HD2 ASN 15 -0.799 2.687 -10.877 103 HD22 ASN 15 2HD2 ASN 15 -0.729 3.780 -12.213 104 H ARG 16 H ARG 16 0.911 -2.503 -12.509 105 HA ARG 16 HA ARG 16 1.861 -3.367 -9.889 106 HB2 ARG 16 2HB ARG 16 0.718 -5.439 -10.283 107 HB3 ARG 16 1HB ARG 16 -0.344 -4.154 -10.845 108 HG2 ARG 16 2HG ARG 16 0.288 -4.651 -13.183 109 HG3 ARG 16 1HG ARG 16 1.366 -5.934 -12.621 110 HD2 ARG 16 2HD ARG 16 -1.654 -5.843 -12.314 111 HD3 ARG 16 1HD ARG 16 -0.731 -6.895 -13.392 112 HE ARG 16 HE ARG 16 0.110 -7.276 -10.720 113 HH11 ARG 16 1HH1 ARG 16 -2.592 -8.100 -12.835 114 HH12 ARG 16 2HH1 ARG 16 -3.027 -9.506 -11.915 115 HH21 ARG 16 1HH2 ARG 16 -0.549 -9.066 -9.488 116 HH22 ARG 16 2HH2 ARG 16 -1.878 -10.050 -10.029 117 H ASP 17 H ASP 17 2.767 -3.583 -13.250 118 HA ASP 17 HA ASP 17 4.415 -5.887 -13.176 119 HB2 ASP 17 2HB ASP 17 3.456 -5.012 -15.268 120 HB3 ASP 17 1HB ASP 17 4.402 -3.539 -15.128 121 H GLU 18 H GLU 18 5.101 -2.436 -12.784 122 HA GLU 18 HA GLU 18 7.919 -2.567 -12.636 123 HB2 GLU 18 2HB GLU 18 7.749 -0.338 -11.482 124 HB3 GLU 18 1HB GLU 18 6.859 -0.433 -12.998 125 HG2 GLU 18 2HG GLU 18 4.755 -0.734 -11.765 126 HG3 GLU 18 1HG GLU 18 5.631 -0.681 -10.236 127 H LYS 19 H LYS 19 5.463 -3.357 -10.316 128 HA LYS 19 HA LYS 19 7.260 -3.346 -8.017 129 HB2 LYS 19 2HB LYS 19 4.329 -4.172 -8.206 130 HB3 LYS 19 1HB LYS 19 5.246 -3.940 -6.720 131 HG2 LYS 19 2HG LYS 19 4.575 -1.767 -8.741 132 HG3 LYS 19 1HG LYS 19 3.777 -2.013 -7.187 133 HD2 LYS 19 2HD LYS 19 5.822 -1.470 -5.981 134 HD3 LYS 19 1HD LYS 19 6.744 -1.391 -7.485 135 HE2 LYS 19 2HE LYS 19 6.278 0.856 -6.714 136 HE3 LYS 19 1HE LYS 19 5.350 0.561 -8.183 137 HZ1 LYS 19 3HZ LYS 19 4.279 0.409 -5.419 138 HZ2 LYS 19 1HZ LYS 19 3.383 0.205 -6.841 139 HZ3 LYS 19 2HZ LYS 19 4.070 1.710 -6.477 140 H ASP 20 H ASP 20 5.662 -5.661 -10.166 141 HA ASP 20 HA ASP 20 6.465 -8.030 -8.762 142 HB2 ASP 20 2HB ASP 20 5.564 -7.627 -11.652 143 HB3 ASP 20 1HB ASP 20 5.787 -9.201 -10.896 144 H ARG 21 H ARG 21 7.857 -6.023 -11.316 145 HA ARG 21 HA ARG 21 10.172 -7.780 -11.677 146 HB2 ARG 21 2HB ARG 21 10.863 -6.391 -13.462 147 HB3 ARG 21 1HB ARG 21 9.110 -6.449 -13.605 148 HG2 ARG 21 2HG ARG 21 8.908 -4.232 -12.651 149 HG3 ARG 21 1HG ARG 21 10.638 -4.165 -12.319 150 HD2 ARG 21 2HD ARG 21 9.405 -4.364 -15.076 151 HD3 ARG 21 1HD ARG 21 9.976 -2.875 -14.323 152 HE ARG 21 HE ARG 21 11.689 -5.166 -15.078 153 HH11 ARG 21 1HH1 ARG 21 11.316 -1.679 -14.592 154 HH12 ARG 21 2HH1 ARG 21 12.923 -1.318 -15.145 155 HH21 ARG 21 1HH2 ARG 21 13.758 -4.673 -15.814 156 HH22 ARG 21 2HH2 ARG 21 14.312 -3.026 -15.842 157 H PHE 22 H PHE 22 9.257 -5.165 -9.616 158 HA PHE 22 HA PHE 22 11.744 -4.042 -9.018 159 HB2 PHE 22 2HB PHE 22 9.474 -3.294 -8.098 160 HB3 PHE 22 1HB PHE 22 9.576 -4.616 -6.943 161 HD1 PHE 22 HD2 PHE 22 11.324 -4.566 -5.127 162 HD2 PHE 22 HD1 PHE 22 10.798 -1.287 -7.831 163 HE1 PHE 22 HE2 PHE 22 12.644 -3.119 -3.639 164 HE2 PHE 22 HE1 PHE 22 12.117 0.149 -6.333 165 HZ PHE 22 HZ PHE 22 13.037 -0.764 -4.245 166 H PHE 23 H PHE 23 10.135 -6.861 -7.576 167 HA PHE 23 HA PHE 23 12.366 -7.618 -5.927 168 HB2 PHE 23 2HB PHE 23 9.747 -8.996 -6.635 169 HB3 PHE 23 1HB PHE 23 10.942 -9.733 -5.574 170 HD1 PHE 23 HD2 PHE 23 9.196 -6.379 -5.880 171 HD2 PHE 23 HD1 PHE 23 10.493 -9.530 -3.285 172 HE1 PHE 23 HE2 PHE 23 8.210 -5.210 -3.953 173 HE2 PHE 23 HE1 PHE 23 9.500 -8.349 -1.368 174 HZ PHE 23 HZ PHE 23 8.362 -6.189 -1.696 175 H SER 24 H SER 24 11.727 -8.055 -9.268 176 HA SER 24 HA SER 24 13.117 -10.664 -9.424 177 HB2 SER 24 2HB SER 24 10.836 -10.472 -10.441 178 HB3 SER 24 1HB SER 24 11.442 -9.230 -11.537 179 HG SER 24 HG SER 24 12.013 -11.989 -11.456 180 H GLU 25 H GLU 25 13.403 -7.281 -10.436 181 HA GLU 25 HA GLU 25 15.757 -7.917 -12.124 182 HB2 GLU 25 2HB GLU 25 13.601 -5.849 -12.790 183 HB3 GLU 25 1HB GLU 25 15.056 -6.172 -13.729 184 HG2 GLU 25 2HG GLU 25 14.167 -8.538 -14.075 185 HG3 GLU 25 1HG GLU 25 12.656 -7.977 -13.354 186 H HIS 26 H HIS 26 14.027 -5.310 -10.365 187 HA HIS 26 HA HIS 26 16.164 -3.414 -10.470 188 HB2 HIS 26 2HB HIS 26 13.801 -2.735 -10.151 189 HB3 HIS 26 1HB HIS 26 13.741 -3.579 -8.612 190 HD2 HIS 26 HD2 HIS 26 14.652 -0.124 -10.030 191 HE1 HIS 26 HE1 HIS 26 15.848 -0.222 -5.973 192 HE2 HIS 26 HE2 HIS 26 15.238 1.274 -7.923 193 H ARG 27 H ARG 27 14.857 -5.093 -7.620 194 HA ARG 27 HA ARG 27 17.570 -5.457 -6.494 195 HB2 ARG 27 2HB ARG 27 14.892 -5.255 -5.030 196 HB3 ARG 27 1HB ARG 27 16.423 -5.650 -4.256 197 HG2 ARG 27 2HG ARG 27 15.738 -3.036 -5.620 198 HG3 ARG 27 1HG ARG 27 15.815 -3.313 -3.882 199 HD2 ARG 27 2HD ARG 27 18.171 -3.592 -5.781 200 HD3 ARG 27 1HD ARG 27 17.834 -2.170 -4.792 201 HE ARG 27 HE ARG 27 17.952 -4.440 -3.126 202 HH11 ARG 27 1HH1 ARG 27 20.133 -2.418 -5.015 203 HH12 ARG 27 2HH1 ARG 27 21.501 -2.747 -4.006 204 HH21 ARG 27 1HH2 ARG 27 19.760 -4.850 -1.805 205 HH22 ARG 27 2HH2 ARG 27 21.291 -4.124 -2.187 206 H GLN 28 H GLN 28 18.081 -7.518 -5.654 207 HA GLN 28 HA GLN 28 16.585 -9.814 -6.538 208 HB2 GLN 28 2HB GLN 28 18.712 -9.680 -4.351 209 HB3 GLN 28 1HB GLN 28 18.157 -11.132 -5.179 210 HG2 GLN 28 2HG GLN 28 19.700 -8.834 -6.423 211 HG3 GLN 28 1HG GLN 28 20.343 -10.423 -6.019 212 HE21 GLN 28 1HE2 GLN 28 18.384 -8.606 -8.251 213 HE22 GLN 28 2HE2 GLN 28 18.273 -9.835 -9.458 214 H SER 29 H SER 29 15.012 -10.928 -5.427 215 HA SER 29 HA SER 29 13.247 -9.579 -3.836 216 HB2 SER 29 2HB SER 29 13.569 -12.607 -3.886 217 HB3 SER 29 1HB SER 29 12.099 -11.708 -3.517 218 HG SER 29 HG SER 29 13.426 -11.428 -5.986 219 HA PRO 30 HA PRO 30 14.808 -9.954 0.540 220 HB2 PRO 30 2HB PRO 30 11.939 -9.074 0.945 221 HB3 PRO 30 1HB PRO 30 13.424 -8.458 1.706 222 HG2 PRO 30 2HG PRO 30 12.218 -7.040 -0.196 223 HG3 PRO 30 1HG PRO 30 13.996 -7.139 -0.134 224 HD2 PRO 30 2HD PRO 30 12.087 -8.574 -1.967 225 HD3 PRO 30 1HD PRO 30 13.678 -7.867 -2.329 226 H ILE 31 H ILE 31 12.054 -11.291 -1.131 227 HA ILE 31 HA ILE 31 11.091 -13.216 0.656 228 HB ILE 31 HB ILE 31 11.381 -13.965 -2.278 229 HG12 ILE 31 2HG1 ILE 31 10.742 -11.587 -2.418 230 HG13 ILE 31 1HG1 ILE 31 9.430 -12.616 -2.965 231 HG21 ILE 31 1HG2 ILE 31 9.126 -14.923 -1.979 232 HG22 ILE 31 2HG2 ILE 31 9.076 -14.309 -0.326 233 HG23 ILE 31 3HG2 ILE 31 10.257 -15.543 -0.772 234 HD11 ILE 31 3HD1 ILE 31 8.606 -10.748 -1.711 235 HD12 ILE 31 1HD1 ILE 31 9.615 -11.175 -0.332 236 HD13 ILE 31 2HD1 ILE 31 8.291 -12.236 -0.819 237 HA PRO 32 HA PRO 32 15.006 -15.483 1.152 238 HB2 PRO 32 2HB PRO 32 13.262 -17.650 2.313 239 HB3 PRO 32 1HB PRO 32 14.662 -16.824 3.033 240 HG2 PRO 32 2HG PRO 32 12.214 -16.246 3.883 241 HG3 PRO 32 1HG PRO 32 13.413 -14.948 3.668 242 HD2 PRO 32 2HD PRO 32 11.145 -15.736 1.840 243 HD3 PRO 32 1HD PRO 32 11.669 -14.115 2.353 244 HA PRO 33 HA PRO 33 15.620 -17.608 -2.559 245 HB2 PRO 33 2HB PRO 33 17.283 -19.775 -1.828 246 HB3 PRO 33 1HB PRO 33 17.821 -18.106 -2.086 247 HG2 PRO 33 2HG PRO 33 17.108 -19.473 0.496 248 HG3 PRO 33 1HG PRO 33 18.486 -18.400 0.130 249 HD2 PRO 33 2HD PRO 33 16.404 -17.427 1.437 250 HD3 PRO 33 1HD PRO 33 17.142 -16.458 0.139 251 H GLU 34 H GLU 34 14.887 -20.060 -0.068 252 HA GLU 34 HA GLU 34 13.962 -22.006 -2.015 253 HB2 GLU 34 2HB GLU 34 13.573 -23.514 -0.139 254 HB3 GLU 34 1HB GLU 34 15.157 -22.778 0.017 255 HG2 GLU 34 2HG GLU 34 12.726 -21.826 1.554 256 HG3 GLU 34 1HG GLU 34 13.835 -23.050 2.160 257 H GLU 35 H GLU 35 12.485 -19.703 0.252 258 HA GLU 35 HA GLU 35 9.820 -20.533 0.073 259 HB2 GLU 35 2HB GLU 35 10.833 -17.668 0.371 260 HB3 GLU 35 1HB GLU 35 9.219 -18.240 0.779 261 HG2 GLU 35 2HG GLU 35 11.805 -19.019 2.147 262 HG3 GLU 35 1HG GLU 35 10.564 -17.942 2.786 263 H ARG 36 H ARG 36 11.576 -18.104 -1.923 264 HA ARG 36 HA ARG 36 9.348 -17.485 -3.602 265 HB2 ARG 36 2HB ARG 36 10.926 -16.090 -4.823 266 HB3 ARG 36 1HB ARG 36 11.222 -15.908 -3.096 267 HG2 ARG 36 2HG ARG 36 13.122 -17.533 -3.299 268 HG3 ARG 36 1HG ARG 36 12.864 -17.557 -5.044 269 HD2 ARG 36 2HD ARG 36 13.724 -15.198 -3.347 270 HD3 ARG 36 1HD ARG 36 14.681 -16.053 -4.557 271 HE ARG 36 HE ARG 36 12.737 -13.990 -4.999 272 HH11 ARG 36 1HH1 ARG 36 14.308 -16.711 -6.603 273 HH12 ARG 36 2HH1 ARG 36 14.030 -16.068 -8.190 274 HH21 ARG 36 1HH2 ARG 36 12.461 -13.147 -7.045 275 HH22 ARG 36 2HH2 ARG 36 12.979 -14.038 -8.441 276 H ASP 37 H ASP 37 11.519 -20.118 -3.567 277 HA ASP 37 HA ASP 37 11.705 -20.659 -6.365 278 HB2 ASP 37 2HB ASP 37 13.317 -21.593 -4.745 279 HB3 ASP 37 1HB ASP 37 12.039 -22.521 -3.968 280 H ASP 38 H ASP 38 9.460 -21.608 -3.805 281 HA ASP 38 HA ASP 38 7.875 -23.386 -5.415 282 HB2 ASP 38 2HB ASP 38 7.247 -22.013 -2.764 283 HB3 ASP 38 1HB ASP 38 6.236 -23.254 -3.504 284 H PHE 39 H PHE 39 7.783 -19.946 -4.698 285 HA PHE 39 HA PHE 39 5.219 -19.638 -6.174 286 HB2 PHE 39 2HB PHE 39 6.493 -17.722 -4.155 287 HB3 PHE 39 1HB PHE 39 4.908 -17.545 -4.902 288 HD1 PHE 39 HD2 PHE 39 3.030 -19.036 -4.229 289 HD2 PHE 39 HD1 PHE 39 6.829 -19.231 -2.276 290 HE1 PHE 39 HE2 PHE 39 2.034 -20.313 -2.377 291 HE2 PHE 39 HE1 PHE 39 5.822 -20.515 -0.440 292 HZ PHE 39 HZ PHE 39 3.424 -21.057 -0.492 293 H ASP 40 H ASP 40 5.888 -19.308 -8.301 294 HA ASP 40 HA ASP 40 7.976 -17.359 -8.908 295 HB2 ASP 40 2HB ASP 40 7.758 -19.392 -10.305 296 HB3 ASP 40 1HB ASP 40 6.117 -18.938 -10.749 297 H GLY 41 H GLY 41 6.984 -15.621 -7.839 298 HA2 GLY 41 2HA GLY 41 6.110 -13.537 -9.187 299 HA3 GLY 41 1HA GLY 41 4.574 -14.388 -8.990 300 H LEU 42 H LEU 42 5.025 -11.816 -7.857 301 HA LEU 42 HA LEU 42 5.155 -12.194 -5.009 302 HB2 LEU 42 2HB LEU 42 3.872 -9.957 -6.627 303 HB3 LEU 42 1HB LEU 42 4.047 -9.944 -4.877 304 HG LEU 42 HG LEU 42 6.308 -9.892 -6.917 305 HD11 LEU 42 1HD1 LEU 42 5.380 -7.754 -4.972 306 HD12 LEU 42 2HD1 LEU 42 5.156 -7.750 -6.725 307 HD13 LEU 42 3HD1 LEU 42 6.778 -7.649 -6.049 308 HD21 LEU 42 3HD2 LEU 42 7.851 -9.697 -5.015 309 HD22 LEU 42 1HD2 LEU 42 6.983 -11.229 -4.980 310 HD23 LEU 42 2HD2 LEU 42 6.515 -9.925 -3.885 311 H SER 43 H SER 43 3.906 -14.022 -4.657 312 HA SER 43 HA SER 43 1.184 -14.302 -5.524 313 HB2 SER 43 2HB SER 43 1.203 -16.288 -3.923 314 HB3 SER 43 1HB SER 43 2.474 -16.321 -5.141 315 HG SER 43 HG SER 43 2.816 -15.382 -2.481 316 H TYR 44 H TYR 44 -0.468 -13.257 -4.679 317 HA TYR 44 HA TYR 44 -1.025 -12.690 -1.987 318 HB2 TYR 44 2HB TYR 44 0.793 -10.732 -3.257 319 HB3 TYR 44 1HB TYR 44 -0.697 -9.951 -2.743 320 HD1 TYR 44 HD2 TYR 44 -1.468 -10.378 -0.290 321 HD2 TYR 44 HD1 TYR 44 2.521 -11.129 -1.629 322 HE1 TYR 44 HE2 TYR 44 -0.682 -10.357 2.030 323 HE2 TYR 44 HE1 TYR 44 3.304 -11.114 0.698 324 HH TYR 44 HH TYR 44 1.099 -11.034 3.388 325 H PHE 45 H PHE 45 -2.488 -10.320 -2.274 326 HA PHE 45 HA PHE 45 -4.890 -11.316 -3.444 327 HB2 PHE 45 2HB PHE 45 -4.378 -8.414 -2.656 328 HB3 PHE 45 1HB PHE 45 -5.928 -9.254 -2.725 329 HD1 PHE 45 HD1 PHE 45 -5.611 -11.691 -1.241 330 HD2 PHE 45 HD2 PHE 45 -3.864 -7.863 -0.422 331 HE1 PHE 45 HE1 PHE 45 -5.356 -12.303 1.130 332 HE2 PHE 45 HE2 PHE 45 -3.621 -8.491 1.941 333 HZ PHE 45 HZ PHE 45 -4.354 -10.706 2.714 334 H ASP 46 H ASP 46 -5.546 -11.174 -5.502 335 HA ASP 46 HA ASP 46 -3.886 -9.723 -7.443 336 HB2 ASP 46 2HB ASP 46 -4.306 -12.125 -7.848 337 HB3 ASP 46 1HB ASP 46 -6.039 -11.832 -7.889 338 HA PRO 47 HA PRO 47 -6.488 -6.090 -7.789 339 HB2 PRO 47 2HB PRO 47 -6.401 -6.133 -10.708 340 HB3 PRO 47 1HB PRO 47 -5.480 -5.113 -9.593 341 HG2 PRO 47 2HG PRO 47 -4.692 -7.668 -10.886 342 HG3 PRO 47 1HG PRO 47 -3.678 -6.301 -10.372 343 HD2 PRO 47 2HD PRO 47 -3.640 -8.565 -8.978 344 HD3 PRO 47 1HD PRO 47 -3.652 -7.005 -8.112 345 H ASP 48 H ASP 48 -8.542 -6.475 -7.232 346 HA ASP 48 HA ASP 48 -10.405 -7.664 -9.199 347 HB2 ASP 48 2HB ASP 48 -9.793 -8.999 -6.955 348 HB3 ASP 48 1HB ASP 48 -10.930 -7.881 -6.216 349 HA PRO 49 HA PRO 49 -12.209 -3.521 -8.677 350 HB2 PRO 49 2HB PRO 49 -14.529 -4.552 -10.253 351 HB3 PRO 49 1HB PRO 49 -13.373 -3.262 -10.652 352 HG2 PRO 49 2HG PRO 49 -13.326 -5.602 -11.962 353 HG3 PRO 49 1HG PRO 49 -11.827 -4.721 -11.584 354 HD2 PRO 49 2HD PRO 49 -13.044 -7.075 -10.130 355 HD3 PRO 49 1HD PRO 49 -11.354 -6.816 -10.635 356 H ASP 50 H ASP 50 -13.580 -6.468 -7.590 357 HA ASP 50 HA ASP 50 -16.055 -5.613 -6.516 358 HB2 ASP 50 2HB ASP 50 -15.631 -7.969 -6.895 359 HB3 ASP 50 1HB ASP 50 -14.264 -7.963 -5.792 360 H TYR 51 H TYR 51 -12.819 -5.880 -4.960 361 HA TYR 51 HA TYR 51 -13.975 -4.970 -2.391 362 HB2 TYR 51 2HB TYR 51 -12.266 -7.010 -2.724 363 HB3 TYR 51 1HB TYR 51 -11.050 -5.742 -2.668 364 HD1 TYR 51 HD2 TYR 51 -10.875 -4.304 -0.534 365 HD2 TYR 51 HD1 TYR 51 -13.344 -7.782 -0.716 366 HE1 TYR 51 HE2 TYR 51 -11.000 -4.339 1.917 367 HE2 TYR 51 HE1 TYR 51 -13.465 -7.815 1.731 368 HH TYR 51 HH TYR 51 -12.094 -6.972 3.680 369 H ARG 52 H ARG 52 -13.009 -3.462 -5.030 370 HA ARG 52 HA ARG 52 -11.158 -1.470 -4.147 371 HB2 ARG 52 2HB ARG 52 -11.629 -2.210 -6.553 372 HB3 ARG 52 1HB ARG 52 -13.144 -1.319 -6.465 373 HG2 ARG 52 2HG ARG 52 -11.905 0.780 -6.150 374 HG3 ARG 52 1HG ARG 52 -10.380 -0.112 -6.157 375 HD2 ARG 52 2HD ARG 52 -11.092 -0.925 -8.530 376 HD3 ARG 52 1HD ARG 52 -12.280 0.385 -8.466 377 HE ARG 52 HE ARG 52 -9.377 0.837 -8.104 378 HH11 ARG 52 1HH1 ARG 52 -12.382 1.714 -9.680 379 HH12 ARG 52 2HH1 ARG 52 -11.690 3.085 -10.489 380 HH21 ARG 52 1HH2 ARG 52 -8.500 2.656 -9.096 381 HH22 ARG 52 2HH2 ARG 52 -9.485 3.623 -10.156 382 H VAL 53 H VAL 53 -11.626 0.235 -2.789 383 HA VAL 53 HA VAL 53 -14.446 1.196 -2.563 384 HB VAL 53 HB VAL 53 -14.116 1.762 -0.217 385 HG11 VAL 53 1HG1 VAL 53 -13.129 -1.078 -0.704 386 HG12 VAL 53 2HG1 VAL 53 -14.813 -0.552 -0.669 387 HG13 VAL 53 3HG1 VAL 53 -13.836 -0.465 0.796 388 HG21 VAL 53 3HG2 VAL 53 -12.025 1.268 1.019 389 HG22 VAL 53 1HG2 VAL 53 -11.760 2.447 -0.269 390 HG23 VAL 53 2HG2 VAL 53 -11.246 0.773 -0.487 391 H GLU 54 H GLU 54 -14.361 3.520 -1.444 392 HA GLU 54 HA GLU 54 -12.208 5.172 -2.637 393 HB2 GLU 54 2HB GLU 54 -13.902 6.903 -3.201 394 HB3 GLU 54 1HB GLU 54 -14.169 5.410 -4.092 395 HG2 GLU 54 2HG GLU 54 -16.030 4.811 -2.658 396 HG3 GLU 54 1HG GLU 54 -15.707 6.172 -1.589 397 H ALA 55 H ALA 55 -11.851 7.195 -1.491 398 HA ALA 55 HA ALA 55 -12.906 7.369 1.243 399 HB1 ALA 55 3HB ALA 55 -10.880 5.972 1.403 400 HB2 ALA 55 1HB ALA 55 -10.656 7.523 2.217 401 HB3 ALA 55 2HB ALA 55 -9.931 7.242 0.630 402 H THR 56 H THR 56 -12.823 9.385 2.146 403 HA THR 56 HA THR 56 -12.211 11.695 0.475 404 HB THR 56 HB THR 56 -13.338 11.543 3.311 405 HG1 THR 56 HG1 THR 56 -14.479 10.905 0.982 406 HG21 THR 56 3HG2 THR 56 -14.122 13.855 2.891 407 HG22 THR 56 1HG2 THR 56 -13.318 13.846 1.318 408 HG23 THR 56 2HG2 THR 56 -12.363 13.760 2.801 409 H VAL 57 H VAL 57 -10.295 12.714 0.651 410 HA VAL 57 HA VAL 57 -8.194 11.731 2.332 411 HB VAL 57 HB VAL 57 -8.158 14.200 0.527 412 HG11 VAL 57 1HG1 VAL 57 -5.743 13.778 0.353 413 HG12 VAL 57 2HG1 VAL 57 -5.894 12.384 1.422 414 HG13 VAL 57 3HG1 VAL 57 -6.221 14.004 2.038 415 HG21 VAL 57 3HG2 VAL 57 -8.981 12.283 -0.779 416 HG22 VAL 57 1HG2 VAL 57 -7.576 11.331 -0.291 417 HG23 VAL 57 2HG2 VAL 57 -7.366 12.761 -1.304 418 H THR 58 H THR 58 -7.498 12.594 4.237 419 HA THR 58 HA THR 58 -8.446 15.271 5.105 420 HB THR 58 HB THR 58 -7.696 12.885 6.868 421 HG1 THR 58 HG1 THR 58 -9.895 12.628 7.181 422 HG21 THR 58 3HG2 THR 58 -8.929 15.571 7.603 423 HG22 THR 58 1HG2 THR 58 -7.292 15.037 7.997 424 HG23 THR 58 2HG2 THR 58 -8.684 14.220 8.711 425 H VAL 59 H VAL 59 -6.695 16.525 4.438 426 HA VAL 59 HA VAL 59 -3.968 15.448 4.674 427 HB VAL 59 HB VAL 59 -5.065 17.867 3.170 428 HG11 VAL 59 1HG1 VAL 59 -2.119 17.171 3.524 429 HG12 VAL 59 2HG1 VAL 59 -2.925 18.597 4.177 430 HG13 VAL 59 3HG1 VAL 59 -2.757 18.402 2.432 431 HG21 VAL 59 3HG2 VAL 59 -4.094 16.703 1.206 432 HG22 VAL 59 1HG2 VAL 59 -5.286 15.703 2.040 433 HG23 VAL 59 2HG2 VAL 59 -3.563 15.387 2.257 434 H HIS 60 H HIS 60 -2.597 16.095 6.154 435 HA HIS 60 HA HIS 60 -3.395 18.028 8.193 436 HB2 HIS 60 2HB HIS 60 -1.139 15.978 8.021 437 HB3 HIS 60 1HB HIS 60 -1.341 17.097 9.375 438 HD1 HIS 60 HD1 HIS 60 -2.971 14.095 7.765 439 HD2 HIS 60 HD2 HIS 60 -3.453 16.512 11.108 440 HE1 HIS 60 HE1 HIS 60 -4.770 13.010 9.139 441 HE2 HIS 60 HE2 HIS 60 -5.174 14.599 11.034 442 H GLU 61 H GLU 61 -2.834 20.031 7.966 443 HA GLU 61 HA GLU 61 -1.046 21.092 6.032 444 HB2 GLU 61 2HB GLU 61 -1.516 23.270 7.048 445 HB3 GLU 61 1HB GLU 61 -3.000 22.332 6.944 446 HG2 GLU 61 2HG GLU 61 -2.734 21.725 9.361 447 HG3 GLU 61 1HG GLU 61 -1.332 22.789 9.438 448 H THR 62 H THR 62 -0.523 19.844 9.178 449 HA THR 62 HA THR 62 2.326 20.637 9.137 450 HB THR 62 HB THR 62 2.272 20.184 11.610 451 HG1 THR 62 HG1 THR 62 0.456 18.811 11.700 452 HG21 THR 62 3HG2 THR 62 0.235 22.264 10.724 453 HG22 THR 62 1HG2 THR 62 1.981 22.518 10.833 454 HG23 THR 62 2HG2 THR 62 1.040 22.212 12.294 455 HA PRO 63 HA PRO 63 2.372 16.085 8.262 456 HB2 PRO 63 2HB PRO 63 4.795 16.034 6.981 457 HB3 PRO 63 1HB PRO 63 3.305 16.557 6.174 458 HG2 PRO 63 2HG PRO 63 5.512 18.227 7.320 459 HG3 PRO 63 1HG PRO 63 4.598 18.450 5.812 460 HD2 PRO 63 2HD PRO 63 4.059 19.846 8.128 461 HD3 PRO 63 1HD PRO 63 2.841 19.511 6.880 462 H GLU 64 H GLU 64 2.924 14.677 9.855 463 HA GLU 64 HA GLU 64 5.135 15.356 11.714 464 HB2 GLU 64 2HB GLU 64 3.846 13.985 13.383 465 HB3 GLU 64 1HB GLU 64 2.987 15.408 12.809 466 HG2 GLU 64 2HG GLU 64 1.670 13.974 11.263 467 HG3 GLU 64 1HG GLU 64 2.505 12.557 11.895 468 H SER 65 H SER 65 6.386 13.586 12.665 469 HA SER 65 HA SER 65 7.334 11.922 10.480 470 HB2 SER 65 2HB SER 65 9.288 11.567 12.064 471 HB3 SER 65 1HB SER 65 8.963 13.243 11.642 472 HG SER 65 HG SER 65 7.861 12.109 13.985 473 H VAL 66 H VAL 66 6.900 9.812 10.234 474 HA VAL 66 HA VAL 66 6.315 8.062 12.547 475 HB VAL 66 HB VAL 66 4.984 7.792 9.802 476 HG11 VAL 66 1HG1 VAL 66 5.130 5.679 11.045 477 HG12 VAL 66 2HG1 VAL 66 3.453 6.215 10.921 478 HG13 VAL 66 3HG1 VAL 66 4.332 6.419 12.438 479 HG21 VAL 66 3HG2 VAL 66 4.171 9.874 10.748 480 HG22 VAL 66 1HG2 VAL 66 3.810 9.090 12.291 481 HG23 VAL 66 2HG2 VAL 66 2.891 8.665 10.848 482 H ASP 67 H ASP 67 7.585 6.246 12.578 483 HA ASP 67 HA ASP 67 9.689 5.928 10.620 484 HB2 ASP 67 2HB ASP 67 8.973 4.270 13.079 485 HB3 ASP 67 1HB ASP 67 10.399 3.992 12.085 486 H LEU 68 H LEU 68 9.187 5.007 8.697 487 HA LEU 68 HA LEU 68 7.839 2.362 8.681 488 HB2 LEU 68 2HB LEU 68 7.590 4.438 6.464 489 HB3 LEU 68 1HB LEU 68 6.826 2.859 6.511 490 HG LEU 68 HG LEU 68 6.153 5.207 8.329 491 HD11 LEU 68 1HD1 LEU 68 4.591 4.009 6.027 492 HD12 LEU 68 2HD1 LEU 68 5.445 5.555 6.016 493 HD13 LEU 68 3HD1 LEU 68 4.065 5.323 7.082 494 HD21 LEU 68 3HD2 LEU 68 4.255 3.869 9.108 495 HD22 LEU 68 1HD2 LEU 68 5.780 3.070 9.481 496 HD23 LEU 68 2HD2 LEU 68 4.795 2.499 8.133 497 H GLU 69 H GLU 69 8.892 0.810 7.411 498 HA GLU 69 HA GLU 69 11.557 1.373 6.501 499 HB2 GLU 69 2HB GLU 69 11.612 -0.995 5.773 500 HB3 GLU 69 1HB GLU 69 11.063 -0.820 7.432 501 HG2 GLU 69 2HG GLU 69 8.709 -1.101 6.638 502 HG3 GLU 69 1HG GLU 69 9.330 -1.407 5.016 503 H THR 70 H THR 70 12.341 1.307 4.404 504 HA THR 70 HA THR 70 10.431 2.134 2.303 505 HB THR 70 HB THR 70 12.144 3.807 2.856 506 HG1 THR 70 HG1 THR 70 11.550 3.751 0.686 507 HG21 THR 70 3HG2 THR 70 14.550 3.435 2.468 508 HG22 THR 70 1HG2 THR 70 14.234 1.742 2.075 509 HG23 THR 70 2HG2 THR 70 13.940 2.338 3.711 510 H SER 71 H SER 71 11.570 1.599 0.016 511 HA SER 71 HA SER 71 11.821 -1.329 -0.124 512 HB2 SER 71 2HB SER 71 11.290 -0.854 -2.591 513 HB3 SER 71 1HB SER 71 10.006 -0.446 -1.453 514 HG SER 71 HG SER 71 11.658 1.236 -2.958 515 H ASP 72 H ASP 72 13.942 0.610 0.674 516 HA ASP 72 HA ASP 72 15.986 0.227 -1.420 517 HB2 ASP 72 2HB ASP 72 15.080 2.598 -1.406 518 HB3 ASP 72 1HB ASP 72 15.620 2.757 0.258 519 H ASP 73 H ASP 73 15.620 -1.576 0.433 520 HA ASP 73 HA ASP 73 16.402 -2.799 2.144 521 HB2 ASP 73 2HB ASP 73 18.900 -3.142 2.111 522 HB3 ASP 73 1HB ASP 73 18.102 -3.300 0.558 523 H ARG 74 H ARG 74 15.539 -0.373 3.243 524 HA ARG 74 HA ARG 74 17.168 -0.189 5.661 525 HB2 ARG 74 2HB ARG 74 18.004 1.419 3.695 526 HB3 ARG 74 1HB ARG 74 16.632 2.408 4.168 527 HG2 ARG 74 2HG ARG 74 17.567 2.734 6.391 528 HG3 ARG 74 1HG ARG 74 18.859 1.577 6.064 529 HD2 ARG 74 2HD ARG 74 18.456 4.238 4.645 530 HD3 ARG 74 1HD ARG 74 19.662 3.906 5.892 531 HE ARG 74 HE ARG 74 20.794 2.431 4.375 532 HH11 ARG 74 1HH1 ARG 74 18.281 4.357 2.826 533 HH12 ARG 74 2HH1 ARG 74 18.934 4.140 1.235 534 HH21 ARG 74 1HH2 ARG 74 21.612 2.136 2.297 535 HH22 ARG 74 2HH2 ARG 74 20.836 2.873 0.934 536 H THR 75 H THR 75 16.121 1.904 6.886 537 HA THR 75 HA THR 75 13.200 1.840 6.816 538 HB THR 75 HB THR 75 14.786 1.384 9.400 539 HG1 THR 75 HG1 THR 75 12.911 -0.444 8.333 540 HG21 THR 75 3HG2 THR 75 11.772 1.488 8.945 541 HG22 THR 75 1HG2 THR 75 12.726 2.714 9.787 542 HG23 THR 75 2HG2 THR 75 12.568 1.095 10.471 543 H VAL 76 H VAL 76 12.352 3.871 7.545 544 HA VAL 76 HA VAL 76 14.264 6.067 7.846 545 HB VAL 76 HB VAL 76 13.423 7.216 5.716 546 HG11 VAL 76 1HG1 VAL 76 15.685 6.267 5.804 547 HG12 VAL 76 2HG1 VAL 76 14.985 6.076 4.197 548 HG13 VAL 76 3HG1 VAL 76 15.065 4.693 5.293 549 HG21 VAL 76 3HG2 VAL 76 12.507 5.811 3.915 550 HG22 VAL 76 1HG2 VAL 76 11.442 5.820 5.322 551 HG23 VAL 76 2HG2 VAL 76 12.467 4.419 5.002 552 H ARG 77 H ARG 77 13.257 8.155 7.951 553 HA ARG 77 HA ARG 77 10.729 8.204 9.329 554 HB2 ARG 77 2HB ARG 77 12.656 9.638 9.980 555 HB3 ARG 77 1HB ARG 77 12.585 10.461 8.432 556 HG2 ARG 77 2HG ARG 77 10.162 10.514 10.221 557 HG3 ARG 77 1HG ARG 77 11.534 11.538 10.623 558 HD2 ARG 77 2HD ARG 77 10.093 11.600 7.948 559 HD3 ARG 77 1HD ARG 77 9.733 12.678 9.295 560 HE ARG 77 HE ARG 77 11.958 13.600 9.099 561 HH11 ARG 77 1HH1 ARG 77 10.945 11.672 6.323 562 HH12 ARG 77 2HH1 ARG 77 12.071 12.435 5.246 563 HH21 ARG 77 1HH2 ARG 77 13.393 14.597 7.664 564 HH22 ARG 77 2HH2 ARG 77 13.453 14.089 6.006 565 H TYR 78 H TYR 78 8.837 8.244 8.268 566 HA TYR 78 HA TYR 78 8.520 9.663 5.689 567 HB2 TYR 78 2HB TYR 78 6.812 7.615 7.158 568 HB3 TYR 78 1HB TYR 78 6.090 8.656 5.943 569 HD1 TYR 78 HD2 TYR 78 9.300 6.664 6.101 570 HD2 TYR 78 HD1 TYR 78 5.698 7.476 3.956 571 HE1 TYR 78 HE2 TYR 78 9.963 5.060 4.363 572 HE2 TYR 78 HE1 TYR 78 6.357 5.858 2.224 573 HH TYR 78 HH TYR 78 8.767 3.592 2.649 574 H LEU 79 H LEU 79 6.853 11.255 5.505 575 HA LEU 79 HA LEU 79 5.981 12.520 8.030 576 HB2 LEU 79 2HB LEU 79 6.414 13.680 5.256 577 HB3 LEU 79 1HB LEU 79 5.518 14.536 6.498 578 HG LEU 79 HG LEU 79 8.464 13.775 6.593 579 HD11 LEU 79 1HD1 LEU 79 8.866 16.188 6.630 580 HD12 LEU 79 2HD1 LEU 79 7.130 16.499 6.530 581 HD13 LEU 79 3HD1 LEU 79 7.969 15.719 5.187 582 HD21 LEU 79 3HD2 LEU 79 7.541 13.505 8.837 583 HD22 LEU 79 1HD2 LEU 79 6.812 15.114 8.766 584 HD23 LEU 79 2HD2 LEU 79 8.569 14.931 8.770 585 H HIS 80 H HIS 80 3.889 12.699 8.480 586 HA HIS 80 HA HIS 80 1.983 11.169 6.930 587 HB2 HIS 80 2HB HIS 80 2.117 10.890 9.388 588 HB3 HIS 80 1HB HIS 80 1.740 12.591 9.620 589 HD2 HIS 80 HD2 HIS 80 -0.288 10.176 7.252 590 HE1 HIS 80 HE1 HIS 80 -2.760 11.442 10.422 591 HE2 HIS 80 HE2 HIS 80 -2.683 10.274 8.192 592 H VAL 81 H VAL 81 1.328 12.259 5.210 593 HA VAL 81 HA VAL 81 0.782 15.141 5.321 594 HB VAL 81 HB VAL 81 0.742 15.051 2.855 595 HG11 VAL 81 1HG1 VAL 81 3.139 14.541 2.519 596 HG12 VAL 81 2HG1 VAL 81 3.189 13.704 4.072 597 HG13 VAL 81 3HG1 VAL 81 2.872 15.441 4.013 598 HG21 VAL 81 3HG2 VAL 81 1.323 12.977 1.629 599 HG22 VAL 81 1HG2 VAL 81 -0.183 12.781 2.527 600 HG23 VAL 81 2HG2 VAL 81 1.308 12.066 3.143 601 H ALA 82 H ALA 82 -0.955 12.093 5.024 602 HA ALA 82 HA ALA 82 -3.515 13.542 4.940 603 HB1 ALA 82 3HB ALA 82 -2.950 13.261 2.560 604 HB2 ALA 82 1HB ALA 82 -4.354 12.284 2.994 605 HB3 ALA 82 2HB ALA 82 -2.774 11.521 2.791 606 H THR 83 H THR 83 -5.365 12.195 5.345 607 HA THR 83 HA THR 83 -4.904 9.427 6.233 608 HB THR 83 HB THR 83 -6.587 11.463 7.795 609 HG1 THR 83 HG1 THR 83 -4.576 10.201 9.150 610 HG21 THR 83 3HG2 THR 83 -5.999 8.540 8.422 611 HG22 THR 83 1HG2 THR 83 -7.558 9.172 7.879 612 HG23 THR 83 2HG2 THR 83 -6.904 9.656 9.444 613 H LEU 84 H LEU 84 -5.943 8.439 4.637 614 HA LEU 84 HA LEU 84 -8.210 9.521 3.235 615 HB2 LEU 84 2HB LEU 84 -7.103 6.694 2.991 616 HB3 LEU 84 1HB LEU 84 -7.974 7.619 1.778 617 HG LEU 84 HG LEU 84 -5.119 8.107 2.726 618 HD11 LEU 84 1HD1 LEU 84 -6.123 7.223 0.008 619 HD12 LEU 84 2HD1 LEU 84 -5.310 6.210 1.205 620 HD13 LEU 84 3HD1 LEU 84 -4.441 7.544 0.451 621 HD21 LEU 84 3HD2 LEU 84 -4.971 9.906 1.057 622 HD22 LEU 84 1HD2 LEU 84 -6.161 10.267 2.306 623 HD23 LEU 84 2HD2 LEU 84 -6.694 9.735 0.711 624 H SER 85 H SER 85 -10.028 9.604 4.399 625 HA SER 85 HA SER 85 -10.803 7.563 6.349 626 HB2 SER 85 2HB SER 85 -10.806 9.909 7.066 627 HB3 SER 85 1HB SER 85 -11.875 10.359 5.739 628 HG SER 85 HG SER 85 -13.250 10.108 7.362 629 H PHE 86 H PHE 86 -12.436 6.145 6.009 630 HA PHE 86 HA PHE 86 -14.529 6.504 4.036 631 HB2 PHE 86 2HB PHE 86 -13.954 4.463 2.715 632 HB3 PHE 86 1HB PHE 86 -12.730 5.708 2.558 633 HD1 PHE 86 HD1 PHE 86 -10.513 5.442 3.713 634 HD2 PHE 86 HD2 PHE 86 -13.396 2.284 3.659 635 HE1 PHE 86 HE1 PHE 86 -8.777 3.839 4.374 636 HE2 PHE 86 HE2 PHE 86 -11.651 0.688 4.326 637 HZ PHE 86 HZ PHE 86 -9.343 1.464 4.687 638 H ASP 87 H ASP 87 -15.539 4.044 3.821 639 HA ASP 87 HA ASP 87 -15.728 2.877 6.553 640 HB2 ASP 87 2HB ASP 87 -18.091 2.432 6.234 641 HB3 ASP 87 1HB ASP 87 -17.824 4.141 5.922 642 H LEU 88 H LEU 88 -15.953 0.601 6.604 643 HA LEU 88 HA LEU 88 -15.847 -0.992 4.180 644 HB2 LEU 88 2HB LEU 88 -13.447 -0.194 4.564 645 HB3 LEU 88 1HB LEU 88 -13.460 -1.078 6.083 646 HG LEU 88 HG LEU 88 -13.861 -3.208 4.780 647 HD11 LEU 88 1HD1 LEU 88 -13.483 -3.232 2.354 648 HD12 LEU 88 2HD1 LEU 88 -13.362 -1.469 2.345 649 HD13 LEU 88 3HD1 LEU 88 -14.884 -2.249 2.776 650 HD21 LEU 88 3HD2 LEU 88 -11.615 -2.601 5.530 651 HD22 LEU 88 1HD2 LEU 88 -11.346 -1.682 4.047 652 HD23 LEU 88 2HD2 LEU 88 -11.553 -3.436 3.978 653 H ASP 89 H ASP 89 -16.630 -3.017 4.565 654 HA ASP 89 HA ASP 89 -17.592 -4.809 5.531 655 HB2 ASP 89 2HB ASP 89 -15.459 -5.113 6.751 656 HB3 ASP 89 1HB ASP 89 -16.019 -4.028 8.017 657 H GLY 90 H GLY 90 -17.502 -2.629 8.339 658 HA2 GLY 90 2HA GLY 90 -20.145 -1.595 8.080 659 HA3 GLY 90 1HA GLY 90 -20.104 -2.883 9.286 660 H GLU 91 H GLU 91 -17.238 -1.053 8.816 661 HA GLU 91 HA GLU 91 -17.613 0.516 11.291 662 HB2 GLU 91 2HB GLU 91 -15.266 -0.215 11.953 663 HB3 GLU 91 1HB GLU 91 -16.456 -1.513 11.972 664 HG2 GLU 91 2HG GLU 91 -15.633 -2.175 9.665 665 HG3 GLU 91 1HG GLU 91 -14.336 -1.006 9.868 666 H SER 92 H SER 92 -16.510 2.474 11.332 667 HA SER 92 HA SER 92 -15.854 3.666 8.802 668 HB2 SER 92 2HB SER 92 -17.090 4.885 10.586 669 HB3 SER 92 1HB SER 92 -15.676 4.799 11.631 670 HG SER 92 HG SER 92 -14.566 6.101 10.118 671 H ARG 93 H ARG 93 -13.959 3.020 7.923 672 HA ARG 93 HA ARG 93 -11.556 2.688 9.621 673 HB2 ARG 93 2HB ARG 93 -12.184 1.632 6.842 674 HB3 ARG 93 1HB ARG 93 -10.644 1.407 7.649 675 HG2 ARG 93 2HG ARG 93 -13.306 0.314 8.613 676 HG3 ARG 93 1HG ARG 93 -12.058 -0.604 7.764 677 HD2 ARG 93 2HD ARG 93 -11.679 -1.154 10.009 678 HD3 ARG 93 1HD ARG 93 -10.494 0.124 9.723 679 HE ARG 93 HE ARG 93 -13.071 0.942 10.824 680 HH11 ARG 93 1HH1 ARG 93 -9.719 0.143 11.534 681 HH12 ARG 93 2HH1 ARG 93 -9.750 0.912 13.087 682 HH21 ARG 93 1HH2 ARG 93 -13.082 1.922 12.875 683 HH22 ARG 93 2HH2 ARG 93 -11.646 1.913 13.845 684 H ASP 94 H ASP 94 -9.786 3.885 9.321 685 HA ASP 94 HA ASP 94 -9.548 5.628 6.934 686 HB2 ASP 94 2HB ASP 94 -8.568 7.393 8.354 687 HB3 ASP 94 1HB ASP 94 -10.203 7.011 8.876 688 H LEU 95 H LEU 95 -7.669 5.425 5.882 689 HA LEU 95 HA LEU 95 -5.381 4.047 7.182 690 HB2 LEU 95 2HB LEU 95 -5.939 4.331 4.197 691 HB3 LEU 95 1HB LEU 95 -4.572 3.495 4.919 692 HG LEU 95 HG LEU 95 -7.473 2.641 4.853 693 HD11 LEU 95 1HD1 LEU 95 -4.926 1.269 3.969 694 HD12 LEU 95 2HD1 LEU 95 -6.135 2.030 2.931 695 HD13 LEU 95 3HD1 LEU 95 -6.556 0.596 3.861 696 HD21 LEU 95 3HD2 LEU 95 -6.929 0.734 6.315 697 HD22 LEU 95 1HD2 LEU 95 -6.790 2.275 7.157 698 HD23 LEU 95 2HD2 LEU 95 -5.337 1.429 6.629 699 H HIS 96 H HIS 96 -3.507 5.140 7.349 700 HA HIS 96 HA HIS 96 -3.592 8.003 6.769 701 HB2 HIS 96 2HB HIS 96 -1.640 6.306 8.388 702 HB3 HIS 96 1HB HIS 96 -1.591 8.062 8.269 703 HD2 HIS 96 HD2 HIS 96 -4.313 5.423 9.503 704 HE1 HIS 96 HE1 HIS 96 -4.343 8.834 11.989 705 HE2 HIS 96 HE2 HIS 96 -5.548 6.702 11.375 706 H ALA 97 H ALA 97 -2.440 8.911 5.180 707 HA ALA 97 HA ALA 97 -0.729 7.263 3.443 708 HB1 ALA 97 3HB ALA 97 -2.165 9.885 2.866 709 HB2 ALA 97 1HB ALA 97 -2.694 8.277 2.365 710 HB3 ALA 97 2HB ALA 97 -1.205 8.957 1.708 711 H PHE 98 H PHE 98 1.380 7.646 3.431 712 HA PHE 98 HA PHE 98 2.484 10.192 4.468 713 HB2 PHE 98 2HB PHE 98 3.946 7.538 4.789 714 HB3 PHE 98 1HB PHE 98 4.176 9.034 5.674 715 HD1 PHE 98 HD2 PHE 98 2.044 6.019 5.355 716 HD2 PHE 98 HD1 PHE 98 2.967 9.438 7.732 717 HE1 PHE 98 HE2 PHE 98 0.767 5.065 7.227 718 HE2 PHE 98 HE1 PHE 98 1.690 8.471 9.594 719 HZ PHE 98 HZ PHE 98 0.593 6.290 9.351 720 H ARG 99 H ARG 99 4.833 10.340 3.791 721 HA ARG 99 HA ARG 99 5.833 8.809 1.575 722 HB2 ARG 99 2HB ARG 99 6.067 10.670 -0.032 723 HB3 ARG 99 1HB ARG 99 4.381 10.332 0.317 724 HG2 ARG 99 2HG ARG 99 4.949 12.343 2.151 725 HG3 ARG 99 1HG ARG 99 5.946 12.804 0.771 726 HD2 ARG 99 2HD ARG 99 2.953 12.348 0.806 727 HD3 ARG 99 1HD ARG 99 3.798 13.873 0.581 728 HE ARG 99 HE ARG 99 4.531 11.984 -1.435 729 HH11 ARG 99 1HH1 ARG 99 1.935 14.219 -0.578 730 HH12 ARG 99 2HH1 ARG 99 1.387 14.376 -2.213 731 HH21 ARG 99 1HH2 ARG 99 3.744 12.123 -3.524 732 HH22 ARG 99 2HH2 ARG 99 2.416 13.179 -3.893 733 H GLN 100 H GLN 100 8.113 9.389 1.135 734 HA GLN 100 HA GLN 100 9.528 9.101 3.397 735 HB2 GLN 100 2HB GLN 100 10.166 9.514 0.605 736 HB3 GLN 100 1HB GLN 100 11.341 10.397 1.555 737 HG2 GLN 100 2HG GLN 100 10.745 7.500 2.176 738 HG3 GLN 100 1HG GLN 100 11.817 7.927 0.852 739 HE21 GLN 100 1HE2 GLN 100 11.603 9.572 4.033 740 HE22 GLN 100 2HE2 GLN 100 13.203 9.173 4.504 741 H ALA 101 H ALA 101 10.247 12.215 1.695 742 HA ALA 101 HA ALA 101 9.904 13.596 4.310 743 HB1 ALA 101 3HB ALA 101 12.256 13.610 3.604 744 HB2 ALA 101 1HB ALA 101 11.589 15.238 3.556 745 HB3 ALA 101 2HB ALA 101 11.816 14.331 2.057 746 H ALA 102 H ALA 102 10.145 14.622 0.905 747 HA ALA 102 HA ALA 102 7.699 16.260 1.208 748 HB1 ALA 102 3HB ALA 102 9.687 17.646 1.727 749 HB2 ALA 102 1HB ALA 102 8.907 18.178 0.238 750 HB3 ALA 102 2HB ALA 102 10.395 17.231 0.164 751 H ASP 103 H ASP 103 7.738 13.810 -0.127 752 HA ASP 103 HA ASP 103 8.554 13.864 -2.841 753 HB2 ASP 103 2HB ASP 103 8.151 11.714 -1.771 754 HB3 ASP 103 1HB ASP 103 6.485 12.146 -1.399 755 H GLU 104 H GLU 104 7.507 14.408 -4.690 756 HA GLU 104 HA GLU 104 4.746 15.462 -4.598 757 HB2 GLU 104 2HB GLU 104 7.135 16.858 -5.892 758 HB3 GLU 104 1HB GLU 104 5.455 17.343 -6.112 759 HG2 GLU 104 2HG GLU 104 5.301 17.730 -3.629 760 HG3 GLU 104 1HG GLU 104 7.024 17.389 -3.510 761 H SER 105 H SER 105 6.476 13.048 -5.670 762 HA SER 105 HA SER 105 5.657 12.994 -8.472 763 HB2 SER 105 2HB SER 105 7.882 12.099 -7.692 764 HB3 SER 105 1HB SER 105 7.031 10.838 -6.803 765 HG SER 105 HG SER 105 6.164 10.140 -8.828 766 H ARG 106 H ARG 106 3.838 12.851 -5.926 767 HA ARG 106 HA ARG 106 1.714 12.169 -5.491 768 HB2 ARG 106 2HB ARG 106 1.821 10.692 -8.161 769 HB3 ARG 106 1HB ARG 106 0.363 11.041 -7.239 770 HG2 ARG 106 2HG ARG 106 2.183 13.171 -8.412 771 HG3 ARG 106 1HG ARG 106 0.737 12.552 -9.209 772 HD2 ARG 106 2HD ARG 106 -0.694 13.448 -7.490 773 HD3 ARG 106 1HD ARG 106 0.688 13.835 -6.463 774 HE ARG 106 HE ARG 106 0.951 15.788 -7.590 775 HH11 ARG 106 1HH1 ARG 106 -0.981 13.715 -9.679 776 HH12 ARG 106 2HH1 ARG 106 -1.282 14.975 -10.834 777 HH21 ARG 106 1HH2 ARG 106 0.501 17.424 -9.085 778 HH22 ARG 106 2HH2 ARG 106 -0.443 17.073 -10.496 779 H THR 107 H THR 107 4.228 10.478 -4.996 780 HA THR 107 HA THR 107 3.276 7.736 -4.938 781 HB THR 107 HB THR 107 5.914 8.940 -3.986 782 HG1 THR 107 HG1 THR 107 4.965 8.450 -6.465 783 HG21 THR 107 3HG2 THR 107 5.177 6.038 -4.518 784 HG22 THR 107 1HG2 THR 107 5.488 6.745 -2.930 785 HG23 THR 107 2HG2 THR 107 6.790 6.629 -4.117 786 H LEU 108 H LEU 108 1.624 7.743 -3.481 787 HA LEU 108 HA LEU 108 2.058 8.598 -0.682 788 HB2 LEU 108 2HB LEU 108 -0.510 7.867 -2.160 789 HB3 LEU 108 1HB LEU 108 -0.421 8.385 -0.482 790 HG LEU 108 HG LEU 108 0.449 10.128 -2.823 791 HD11 LEU 108 1HD1 LEU 108 -2.146 10.244 -1.265 792 HD12 LEU 108 2HD1 LEU 108 -1.959 9.689 -2.931 793 HD13 LEU 108 3HD1 LEU 108 -1.621 11.368 -2.522 794 HD21 LEU 108 3HD2 LEU 108 0.433 11.946 -1.162 795 HD22 LEU 108 1HD2 LEU 108 1.580 10.680 -0.729 796 HD23 LEU 108 2HD2 LEU 108 0.032 10.790 0.113 797 H PHE 109 H PHE 109 2.485 7.078 0.761 798 HA PHE 109 HA PHE 109 2.049 4.230 0.100 799 HB2 PHE 109 2HB PHE 109 4.417 4.939 0.489 800 HB3 PHE 109 1HB PHE 109 3.984 5.508 2.098 801 HD1 PHE 109 HD1 PHE 109 3.657 2.358 0.032 802 HD2 PHE 109 HD2 PHE 109 4.523 4.050 3.875 803 HE1 PHE 109 HE1 PHE 109 4.134 0.114 0.925 804 HE2 PHE 109 HE2 PHE 109 4.995 1.798 4.753 805 HZ PHE 109 HZ PHE 109 4.798 -0.164 3.281 806 H VAL 110 H VAL 110 0.220 3.508 1.001 807 HA VAL 110 HA VAL 110 -0.484 4.307 3.767 808 HB VAL 110 HB VAL 110 -2.796 3.364 3.298 809 HG11 VAL 110 1HG1 VAL 110 -2.413 5.784 3.287 810 HG12 VAL 110 2HG1 VAL 110 -3.640 5.342 2.100 811 HG13 VAL 110 3HG1 VAL 110 -1.999 5.734 1.571 812 HG21 VAL 110 3HG2 VAL 110 -3.572 3.126 0.967 813 HG22 VAL 110 1HG2 VAL 110 -2.297 1.964 1.337 814 HG23 VAL 110 2HG2 VAL 110 -1.926 3.404 0.386 815 HA PRO 111 HA PRO 111 0.558 -0.085 4.562 816 HB2 PRO 111 2HB PRO 111 1.537 0.335 7.091 817 HB3 PRO 111 1HB PRO 111 2.555 0.519 5.649 818 HG2 PRO 111 2HG PRO 111 1.253 2.643 7.308 819 HG3 PRO 111 1HG PRO 111 2.861 2.631 6.548 820 HD2 PRO 111 2HD PRO 111 0.662 3.924 5.468 821 HD3 PRO 111 1HD PRO 111 2.050 3.362 4.517 822 H PHE 112 H PHE 112 -1.253 -1.143 5.137 823 HA PHE 112 HA PHE 112 -2.829 -0.217 7.434 824 HB2 PHE 112 2HB PHE 112 -4.851 -1.161 6.484 825 HB3 PHE 112 1HB PHE 112 -4.181 0.051 5.417 826 HD1 PHE 112 HD1 PHE 112 -2.954 -0.740 3.294 827 HD2 PHE 112 HD2 PHE 112 -5.367 -3.342 5.687 828 HE1 PHE 112 HE1 PHE 112 -3.249 -2.251 1.376 829 HE2 PHE 112 HE2 PHE 112 -5.644 -4.850 3.764 830 HZ PHE 112 HZ PHE 112 -4.589 -4.301 1.604 831 H ARG 113 H ARG 113 -4.209 -2.305 8.167 832 HA ARG 113 HA ARG 113 -2.807 -4.837 7.788 833 HB2 ARG 113 2HB ARG 113 -1.576 -3.815 9.707 834 HB3 ARG 113 1HB ARG 113 -3.090 -3.642 10.595 835 HG2 ARG 113 2HG ARG 113 -3.352 -6.093 10.645 836 HG3 ARG 113 1HG ARG 113 -1.867 -6.278 9.710 837 HD2 ARG 113 2HD ARG 113 -0.599 -5.210 11.574 838 HD3 ARG 113 1HD ARG 113 -2.098 -5.124 12.505 839 HE ARG 113 HE ARG 113 -2.147 -7.515 12.593 840 HH11 ARG 113 1HH1 ARG 113 0.897 -6.208 11.409 841 HH12 ARG 113 2HH1 ARG 113 1.786 -7.657 11.755 842 HH21 ARG 113 1HH2 ARG 113 -0.976 -9.419 12.986 843 HH22 ARG 113 2HH2 ARG 113 0.725 -9.476 12.647 844 H ASP 114 H ASP 114 -4.301 -6.501 7.742 845 HA ASP 114 HA ASP 114 -7.012 -5.937 8.764 846 HB2 ASP 114 2HB ASP 114 -7.978 -6.888 6.787 847 HB3 ASP 114 1HB ASP 114 -6.786 -5.718 6.230 848 H LYS 115 H LYS 115 -8.060 -8.495 8.218 849 HA LYS 115 HA LYS 115 -7.003 -9.909 10.485 850 HB2 LYS 115 2HB LYS 115 -9.299 -10.485 8.603 851 HB3 LYS 115 1HB LYS 115 -8.887 -11.557 9.929 852 HG2 LYS 115 2HG LYS 115 -9.657 -8.643 10.298 853 HG3 LYS 115 1HG LYS 115 -10.808 -9.973 10.343 854 HD2 LYS 115 2HD LYS 115 -10.399 -9.674 12.609 855 HD3 LYS 115 1HD LYS 115 -9.222 -10.928 12.230 856 HE2 LYS 115 2HE LYS 115 -7.493 -9.088 11.993 857 HE3 LYS 115 1HE LYS 115 -8.708 -7.960 12.593 858 HZ1 LYS 115 3HZ LYS 115 -7.251 -8.750 14.347 859 HZ2 LYS 115 1HZ LYS 115 -7.712 -10.347 14.045 860 HZ3 LYS 115 2HZ LYS 115 -8.844 -9.235 14.622 861 H THR 116 H THR 116 -6.503 -10.242 7.019 862 HA THR 116 HA THR 116 -5.804 -13.041 7.072 863 HB THR 116 HB THR 116 -4.912 -12.722 4.806 864 HG1 THR 116 HG1 THR 116 -5.518 -10.017 4.628 865 HG21 THR 116 3HG2 THR 116 -6.918 -11.874 3.629 866 HG22 THR 116 1HG2 THR 116 -7.508 -11.165 5.136 867 HG23 THR 116 2HG2 THR 116 -7.371 -12.918 4.978 868 H THR 117 H THR 117 -4.147 -9.973 7.451 869 HA THR 117 HA THR 117 -1.477 -10.714 7.035 870 HB THR 117 HB THR 117 -2.651 -8.462 8.729 871 HG1 THR 117 HG1 THR 117 -3.170 -8.413 6.463 872 HG21 THR 117 3HG2 THR 117 -0.457 -7.322 8.453 873 HG22 THR 117 1HG2 THR 117 0.193 -8.771 7.684 874 HG23 THR 117 2HG2 THR 117 -0.294 -8.815 9.380 875 H GLY 118 H GLY 118 -0.033 -11.789 8.272 876 HA2 GLY 118 2HA GLY 118 1.008 -12.606 10.202 877 HA3 GLY 118 1HA GLY 118 -0.394 -12.161 11.162 878 H GLN 119 H GLN 119 -2.276 -13.521 9.292 879 HA GLN 119 HA GLN 119 -2.066 -16.182 10.513 880 HB2 GLN 119 2HB GLN 119 -4.428 -14.937 9.022 881 HB3 GLN 119 1HB GLN 119 -4.470 -16.386 10.013 882 HG2 GLN 119 2HG GLN 119 -3.991 -13.557 10.995 883 HG3 GLN 119 1HG GLN 119 -5.480 -14.480 11.177 884 HE21 GLN 119 1HE2 GLN 119 -3.765 -13.261 13.226 885 HE22 GLN 119 2HE2 GLN 119 -3.279 -14.541 14.282 886 H GLN 120 H GLN 120 -3.604 -15.316 7.426 887 HA GLN 120 HA GLN 120 -2.316 -17.580 6.027 888 HB2 GLN 120 2HB GLN 120 -4.156 -17.059 4.276 889 HB3 GLN 120 1HB GLN 120 -4.684 -17.714 5.823 890 HG2 GLN 120 2HG GLN 120 -5.407 -15.541 6.588 891 HG3 GLN 120 1HG GLN 120 -4.716 -14.752 5.175 892 HE21 GLN 120 1HE2 GLN 120 -7.510 -14.942 6.313 893 HE22 GLN 120 2HE2 GLN 120 -8.478 -15.416 4.960 894 H SER 121 H SER 121 -1.935 -14.362 6.456 895 HA SER 121 HA SER 121 -0.377 -13.952 3.970 896 HB2 SER 121 2HB SER 121 -2.345 -12.549 3.720 897 HB3 SER 121 1HB SER 121 -2.220 -11.964 5.375 898 HG SER 121 HG SER 121 -1.457 -10.486 3.762 899 H TYR 122 H TYR 122 1.393 -12.332 4.346 900 HA TYR 122 HA TYR 122 2.835 -13.150 6.705 901 HB2 TYR 122 2HB TYR 122 3.664 -11.404 4.352 902 HB3 TYR 122 1HB TYR 122 4.754 -11.955 5.620 903 HD1 TYR 122 HD2 TYR 122 2.601 -13.121 2.795 904 HD2 TYR 122 HD1 TYR 122 5.694 -14.186 5.557 905 HE1 TYR 122 HE2 TYR 122 3.001 -15.198 1.546 906 HE2 TYR 122 HE1 TYR 122 6.090 -16.264 4.301 907 HH TYR 122 HH TYR 122 4.842 -17.755 2.754 908 H ASP 123 H ASP 123 3.984 -11.731 8.085 909 HA ASP 123 HA ASP 123 2.210 -9.694 9.174 910 HB2 ASP 123 2HB ASP 123 3.610 -11.733 10.355 911 HB3 ASP 123 1HB ASP 123 4.769 -10.432 10.583 912 H GLY 124 H GLY 124 4.181 -8.127 10.637 913 HA2 GLY 124 2HA GLY 124 5.559 -6.272 10.345 914 HA3 GLY 124 1HA GLY 124 5.640 -6.590 8.617 915 H GLY 125 H GLY 125 2.730 -6.869 8.446 916 HA2 GLY 125 2HA GLY 125 0.884 -5.168 8.998 917 HA3 GLY 125 1HA GLY 125 1.993 -4.032 8.221 918 H ARG 126 H ARG 126 0.238 -3.752 6.680 919 HA ARG 126 HA ARG 126 0.551 -5.638 4.451 920 HB2 ARG 126 2HB ARG 126 -1.807 -5.728 5.664 921 HB3 ARG 126 1HB ARG 126 -2.096 -4.195 4.855 922 HG2 ARG 126 2HG ARG 126 -3.049 -5.716 3.370 923 HG3 ARG 126 1HG ARG 126 -1.447 -5.493 2.673 924 HD2 ARG 126 2HD ARG 126 -2.481 -7.848 4.276 925 HD3 ARG 126 1HD ARG 126 -1.901 -7.846 2.607 926 HE ARG 126 HE ARG 126 -0.341 -8.075 5.008 927 HH11 ARG 126 1HH1 ARG 126 -0.159 -7.133 1.612 928 HH12 ARG 126 2HH1 ARG 126 1.557 -7.359 1.523 929 HH21 ARG 126 1HH2 ARG 126 1.900 -8.239 4.905 930 HH22 ARG 126 2HH2 ARG 126 2.713 -7.985 3.399 931 H TYR 127 H TYR 127 1.106 -4.599 2.580 932 HA TYR 127 HA TYR 127 1.735 -1.724 2.933 933 HB2 TYR 127 2HB TYR 127 3.150 -3.866 1.255 934 HB3 TYR 127 1HB TYR 127 3.668 -2.189 1.415 935 HD1 TYR 127 HD2 TYR 127 2.790 -5.048 3.732 936 HD2 TYR 127 HD1 TYR 127 5.509 -1.857 2.889 937 HE1 TYR 127 HE2 TYR 127 4.121 -5.673 5.689 938 HE2 TYR 127 HE1 TYR 127 6.843 -2.497 4.856 939 HH TYR 127 HH TYR 127 6.914 -3.782 6.707 940 H MET 128 H MET 128 0.874 -0.295 1.503 941 HA MET 128 HA MET 128 0.053 -1.155 -1.178 942 HB2 MET 128 2HB MET 128 -1.874 -1.186 0.850 943 HB3 MET 128 1HB MET 128 -2.056 0.450 0.236 944 HG2 MET 128 2HG MET 128 -2.165 -1.991 -1.549 945 HG3 MET 128 1HG MET 128 -3.583 -1.255 -0.807 946 HE1 MET 128 3HE MET 128 -4.792 0.764 -1.628 947 HE2 MET 128 1HE MET 128 -4.110 2.011 -2.675 948 HE3 MET 128 2HE MET 128 -3.464 1.774 -1.054 949 H GLU 129 H GLU 129 -0.057 0.588 -2.656 950 HA GLU 129 HA GLU 129 0.686 3.275 -1.706 951 HB2 GLU 129 2HB GLU 129 2.799 2.028 -2.104 952 HB3 GLU 129 1HB GLU 129 2.288 1.668 -3.749 953 HG2 GLU 129 2HG GLU 129 2.334 4.106 -4.267 954 HG3 GLU 129 1HG GLU 129 2.900 4.426 -2.626 955 H LEU 130 H LEU 130 -0.238 4.846 -2.886 956 HA LEU 130 HA LEU 130 -1.655 4.211 -5.408 957 HB2 LEU 130 2HB LEU 130 -2.427 6.636 -3.757 958 HB3 LEU 130 1HB LEU 130 -3.394 5.676 -4.858 959 HG LEU 130 HG LEU 130 -3.180 3.816 -2.957 960 HD11 LEU 130 1HD1 LEU 130 -2.709 6.352 -1.360 961 HD12 LEU 130 2HD1 LEU 130 -1.596 4.992 -1.539 962 HD13 LEU 130 3HD1 LEU 130 -3.121 4.773 -0.686 963 HD21 LEU 130 3HD2 LEU 130 -5.291 4.837 -3.710 964 HD22 LEU 130 1HD2 LEU 130 -5.028 6.187 -2.606 965 HD23 LEU 130 2HD2 LEU 130 -5.272 4.558 -1.971 966 H GLU 131 H GLU 131 -1.315 5.597 -7.118 967 HA GLU 131 HA GLU 131 0.345 8.020 -6.747 968 HB2 GLU 131 2HB GLU 131 0.558 5.947 -8.978 969 HB3 GLU 131 1HB GLU 131 1.373 7.507 -8.997 970 HG2 GLU 131 2HG GLU 131 2.800 6.900 -7.169 971 HG3 GLU 131 1HG GLU 131 1.827 5.481 -6.789 972 HA PRO 132 HA PRO 132 -3.876 8.909 -8.554 973 HB2 PRO 132 2HB PRO 132 -4.231 11.344 -7.308 974 HB3 PRO 132 1HB PRO 132 -4.546 9.797 -6.496 975 HG2 PRO 132 2HG PRO 132 -2.073 11.512 -6.351 976 HG3 PRO 132 1HG PRO 132 -2.995 10.770 -5.022 977 HD2 PRO 132 2HD PRO 132 -0.757 9.615 -5.938 978 HD3 PRO 132 1HD PRO 132 -2.150 8.626 -5.445 979 H ASP 133 H ASP 133 -4.314 9.981 -10.423 980 HA ASP 133 HA ASP 133 -2.435 11.332 -11.967 981 HB2 ASP 133 2HB ASP 133 -4.415 10.181 -12.875 982 HB3 ASP 133 1HB ASP 133 -5.475 11.379 -12.150 983 H ARG 134 H ARG 134 -4.365 12.559 -9.419 984 HA ARG 134 HA ARG 134 -3.426 15.305 -9.932 985 HB2 ARG 134 2HB ARG 134 -5.638 16.165 -8.959 986 HB3 ARG 134 1HB ARG 134 -5.690 15.533 -10.594 987 HG2 ARG 134 2HG ARG 134 -7.654 14.724 -9.597 988 HG3 ARG 134 1HG ARG 134 -6.560 13.346 -9.575 989 HD2 ARG 134 2HD ARG 134 -6.117 13.683 -7.200 990 HD3 ARG 134 1HD ARG 134 -7.061 15.173 -7.194 991 HE ARG 134 HE ARG 134 -8.032 12.471 -7.064 992 HH11 ARG 134 1HH1 ARG 134 -8.953 15.772 -7.884 993 HH12 ARG 134 2HH1 ARG 134 -10.647 15.479 -7.648 994 HH21 ARG 134 1HH2 ARG 134 -10.243 12.129 -6.719 995 HH22 ARG 134 2HH2 ARG 134 -11.370 13.418 -6.989 996 H ASP 135 H ASP 135 -3.032 16.527 -8.011 997 HA ASP 135 HA ASP 135 -2.070 14.892 -5.841 998 HB2 ASP 135 2HB ASP 135 -0.756 16.822 -6.623 999 HB3 ASP 135 1HB ASP 135 -2.067 17.922 -6.188 1000 H LEU 136 H LEU 136 -2.853 14.791 -3.740 1001 HA LEU 136 HA LEU 136 -5.723 15.300 -3.509 1002 HB2 LEU 136 2HB LEU 136 -3.877 13.740 -1.672 1003 HB3 LEU 136 1HB LEU 136 -5.632 13.768 -1.591 1004 HG LEU 136 HG LEU 136 -3.921 12.507 -3.771 1005 HD11 LEU 136 1HD1 LEU 136 -4.094 11.222 -1.675 1006 HD12 LEU 136 2HD1 LEU 136 -4.864 10.405 -3.030 1007 HD13 LEU 136 3HD1 LEU 136 -5.854 11.226 -1.821 1008 HD21 LEU 136 3HD2 LEU 136 -5.851 13.475 -4.871 1009 HD22 LEU 136 1HD2 LEU 136 -6.945 12.750 -3.689 1010 HD23 LEU 136 2HD2 LEU 136 -6.033 11.724 -4.803 1011 H SER 137 H SER 137 -6.573 16.854 -2.301 1012 HA SER 137 HA SER 137 -5.021 18.239 -0.183 1013 HB2 SER 137 2HB SER 137 -7.372 19.239 -1.845 1014 HB3 SER 137 1HB SER 137 -6.536 20.159 -0.594 1015 HG SER 137 HG SER 137 -4.607 19.413 -2.078 1016 H ASP 138 H ASP 138 -6.770 19.325 1.437 1017 HA ASP 138 HA ASP 138 -8.013 17.099 2.798 1018 HB2 ASP 138 2HB ASP 138 -6.805 18.911 4.020 1019 HB3 ASP 138 1HB ASP 138 -8.021 20.070 3.500 1020 H GLY 139 H GLY 139 -9.921 16.369 2.154 1021 HA2 GLY 139 2HA GLY 139 -12.299 16.560 1.913 1022 HA3 GLY 139 1HA GLY 139 -12.094 18.191 1.284 1023 H ASP 140 H ASP 140 -9.717 16.273 -0.047 1024 HA ASP 140 HA ASP 140 -10.950 16.207 -2.673 1025 HB2 ASP 140 2HB ASP 140 -8.453 16.696 -2.024 1026 HB3 ASP 140 1HB ASP 140 -8.278 14.959 -1.880 1027 H GLU 141 H GLU 141 -10.931 14.104 -3.971 1028 HA GLU 141 HA GLU 141 -11.611 11.752 -2.299 1029 HB2 GLU 141 2HB GLU 141 -12.410 12.545 -5.129 1030 HB3 GLU 141 1HB GLU 141 -12.864 11.022 -4.364 1031 HG2 GLU 141 2HG GLU 141 -14.163 12.179 -2.669 1032 HG3 GLU 141 1HG GLU 141 -13.590 13.745 -3.234 1033 H ILE 142 H ILE 142 -10.881 9.691 -2.835 1034 HA ILE 142 HA ILE 142 -8.888 9.245 -4.917 1035 HB ILE 142 HB ILE 142 -7.485 10.103 -3.061 1036 HG12 ILE 142 2HG1 ILE 142 -5.913 8.152 -2.775 1037 HG13 ILE 142 1HG1 ILE 142 -7.143 7.086 -3.440 1038 HG21 ILE 142 1HG2 ILE 142 -8.946 9.594 -1.164 1039 HG22 ILE 142 2HG2 ILE 142 -7.330 8.947 -0.886 1040 HG23 ILE 142 3HG2 ILE 142 -8.640 7.865 -1.361 1041 HD11 ILE 142 3HD1 ILE 142 -6.970 8.206 -5.597 1042 HD12 ILE 142 1HD1 ILE 142 -5.388 7.636 -5.057 1043 HD13 ILE 142 2HD1 ILE 142 -5.800 9.348 -4.929 1044 H THR 143 H THR 143 -8.652 6.984 -5.365 1045 HA THR 143 HA THR 143 -10.725 5.243 -4.180 1046 HB THR 143 HB THR 143 -9.101 4.646 -6.695 1047 HG1 THR 143 HG1 THR 143 -11.354 6.324 -6.365 1048 HG21 THR 143 3HG2 THR 143 -10.365 2.755 -5.770 1049 HG22 THR 143 1HG2 THR 143 -11.107 3.303 -7.272 1050 HG23 THR 143 2HG2 THR 143 -11.835 3.733 -5.727 1051 H LEU 144 H LEU 144 -10.122 3.510 -2.923 1052 HA LEU 144 HA LEU 144 -7.254 3.054 -2.390 1053 HB2 LEU 144 2HB LEU 144 -9.757 2.895 -0.718 1054 HB3 LEU 144 1HB LEU 144 -8.455 1.800 -0.317 1055 HG LEU 144 HG LEU 144 -8.478 3.858 1.086 1056 HD11 LEU 144 1HD1 LEU 144 -5.995 3.568 -0.636 1057 HD12 LEU 144 2HD1 LEU 144 -6.396 2.613 0.794 1058 HD13 LEU 144 3HD1 LEU 144 -6.077 4.338 0.953 1059 HD21 LEU 144 3HD2 LEU 144 -9.308 5.445 -0.609 1060 HD22 LEU 144 1HD2 LEU 144 -7.769 5.343 -1.468 1061 HD23 LEU 144 2HD2 LEU 144 -7.834 6.023 0.161 1062 H ASP 145 H ASP 145 -6.657 1.519 -3.842 1063 HA ASP 145 HA ASP 145 -8.184 -0.944 -4.214 1064 HB2 ASP 145 2HB ASP 145 -5.660 0.190 -5.480 1065 HB3 ASP 145 1HB ASP 145 -6.213 -1.445 -5.804 1066 H PHE 146 H PHE 146 -7.983 -1.868 -2.110 1067 HA PHE 146 HA PHE 146 -5.494 -2.456 -0.808 1068 HB2 PHE 146 2HB PHE 146 -8.111 -3.983 -0.494 1069 HB3 PHE 146 1HB PHE 146 -6.791 -3.892 0.672 1070 HD1 PHE 146 HD2 PHE 146 -6.244 -0.940 0.627 1071 HD2 PHE 146 HD1 PHE 146 -9.934 -3.101 0.711 1072 HE1 PHE 146 HE2 PHE 146 -7.349 0.961 1.691 1073 HE2 PHE 146 HE1 PHE 146 -11.028 -1.185 1.788 1074 HZ PHE 146 HZ PHE 146 -9.730 0.843 2.277 1075 H ASN 147 H ASN 147 -7.049 -3.726 -3.476 1076 HA ASN 147 HA ASN 147 -6.245 -6.468 -3.405 1077 HB2 ASN 147 2HB ASN 147 -7.174 -4.885 -5.833 1078 HB3 ASN 147 1HB ASN 147 -7.323 -6.615 -5.548 1079 HD21 ASN 147 1HD2 ASN 147 -9.454 -6.992 -5.436 1080 HD22 ASN 147 2HD2 ASN 147 -10.611 -6.094 -4.536 1081 H LEU 148 H LEU 148 -4.526 -3.654 -3.966 1082 HA LEU 148 HA LEU 148 -2.475 -4.935 -5.678 1083 HB2 LEU 148 2HB LEU 148 -2.835 -1.978 -5.015 1084 HB3 LEU 148 1HB LEU 148 -1.731 -2.658 -6.200 1085 HG LEU 148 HG LEU 148 -4.764 -2.543 -6.385 1086 HD11 LEU 148 1HD1 LEU 148 -3.684 -0.404 -6.826 1087 HD12 LEU 148 2HD1 LEU 148 -4.397 -1.061 -8.297 1088 HD13 LEU 148 3HD1 LEU 148 -2.650 -1.147 -8.050 1089 HD21 LEU 148 3HD2 LEU 148 -4.567 -3.550 -8.623 1090 HD22 LEU 148 1HD2 LEU 148 -4.037 -4.654 -7.356 1091 HD23 LEU 148 2HD2 LEU 148 -2.842 -3.820 -8.355 1092 H ALA 149 H ALA 149 -2.893 -5.452 -2.800 1093 HA ALA 149 HA ALA 149 -0.971 -3.947 -1.285 1094 HB1 ALA 149 3HB ALA 149 -1.467 -5.521 0.550 1095 HB2 ALA 149 1HB ALA 149 -2.382 -6.544 -0.566 1096 HB3 ALA 149 2HB ALA 149 -2.949 -4.914 -0.194 1097 H TYR 150 H TYR 150 1.143 -4.195 -1.378 1098 HA TYR 150 HA TYR 150 2.401 -6.321 -2.887 1099 HB2 TYR 150 2HB TYR 150 3.777 -4.047 -1.395 1100 HB3 TYR 150 1HB TYR 150 4.406 -4.967 -2.758 1101 HD1 TYR 150 HD1 TYR 150 2.385 -4.864 -4.809 1102 HD2 TYR 150 HD2 TYR 150 3.462 -1.812 -2.012 1103 HE1 TYR 150 HE1 TYR 150 1.563 -3.146 -6.355 1104 HE2 TYR 150 HE2 TYR 150 2.640 -0.102 -3.567 1105 HH TYR 150 HH TYR 150 0.707 -0.761 -6.190 1106 H SER 151 H SER 151 3.952 -7.792 -2.114 1107 HA SER 151 HA SER 151 3.983 -8.885 0.345 1108 HB2 SER 151 2HB SER 151 6.319 -8.666 -1.598 1109 HB3 SER 151 1HB SER 151 6.171 -9.869 -0.313 1110 HG SER 151 HG SER 151 4.677 -10.914 -1.432 1111 HA PRO 152 HA PRO 152 6.184 -6.086 3.194 1112 HB2 PRO 152 2HB PRO 152 6.873 -8.015 5.087 1113 HB3 PRO 152 1HB PRO 152 5.276 -7.252 4.976 1114 HG2 PRO 152 2HG PRO 152 6.163 -9.910 3.949 1115 HG3 PRO 152 1HG PRO 152 4.640 -9.453 4.743 1116 HD2 PRO 152 2HD PRO 152 4.807 -9.783 2.064 1117 HD3 PRO 152 1HD PRO 152 3.721 -8.586 2.794 1118 H PHE 153 H PHE 153 8.311 -6.289 4.528 1119 HA PHE 153 HA PHE 153 10.490 -7.254 2.766 1120 HB2 PHE 153 2HB PHE 153 10.475 -4.590 4.267 1121 HB3 PHE 153 1HB PHE 153 11.819 -5.231 3.327 1122 HD1 PHE 153 HD2 PHE 153 11.665 -5.364 0.839 1123 HD2 PHE 153 HD1 PHE 153 8.576 -3.517 3.164 1124 HE1 PHE 153 HE2 PHE 153 10.758 -4.309 -1.187 1125 HE2 PHE 153 HE1 PHE 153 7.673 -2.471 1.123 1126 HZ PHE 153 HZ PHE 153 8.767 -2.867 -1.051 1127 H CYS 154 H CYS 154 9.701 -5.983 6.034 1128 HA CYS 154 HA CYS 154 11.827 -7.186 7.425 1129 HB2 CYS 154 2HB CYS 154 10.481 -5.301 8.305 1130 HB3 CYS 154 1HB CYS 154 9.116 -6.386 8.540 1131 HG CYS 154 HG CYS 154 12.104 -6.989 10.071 1132 H ALA 155 H ALA 155 8.543 -8.405 6.777 1133 HA ALA 155 HA ALA 155 8.547 -10.597 8.534 1134 HB1 ALA 155 3HB ALA 155 7.088 -10.375 5.886 1135 HB2 ALA 155 1HB ALA 155 6.514 -9.751 7.432 1136 HB3 ALA 155 2HB ALA 155 6.699 -11.491 7.200 1137 H TYR 156 H TYR 156 9.784 -10.297 5.234 1138 HA TYR 156 HA TYR 156 10.429 -13.131 5.014 1139 HB2 TYR 156 2HB TYR 156 10.933 -10.766 3.167 1140 HB3 TYR 156 1HB TYR 156 11.383 -12.423 2.790 1141 HD1 TYR 156 HD2 TYR 156 9.462 -14.196 2.680 1142 HD2 TYR 156 HD1 TYR 156 8.770 -9.988 2.604 1143 HE1 TYR 156 HE2 TYR 156 7.267 -14.574 1.629 1144 HE2 TYR 156 HE1 TYR 156 6.596 -10.368 1.551 1145 HH TYR 156 HH TYR 156 5.186 -13.496 1.228 1146 H SER 157 H SER 157 12.037 -10.094 5.793 1147 HA SER 157 HA SER 157 14.553 -11.518 6.351 1148 HB2 SER 157 2HB SER 157 14.361 -8.970 4.682 1149 HB3 SER 157 1HB SER 157 15.863 -9.687 5.263 1150 HG SER 157 HG SER 157 14.204 -11.392 3.839 1151 H ASP 158 H ASP 158 14.969 -11.145 8.433 1152 HA ASP 158 HA ASP 158 13.676 -9.146 10.016 1153 HB2 ASP 158 2HB ASP 158 15.981 -11.019 10.721 1154 HB3 ASP 158 1HB ASP 158 15.072 -10.060 11.885 1155 H THR 159 H THR 159 16.406 -8.929 8.058 1156 HA THR 159 HA THR 159 18.046 -7.114 9.507 1157 HB THR 159 HB THR 159 18.898 -8.433 7.596 1158 HG1 THR 159 HG1 THR 159 19.302 -5.773 7.968 1159 HG21 THR 159 3HG2 THR 159 18.384 -7.801 5.275 1160 HG22 THR 159 1HG2 THR 159 17.214 -6.609 5.846 1161 HG23 THR 159 2HG2 THR 159 16.925 -8.328 6.115 1162 H PHE 160 H PHE 160 14.968 -6.645 8.070 1163 HA PHE 160 HA PHE 160 15.292 -3.731 7.742 1164 HB2 PHE 160 2HB PHE 160 12.895 -5.555 7.214 1165 HB3 PHE 160 1HB PHE 160 12.899 -3.817 6.967 1166 HD1 PHE 160 HD2 PHE 160 14.077 -7.059 5.653 1167 HD2 PHE 160 HD1 PHE 160 13.998 -2.829 5.011 1168 HE1 PHE 160 HE2 PHE 160 14.769 -7.400 3.318 1169 HE2 PHE 160 HE1 PHE 160 14.680 -3.186 2.676 1170 HZ PHE 160 HZ PHE 160 15.069 -5.466 1.826 1171 H SER 161 H SER 161 14.481 -2.343 9.304 1172 HA SER 161 HA SER 161 13.259 -3.409 11.732 1173 HB2 SER 161 2HB SER 161 14.918 -1.556 11.898 1174 HB3 SER 161 1HB SER 161 13.865 -0.524 10.931 1175 HG SER 161 HG SER 161 13.663 -1.294 13.596 1176 H CYS 162 H CYS 162 11.066 -3.553 11.981 1177 HA CYS 162 HA CYS 162 9.417 -3.436 9.710 1178 HB2 CYS 162 2HB CYS 162 7.621 -4.073 11.383 1179 HB3 CYS 162 1HB CYS 162 9.060 -5.090 11.450 1180 HG CYS 162 HG CYS 162 8.840 -2.439 13.566 1181 HA PRO 163 HA PRO 163 7.820 0.746 9.948 1182 HB2 PRO 163 2HB PRO 163 5.439 0.534 8.638 1183 HB3 PRO 163 1HB PRO 163 6.984 0.311 7.788 1184 HG2 PRO 163 2HG PRO 163 5.077 -1.769 8.796 1185 HG3 PRO 163 1HG PRO 163 5.953 -1.702 7.251 1186 HD2 PRO 163 2HD PRO 163 6.796 -3.210 9.393 1187 HD3 PRO 163 1HD PRO 163 7.893 -2.565 8.158 1188 H LEU 164 H LEU 164 6.051 2.066 10.960 1189 HA LEU 164 HA LEU 164 4.724 0.633 13.176 1190 HB2 LEU 164 2HB LEU 164 6.425 2.428 13.771 1191 HB3 LEU 164 1HB LEU 164 5.386 3.609 13.005 1192 HG LEU 164 HG LEU 164 5.277 3.533 15.553 1193 HD11 LEU 164 1HD1 LEU 164 2.858 3.809 15.766 1194 HD12 LEU 164 2HD1 LEU 164 2.617 3.074 14.178 1195 HD13 LEU 164 3HD1 LEU 164 3.469 4.612 14.319 1196 HD21 LEU 164 3HD2 LEU 164 4.008 1.757 16.653 1197 HD22 LEU 164 1HD2 LEU 164 5.431 1.106 15.843 1198 HD23 LEU 164 2HD2 LEU 164 3.834 0.900 15.119 1199 HA PRO 165 HA PRO 165 1.113 2.024 10.722 1200 HB2 PRO 165 2HB PRO 165 -0.261 -0.414 11.557 1201 HB3 PRO 165 1HB PRO 165 0.335 -0.001 9.941 1202 HG2 PRO 165 2HG PRO 165 1.372 -2.046 11.447 1203 HG3 PRO 165 1HG PRO 165 2.294 -1.172 10.198 1204 HD2 PRO 165 2HD PRO 165 2.292 -0.728 13.192 1205 HD3 PRO 165 1HD PRO 165 3.668 -0.814 12.064 1206 HA PRO 166 HA PRO 166 -0.654 3.533 14.725 1207 HB2 PRO 166 2HB PRO 166 -2.452 5.301 13.572 1208 HB3 PRO 166 1HB PRO 166 -0.736 5.691 13.798 1209 HG2 PRO 166 2HG PRO 166 -2.124 4.683 11.329 1210 HG3 PRO 166 1HG PRO 166 -0.945 6.002 11.486 1211 HD2 PRO 166 2HD PRO 166 -0.186 3.575 10.612 1212 HD3 PRO 166 1HD PRO 166 0.877 4.536 11.668 1213 H GLU 167 H GLU 167 -2.367 2.592 15.807 1214 HA GLU 167 HA GLU 167 -3.593 0.321 14.805 1215 HB2 GLU 167 2HB GLU 167 -4.502 1.961 17.198 1216 HB3 GLU 167 1HB GLU 167 -4.883 0.267 16.902 1217 HG2 GLU 167 2HG GLU 167 -2.464 -0.291 17.069 1218 HG3 GLU 167 1HG GLU 167 -2.115 1.407 17.405 1219 H SER 168 H SER 168 -4.697 3.520 14.299 1220 HA SER 168 HA SER 168 -7.492 3.173 14.026 1221 HB2 SER 168 2HB SER 168 -5.626 5.183 12.690 1222 HB3 SER 168 1HB SER 168 -7.382 5.333 12.796 1223 HG SER 168 HG SER 168 -7.151 6.101 14.725 1224 H ASN 169 H ASN 169 -4.918 2.037 12.074 1225 HA ASN 169 HA ASN 169 -6.378 2.125 9.524 1226 HB2 ASN 169 2HB ASN 169 -4.285 1.693 8.460 1227 HB3 ASN 169 1HB ASN 169 -3.934 2.853 9.732 1228 HD21 ASN 169 1HD2 ASN 169 -2.092 1.105 8.445 1229 HD22 ASN 169 2HD2 ASN 169 -1.429 0.067 9.634 1230 H TRP 170 H TRP 170 -6.352 0.107 12.082 1231 HA TRP 170 HA TRP 170 -5.932 -2.458 10.839 1232 HB2 TRP 170 2HB TRP 170 -7.059 -1.656 13.545 1233 HB3 TRP 170 1HB TRP 170 -6.930 -3.334 13.030 1234 HD1 TRP 170 HD1 TRP 170 -3.877 -1.954 11.702 1235 HE1 TRP 170 HE1 TRP 170 -1.911 -2.246 13.322 1236 HE3 TRP 170 HE3 TRP 170 -6.471 -3.029 15.989 1237 HZ2 TRP 170 HZ2 TRP 170 -1.485 -2.856 16.037 1238 HZ3 TRP 170 HZ3 TRP 170 -5.199 -3.459 18.056 1239 HH2 TRP 170 HH2 TRP 170 -2.756 -3.373 18.079 1240 H LEU 171 H LEU 171 -7.334 -3.333 9.488 1241 HA LEU 171 HA LEU 171 -10.174 -2.609 9.445 1242 HB2 LEU 171 2HB LEU 171 -8.756 -4.523 7.540 1243 HB3 LEU 171 1HB LEU 171 -10.235 -3.620 7.266 1244 HG LEU 171 HG LEU 171 -7.415 -2.463 7.318 1245 HD11 LEU 171 1HD1 LEU 171 -7.736 -2.063 4.915 1246 HD12 LEU 171 2HD1 LEU 171 -9.304 -2.870 4.981 1247 HD13 LEU 171 3HD1 LEU 171 -7.829 -3.778 5.311 1248 HD21 LEU 171 3HD2 LEU 171 -10.037 -1.030 6.787 1249 HD22 LEU 171 1HD2 LEU 171 -8.423 -0.338 6.588 1250 HD23 LEU 171 2HD2 LEU 171 -8.984 -0.816 8.187 1251 H GLU 172 H GLU 172 -11.320 -3.846 10.955 1252 HA GLU 172 HA GLU 172 -10.341 -6.504 11.690 1253 HB2 GLU 172 2HB GLU 172 -11.167 -4.778 13.381 1254 HB3 GLU 172 1HB GLU 172 -12.800 -5.096 12.808 1255 HG2 GLU 172 2HG GLU 172 -12.708 -7.378 13.579 1256 HG3 GLU 172 1HG GLU 172 -10.984 -7.262 13.924 1257 H THR 173 H THR 173 -10.719 -6.907 9.369 1258 HA THR 173 HA THR 173 -12.880 -8.691 8.894 1259 HB THR 173 HB THR 173 -14.027 -6.529 8.328 1260 HG1 THR 173 HG1 THR 173 -14.938 -7.903 7.030 1261 HG21 THR 173 3HG2 THR 173 -12.056 -5.196 7.610 1262 HG22 THR 173 1HG2 THR 173 -13.320 -5.194 6.375 1263 HG23 THR 173 2HG2 THR 173 -11.893 -6.213 6.176 1264 H ALA 174 H ALA 174 -12.493 -9.765 6.734 1265 HA ALA 174 HA ALA 174 -9.600 -10.001 6.257 1266 HB1 ALA 174 3HB ALA 174 -10.183 -12.052 5.007 1267 HB2 ALA 174 1HB ALA 174 -11.898 -11.733 5.282 1268 HB3 ALA 174 2HB ALA 174 -10.836 -12.083 6.647 1269 H VAL 175 H VAL 175 -8.672 -9.120 4.515 1270 HA VAL 175 HA VAL 175 -10.281 -8.134 2.245 1271 HB VAL 175 HB VAL 175 -7.310 -7.687 2.850 1272 HG11 VAL 175 1HG1 VAL 175 -7.749 -7.608 0.434 1273 HG12 VAL 175 2HG1 VAL 175 -7.380 -5.993 1.037 1274 HG13 VAL 175 3HG1 VAL 175 -9.051 -6.441 0.683 1275 HG21 VAL 175 3HG2 VAL 175 -9.645 -5.763 3.197 1276 HG22 VAL 175 1HG2 VAL 175 -7.941 -5.361 3.427 1277 HG23 VAL 175 2HG2 VAL 175 -8.724 -6.528 4.493 1278 H THR 176 H THR 176 -10.777 -10.142 1.324 1279 HA THR 176 HA THR 176 -8.500 -11.638 0.141 1280 HB THR 176 HB THR 176 -10.138 -13.545 -0.171 1281 HG1 THR 176 HG1 THR 176 -11.967 -11.833 0.438 1282 HG21 THR 176 3HG2 THR 176 -9.695 -12.693 2.715 1283 HG22 THR 176 1HG2 THR 176 -8.556 -13.600 1.714 1284 HG23 THR 176 2HG2 THR 176 -10.097 -14.326 2.177 1285 H ALA 177 H ALA 177 -8.205 -11.229 -1.894 1286 HA ALA 177 HA ALA 177 -10.367 -10.482 -3.740 1287 HB1 ALA 177 3HB ALA 177 -7.917 -8.762 -3.183 1288 HB2 ALA 177 1HB ALA 177 -9.585 -8.365 -2.756 1289 HB3 ALA 177 2HB ALA 177 -9.110 -8.472 -4.453 1290 H GLY 178 H GLY 178 -9.899 -11.157 -5.857 1291 HA2 GLY 178 2HA GLY 178 -8.999 -12.607 -7.400 1292 HA3 GLY 178 1HA GLY 178 -7.435 -11.988 -6.881 1293 H GLU 179 H GLU 179 -6.402 -14.049 -6.995 1294 HA GLU 179 HA GLU 179 -7.161 -16.249 -5.329 1295 HB2 GLU 179 2HB GLU 179 -5.552 -16.453 -7.238 1296 HB3 GLU 179 1HB GLU 179 -4.384 -15.481 -6.353 1297 HG2 GLU 179 2HG GLU 179 -3.821 -17.869 -6.225 1298 HG3 GLU 179 1HG GLU 179 -4.208 -17.229 -4.629 1299 H ARG 180 H ARG 180 -6.150 -16.878 -3.328 1300 HA ARG 180 HA ARG 180 -5.238 -14.647 -1.590 1301 HB2 ARG 180 2HB ARG 180 -6.425 -15.885 0.299 1302 HB3 ARG 180 1HB ARG 180 -7.497 -15.163 -0.896 1303 HG2 ARG 180 2HG ARG 180 -7.921 -17.316 -1.925 1304 HG3 ARG 180 1HG ARG 180 -6.691 -18.091 -0.929 1305 HD2 ARG 180 2HD ARG 180 -9.135 -16.773 0.279 1306 HD3 ARG 180 1HD ARG 180 -9.140 -18.452 -0.266 1307 HE ARG 180 HE ARG 180 -6.943 -18.171 1.422 1308 HH11 ARG 180 1HH1 ARG 180 -10.451 -17.941 1.733 1309 HH12 ARG 180 2HH1 ARG 180 -10.455 -18.434 3.392 1310 HH21 ARG 180 1HH2 ARG 180 -6.986 -18.860 3.586 1311 HH22 ARG 180 2HH2 ARG 180 -8.496 -18.955 4.443 1312 H THR 181 H THR 181 -3.133 -15.075 -0.873 1313 HA THR 181 HA THR 181 -1.885 -17.487 -0.610 1314 HB THR 181 HB THR 181 -0.515 -16.351 1.226 1315 HG1 THR 181 HG1 THR 181 -2.175 -14.977 2.044 1316 HG21 THR 181 3HG2 THR 181 -0.955 -14.750 -1.317 1317 HG22 THR 181 1HG2 THR 181 0.112 -16.146 -1.151 1318 HG23 THR 181 2HG2 THR 181 0.462 -14.658 -0.270 1319 H ASP 182 H ASP 182 -1.380 -18.811 1.146 1320 HA ASP 182 HA ASP 182 -3.009 -18.802 3.569 1321 HB2 ASP 182 2HB ASP 182 -3.137 -21.010 1.491 1322 HB3 ASP 182 1HB ASP 182 -3.310 -21.433 3.191 1323 H LEU 183 H LEU 183 -2.137 -20.013 5.229 1324 HA LEU 183 HA LEU 183 0.640 -20.311 5.481 1325 HB2 LEU 183 2HB LEU 183 0.195 -21.378 7.614 1326 HB3 LEU 183 1HB LEU 183 -0.905 -20.030 7.405 1327 HG LEU 183 HG LEU 183 -1.708 -22.938 6.951 1328 HD11 LEU 183 1HD1 LEU 183 -2.171 -21.283 9.443 1329 HD12 LEU 183 2HD1 LEU 183 -1.082 -22.664 9.280 1330 HD13 LEU 183 3HD1 LEU 183 -2.819 -22.896 9.116 1331 HD21 LEU 183 3HD2 LEU 183 -3.471 -20.480 7.259 1332 HD22 LEU 183 1HD2 LEU 183 -4.032 -22.149 7.111 1333 HD23 LEU 183 2HD2 LEU 183 -3.189 -21.385 5.769 1334 H GLU 184 H GLU 184 -1.849 -22.597 4.453 1335 HA GLU 184 HA GLU 184 -0.062 -24.906 4.511 1336 HB2 GLU 184 2HB GLU 184 -2.976 -24.676 3.661 1337 HB3 GLU 184 1HB GLU 184 -2.078 -26.185 3.790 1338 HG2 GLU 184 2HG GLU 184 -2.756 -24.304 6.067 1339 HG3 GLU 184 1HG GLU 184 -3.532 -25.846 5.726 1340 H HIS 185 H HIS 185 -1.478 -22.718 2.165 1341 HA HIS 185 HA HIS 185 0.041 -24.006 -0.012 1342 HB2 HIS 185 2HB HIS 185 -2.848 -23.023 -0.174 1343 HB3 HIS 185 1HB HIS 185 -1.871 -23.431 -1.581 1344 HD1 HIS 185 HD1 HIS 185 -1.543 -25.919 -2.117 1345 HD2 HIS 185 HD2 HIS 185 -3.663 -25.269 1.394 1346 HE1 HIS 185 HE1 HIS 185 -2.475 -28.153 -1.467 1347 HE2 HIS 185 HE2 HIS 185 -3.637 -27.760 0.722 Start of MODEL 10 1 H1 MET 1 1H MET 1 -20.544 1.414 -13.031 2 H2 MET 1 2H MET 1 -20.077 0.094 -13.969 3 H3 MET 1 3H MET 1 -20.048 1.646 -14.636 4 HA MET 1 HA MET 1 -18.339 2.311 -13.078 5 HB2 MET 1 2HB MET 1 -18.292 -0.631 -12.265 6 HB3 MET 1 1HB MET 1 -17.173 0.610 -11.703 7 HG2 MET 1 2HG MET 1 -18.782 0.190 -9.969 8 HG3 MET 1 1HG MET 1 -19.100 1.790 -10.642 9 HE1 MET 1 3HE MET 1 -22.725 0.551 -9.721 10 HE2 MET 1 1HE MET 1 -21.560 1.865 -9.558 11 HE3 MET 1 2HE MET 1 -21.235 0.301 -8.810 12 H ASP 2 H ASP 2 -18.945 0.149 -15.578 13 HA ASP 2 HA ASP 2 -16.573 -1.186 -16.128 14 HB2 ASP 2 2HB ASP 2 -18.608 -0.124 -18.144 15 HB3 ASP 2 1HB ASP 2 -17.404 -1.372 -18.482 16 H GLU 3 H GLU 3 -17.441 2.107 -16.816 17 HA GLU 3 HA GLU 3 -15.569 2.744 -18.844 18 HB2 GLU 3 2HB GLU 3 -16.906 4.645 -16.848 19 HB3 GLU 3 1HB GLU 3 -16.128 5.116 -18.353 20 HG2 GLU 3 2HG GLU 3 -18.500 5.221 -18.679 21 HG3 GLU 3 1HG GLU 3 -17.887 3.853 -19.605 22 H ASP 4 H ASP 4 -15.577 3.017 -15.328 23 HA ASP 4 HA ASP 4 -12.980 4.294 -15.133 24 HB2 ASP 4 2HB ASP 4 -14.748 4.858 -13.517 25 HB3 ASP 4 1HB ASP 4 -14.871 3.178 -13.013 26 H THR 5 H THR 5 -14.289 1.036 -14.913 27 HA THR 5 HA THR 5 -12.082 -0.079 -13.433 28 HB THR 5 HB THR 5 -14.204 -1.668 -14.941 29 HG1 THR 5 HG1 THR 5 -15.623 -1.094 -13.482 30 HG21 THR 5 3HG2 THR 5 -13.882 -3.309 -13.120 31 HG22 THR 5 1HG2 THR 5 -12.666 -2.264 -12.377 32 HG23 THR 5 2HG2 THR 5 -12.356 -3.005 -13.949 33 H GLU 6 H GLU 6 -12.980 0.098 -16.868 34 HA GLU 6 HA GLU 6 -10.948 -1.649 -17.850 35 HB2 GLU 6 2HB GLU 6 -11.433 -0.685 -20.067 36 HB3 GLU 6 1HB GLU 6 -12.912 -1.098 -19.202 37 HG2 GLU 6 2HG GLU 6 -13.124 1.332 -18.552 38 HG3 GLU 6 1HG GLU 6 -11.752 1.678 -19.606 39 H ASP 7 H ASP 7 -10.957 1.786 -17.015 40 HA ASP 7 HA ASP 7 -8.255 2.280 -17.930 41 HB2 ASP 7 2HB ASP 7 -10.153 3.831 -16.121 42 HB3 ASP 7 1HB ASP 7 -8.487 4.351 -16.364 43 H TRP 8 H TRP 8 -9.792 1.456 -14.855 44 HA TRP 8 HA TRP 8 -7.678 1.399 -13.115 45 HB2 TRP 8 2HB TRP 8 -9.960 0.936 -12.367 46 HB3 TRP 8 1HB TRP 8 -9.991 -0.574 -13.266 47 HD1 TRP 8 HD1 TRP 8 -7.696 0.903 -10.458 48 HE1 TRP 8 HE1 TRP 8 -7.313 -0.943 -8.713 49 HE3 TRP 8 HE3 TRP 8 -10.357 -2.877 -12.658 50 HZ2 TRP 8 HZ2 TRP 8 -8.044 -3.629 -8.307 51 HZ3 TRP 8 HZ3 TRP 8 -10.476 -5.061 -11.516 52 HH2 TRP 8 HH2 TRP 8 -9.336 -5.426 -9.380 53 H GLU 9 H GLU 9 -8.626 -1.242 -15.376 54 HA GLU 9 HA GLU 9 -6.522 -2.987 -14.541 55 HB2 GLU 9 2HB GLU 9 -7.149 -4.445 -16.387 56 HB3 GLU 9 1HB GLU 9 -8.590 -3.883 -15.546 57 HG2 GLU 9 2HG GLU 9 -9.088 -2.313 -17.317 58 HG3 GLU 9 1HG GLU 9 -7.567 -2.673 -18.129 59 H THR 10 H THR 10 -6.599 -0.335 -16.777 60 HA THR 10 HA THR 10 -4.284 -1.011 -18.320 61 HB THR 10 HB THR 10 -5.424 1.772 -17.778 62 HG1 THR 10 HG1 THR 10 -6.944 1.304 -19.175 63 HG21 THR 10 3HG2 THR 10 -3.737 0.737 -20.099 64 HG22 THR 10 1HG2 THR 10 -3.175 1.824 -18.825 65 HG23 THR 10 2HG2 THR 10 -4.412 2.362 -19.961 66 H GLN 11 H GLN 11 -4.710 1.477 -15.719 67 HA GLN 11 HA GLN 11 -1.958 1.881 -15.228 68 HB2 GLN 11 2HB GLN 11 -2.673 2.999 -13.127 69 HB3 GLN 11 1HB GLN 11 -3.605 3.533 -14.521 70 HG2 GLN 11 2HG GLN 11 -5.495 2.137 -13.835 71 HG3 GLN 11 1HG GLN 11 -4.561 1.502 -12.479 72 HE21 GLN 11 1HE2 GLN 11 -6.095 2.230 -10.982 73 HE22 GLN 11 2HE2 GLN 11 -6.281 3.898 -10.580 74 H LEU 12 H LEU 12 -4.173 -0.547 -14.090 75 HA LEU 12 HA LEU 12 -3.056 -1.521 -11.761 76 HB2 LEU 12 2HB LEU 12 -5.179 -2.306 -12.464 77 HB3 LEU 12 1HB LEU 12 -4.581 -2.792 -14.033 78 HG LEU 12 HG LEU 12 -3.453 -4.742 -13.026 79 HD11 LEU 12 1HD1 LEU 12 -3.813 -5.371 -10.705 80 HD12 LEU 12 2HD1 LEU 12 -4.656 -3.850 -10.407 81 HD13 LEU 12 3HD1 LEU 12 -2.940 -3.844 -10.821 82 HD21 LEU 12 3HD2 LEU 12 -5.767 -4.945 -13.850 83 HD22 LEU 12 1HD2 LEU 12 -6.380 -4.553 -12.240 84 HD23 LEU 12 2HD2 LEU 12 -5.455 -6.034 -12.502 85 H GLN 13 H GLN 13 -2.441 -2.778 -15.085 86 HA GLN 13 HA GLN 13 -0.567 -4.707 -14.295 87 HB2 GLN 13 2HB GLN 13 0.093 -4.840 -16.691 88 HB3 GLN 13 1HB GLN 13 -1.646 -4.907 -16.443 89 HG2 GLN 13 2HG GLN 13 -1.865 -2.578 -17.138 90 HG3 GLN 13 1HG GLN 13 -0.120 -2.449 -17.336 91 HE21 GLN 13 1HE2 GLN 13 0.208 -5.071 -18.585 92 HE22 GLN 13 2HE2 GLN 13 -0.480 -4.952 -20.166 93 H ALA 14 H ALA 14 -0.151 -1.315 -15.191 94 HA ALA 14 HA ALA 14 2.650 -1.170 -15.351 95 HB1 ALA 14 3HB ALA 14 2.360 1.246 -14.954 96 HB2 ALA 14 1HB ALA 14 0.683 0.967 -14.453 97 HB3 ALA 14 2HB ALA 14 1.178 0.640 -16.114 98 H ASN 15 H ASN 15 0.472 -0.539 -12.592 99 HA ASN 15 HA ASN 15 2.229 0.235 -10.636 100 HB2 ASN 15 2HB ASN 15 -0.310 -1.407 -10.279 101 HB3 ASN 15 1HB ASN 15 0.525 -0.583 -8.965 102 HD21 ASN 15 1HD2 ASN 15 -2.202 -0.222 -9.959 103 HD22 ASN 15 2HD2 ASN 15 -2.338 1.442 -10.393 104 H ARG 16 H ARG 16 1.562 -3.146 -11.596 105 HA ARG 16 HA ARG 16 3.552 -4.040 -9.588 106 HB2 ARG 16 2HB ARG 16 2.757 -6.381 -9.965 107 HB3 ARG 16 1HB ARG 16 1.582 -5.314 -9.219 108 HG2 ARG 16 2HG ARG 16 1.445 -5.670 -12.202 109 HG3 ARG 16 1HG ARG 16 0.914 -7.009 -11.179 110 HD2 ARG 16 2HD ARG 16 -0.145 -4.168 -11.123 111 HD3 ARG 16 1HD ARG 16 -0.984 -5.591 -11.744 112 HE ARG 16 HE ARG 16 -1.097 -6.454 -9.492 113 HH11 ARG 16 1HH1 ARG 16 -0.258 -3.055 -9.701 114 HH12 ARG 16 2HH1 ARG 16 -0.755 -2.705 -8.074 115 HH21 ARG 16 1HH2 ARG 16 -1.706 -5.990 -7.366 116 HH22 ARG 16 2HH2 ARG 16 -1.576 -4.374 -6.755 117 H ASP 17 H ASP 17 3.338 -3.458 -12.947 118 HA ASP 17 HA ASP 17 5.262 -5.420 -13.790 119 HB2 ASP 17 2HB ASP 17 3.777 -4.309 -15.422 120 HB3 ASP 17 1HB ASP 17 4.507 -2.747 -15.070 121 H GLU 18 H GLU 18 5.484 -1.987 -12.886 122 HA GLU 18 HA GLU 18 8.313 -1.810 -13.025 123 HB2 GLU 18 2HB GLU 18 8.012 0.332 -11.805 124 HB3 GLU 18 1HB GLU 18 6.949 0.179 -13.193 125 HG2 GLU 18 2HG GLU 18 5.264 0.837 -11.830 126 HG3 GLU 18 1HG GLU 18 5.344 -0.766 -11.114 127 H LYS 19 H LYS 19 6.042 -2.679 -10.433 128 HA LYS 19 HA LYS 19 7.944 -2.996 -8.346 129 HB2 LYS 19 2HB LYS 19 5.149 -4.041 -8.813 130 HB3 LYS 19 1HB LYS 19 6.076 -4.687 -7.475 131 HG2 LYS 19 2HG LYS 19 5.493 -1.729 -7.799 132 HG3 LYS 19 1HG LYS 19 4.428 -2.837 -6.935 133 HD2 LYS 19 2HD LYS 19 5.661 -2.086 -5.131 134 HD3 LYS 19 1HD LYS 19 6.702 -3.422 -5.611 135 HE2 LYS 19 2HE LYS 19 8.101 -1.512 -5.183 136 HE3 LYS 19 1HE LYS 19 8.078 -1.752 -6.933 137 HZ1 LYS 19 3HZ LYS 19 6.392 0.210 -5.458 138 HZ2 LYS 19 1HZ LYS 19 6.464 0.016 -7.134 139 HZ3 LYS 19 2HZ LYS 19 7.816 0.581 -6.290 140 H ASP 20 H ASP 20 6.845 -5.104 -10.944 141 HA ASP 20 HA ASP 20 7.762 -7.597 -10.012 142 HB2 ASP 20 2HB ASP 20 6.182 -7.543 -11.835 143 HB3 ASP 20 1HB ASP 20 7.232 -6.526 -12.808 144 H ARG 21 H ARG 21 9.266 -5.279 -12.287 145 HA ARG 21 HA ARG 21 11.725 -6.820 -12.399 146 HB2 ARG 21 2HB ARG 21 12.580 -5.097 -13.899 147 HB3 ARG 21 1HB ARG 21 10.983 -5.635 -14.407 148 HG2 ARG 21 2HG ARG 21 9.958 -3.602 -13.573 149 HG3 ARG 21 1HG ARG 21 11.485 -3.075 -12.850 150 HD2 ARG 21 2HD ARG 21 11.058 -1.909 -14.974 151 HD3 ARG 21 1HD ARG 21 12.501 -2.916 -15.078 152 HE ARG 21 HE ARG 21 11.107 -4.580 -16.264 153 HH11 ARG 21 1HH1 ARG 21 10.009 -1.242 -16.267 154 HH12 ARG 21 2HH1 ARG 21 9.104 -1.423 -17.733 155 HH21 ARG 21 1HH2 ARG 21 9.964 -4.793 -18.184 156 HH22 ARG 21 2HH2 ARG 21 9.077 -3.448 -18.822 157 H PHE 22 H PHE 22 10.505 -4.254 -10.395 158 HA PHE 22 HA PHE 22 12.975 -3.342 -9.340 159 HB2 PHE 22 2HB PHE 22 10.715 -2.266 -8.941 160 HB3 PHE 22 1HB PHE 22 10.315 -3.591 -7.858 161 HD1 PHE 22 HD2 PHE 22 11.452 -3.771 -5.631 162 HD2 PHE 22 HD1 PHE 22 12.258 -0.503 -8.262 163 HE1 PHE 22 HE2 PHE 22 12.463 -2.519 -3.769 164 HE2 PHE 22 HE1 PHE 22 13.265 0.736 -6.400 165 HZ PHE 22 HZ PHE 22 13.367 -0.262 -4.157 166 H PHE 23 H PHE 23 10.729 -5.892 -8.289 167 HA PHE 23 HA PHE 23 12.403 -6.829 -6.141 168 HB2 PHE 23 2HB PHE 23 9.732 -7.704 -7.295 169 HB3 PHE 23 1HB PHE 23 10.565 -8.719 -6.120 170 HD1 PHE 23 HD2 PHE 23 9.572 -5.084 -6.504 171 HD2 PHE 23 HD1 PHE 23 9.989 -8.427 -3.879 172 HE1 PHE 23 HE2 PHE 23 8.675 -3.744 -4.647 173 HE2 PHE 23 HE1 PHE 23 9.106 -7.078 -2.030 174 HZ PHE 23 HZ PHE 23 8.461 -4.743 -2.400 175 H SER 24 H SER 24 12.113 -7.644 -9.520 176 HA SER 24 HA SER 24 13.464 -10.236 -9.150 177 HB2 SER 24 2HB SER 24 12.260 -8.974 -11.654 178 HB3 SER 24 1HB SER 24 13.003 -10.574 -11.586 179 HG SER 24 HG SER 24 10.592 -9.674 -10.459 180 H GLU 25 H GLU 25 13.969 -7.174 -10.985 181 HA GLU 25 HA GLU 25 16.600 -8.192 -11.876 182 HB2 GLU 25 2HB GLU 25 14.979 -5.868 -13.011 183 HB3 GLU 25 1HB GLU 25 16.416 -6.599 -13.724 184 HG2 GLU 25 2HG GLU 25 13.719 -7.947 -13.369 185 HG3 GLU 25 1HG GLU 25 14.374 -7.322 -14.883 186 H HIS 26 H HIS 26 15.109 -5.372 -10.317 187 HA HIS 26 HA HIS 26 17.413 -3.652 -10.438 188 HB2 HIS 26 2HB HIS 26 15.211 -2.638 -10.302 189 HB3 HIS 26 1HB HIS 26 14.821 -3.527 -8.833 190 HD2 HIS 26 HD2 HIS 26 16.973 -0.425 -9.939 191 HE1 HIS 26 HE1 HIS 26 16.462 -0.396 -5.742 192 HE2 HIS 26 HE2 HIS 26 17.477 0.813 -7.719 193 H ARG 27 H ARG 27 15.775 -5.265 -7.745 194 HA ARG 27 HA ARG 27 18.338 -5.693 -6.339 195 HB2 ARG 27 2HB ARG 27 17.212 -5.177 -4.185 196 HB3 ARG 27 1HB ARG 27 17.231 -3.784 -5.249 197 HG2 ARG 27 2HG ARG 27 15.020 -3.536 -4.808 198 HG3 ARG 27 1HG ARG 27 14.742 -4.959 -5.807 199 HD2 ARG 27 2HD ARG 27 13.599 -5.220 -3.675 200 HD3 ARG 27 1HD ARG 27 14.924 -6.387 -3.763 201 HE ARG 27 HE ARG 27 15.057 -3.824 -2.270 202 HH11 ARG 27 1HH1 ARG 27 15.842 -7.219 -2.473 203 HH12 ARG 27 2HH1 ARG 27 16.700 -7.244 -0.973 204 HH21 ARG 27 1HH2 ARG 27 16.243 -3.838 -0.349 205 HH22 ARG 27 2HH2 ARG 27 16.925 -5.321 0.234 206 H GLN 28 H GLN 28 18.365 -7.671 -5.125 207 HA GLN 28 HA GLN 28 16.923 -9.814 -6.240 208 HB2 GLN 28 2HB GLN 28 17.961 -11.246 -4.548 209 HB3 GLN 28 1HB GLN 28 19.137 -10.110 -5.178 210 HG2 GLN 28 2HG GLN 28 19.703 -9.816 -2.993 211 HG3 GLN 28 1HG GLN 28 18.306 -8.745 -2.944 212 HE21 GLN 28 1HE2 GLN 28 16.434 -9.445 -1.844 213 HE22 GLN 28 2HE2 GLN 28 16.426 -10.832 -0.818 214 H SER 29 H SER 29 15.015 -10.773 -5.718 215 HA SER 29 HA SER 29 13.004 -9.504 -4.393 216 HB2 SER 29 2HB SER 29 11.891 -11.846 -4.338 217 HB3 SER 29 1HB SER 29 12.415 -11.227 -5.906 218 HG SER 29 HG SER 29 14.334 -12.648 -4.532 219 HA PRO 30 HA PRO 30 13.905 -10.386 0.033 220 HB2 PRO 30 2HB PRO 30 12.161 -8.606 1.078 221 HB3 PRO 30 1HB PRO 30 13.612 -8.028 0.230 222 HG2 PRO 30 2HG PRO 30 10.810 -8.279 -0.832 223 HG3 PRO 30 1HG PRO 30 11.932 -6.903 -0.941 224 HD2 PRO 30 2HD PRO 30 11.627 -8.697 -2.969 225 HD3 PRO 30 1HD PRO 30 13.159 -7.850 -2.657 226 H ILE 31 H ILE 31 11.858 -11.842 -1.801 227 HA ILE 31 HA ILE 31 9.690 -12.538 0.014 228 HB ILE 31 HB ILE 31 10.425 -13.559 -2.786 229 HG12 ILE 31 2HG1 ILE 31 9.864 -11.146 -2.832 230 HG13 ILE 31 1HG1 ILE 31 8.634 -12.089 -3.660 231 HG21 ILE 31 1HG2 ILE 31 9.046 -15.204 -1.594 232 HG22 ILE 31 2HG2 ILE 31 8.132 -14.472 -2.914 233 HG23 ILE 31 3HG2 ILE 31 7.830 -13.967 -1.250 234 HD11 ILE 31 3HD1 ILE 31 7.624 -10.326 -2.374 235 HD12 ILE 31 1HD1 ILE 31 8.421 -10.879 -0.901 236 HD13 ILE 31 2HD1 ILE 31 7.181 -11.879 -1.665 237 HA PRO 32 HA PRO 32 12.094 -15.716 2.107 238 HB2 PRO 32 2HB PRO 32 10.062 -17.767 2.094 239 HB3 PRO 32 1HB PRO 32 10.401 -16.606 3.388 240 HG2 PRO 32 2HG PRO 32 8.335 -16.487 1.253 241 HG3 PRO 32 1HG PRO 32 8.275 -15.863 2.912 242 HD2 PRO 32 2HD PRO 32 8.582 -14.192 0.844 243 HD3 PRO 32 1HD PRO 32 9.457 -13.914 2.365 244 HA PRO 33 HA PRO 33 14.115 -17.639 -1.390 245 HB2 PRO 33 2HB PRO 33 15.339 -19.772 0.090 246 HB3 PRO 33 1HB PRO 33 16.034 -18.184 -0.265 247 HG2 PRO 33 2HG PRO 33 14.615 -19.109 2.197 248 HG3 PRO 33 1HG PRO 33 15.996 -17.998 2.043 249 HD2 PRO 33 2HD PRO 33 13.571 -17.029 2.563 250 HD3 PRO 33 1HD PRO 33 14.629 -16.177 1.411 251 H GLU 34 H GLU 34 12.312 -19.757 0.785 252 HA GLU 34 HA GLU 34 12.120 -21.943 -1.104 253 HB2 GLU 34 2HB GLU 34 10.753 -21.487 1.581 254 HB3 GLU 34 1HB GLU 34 10.761 -23.008 0.682 255 HG2 GLU 34 2HG GLU 34 13.174 -23.211 0.924 256 HG3 GLU 34 1HG GLU 34 13.275 -21.612 1.658 257 H GLU 35 H GLU 35 10.111 -19.191 -0.224 258 HA GLU 35 HA GLU 35 7.736 -20.127 -1.586 259 HB2 GLU 35 2HB GLU 35 7.557 -18.620 0.328 260 HB3 GLU 35 1HB GLU 35 8.478 -17.381 -0.511 261 HG2 GLU 35 2HG GLU 35 6.694 -17.022 -2.094 262 HG3 GLU 35 1HG GLU 35 5.814 -18.435 -1.511 263 H ARG 36 H ARG 36 10.356 -17.784 -2.301 264 HA ARG 36 HA ARG 36 9.227 -16.775 -4.689 265 HB2 ARG 36 2HB ARG 36 11.398 -15.710 -5.047 266 HB3 ARG 36 1HB ARG 36 10.908 -15.531 -3.365 267 HG2 ARG 36 2HG ARG 36 12.486 -17.145 -2.614 268 HG3 ARG 36 1HG ARG 36 12.806 -17.723 -4.249 269 HD2 ARG 36 2HD ARG 36 13.569 -15.015 -3.113 270 HD3 ARG 36 1HD ARG 36 14.665 -16.361 -3.469 271 HE ARG 36 HE ARG 36 13.324 -14.609 -5.394 272 HH11 ARG 36 1HH1 ARG 36 15.443 -17.381 -4.967 273 HH12 ARG 36 2HH1 ARG 36 16.023 -17.319 -6.601 274 HH21 ARG 36 1HH2 ARG 36 14.096 -14.527 -7.484 275 HH22 ARG 36 2HH2 ARG 36 15.256 -15.696 -8.030 276 H ASP 37 H ASP 37 11.019 -19.652 -3.978 277 HA ASP 37 HA ASP 37 12.132 -20.448 -6.355 278 HB2 ASP 37 2HB ASP 37 12.168 -21.780 -4.240 279 HB3 ASP 37 1HB ASP 37 10.476 -22.199 -4.474 280 H ASP 38 H ASP 38 8.708 -20.532 -5.444 281 HA ASP 38 HA ASP 38 7.838 -21.426 -8.085 282 HB2 ASP 38 2HB ASP 38 6.223 -20.637 -5.617 283 HB3 ASP 38 1HB ASP 38 5.554 -21.342 -7.087 284 H PHE 39 H PHE 39 8.032 -18.419 -6.222 285 HA PHE 39 HA PHE 39 6.491 -16.953 -8.308 286 HB2 PHE 39 2HB PHE 39 6.839 -16.303 -5.343 287 HB3 PHE 39 1HB PHE 39 5.991 -15.285 -6.502 288 HD1 PHE 39 HD1 PHE 39 5.832 -18.423 -4.561 289 HD2 PHE 39 HD2 PHE 39 3.774 -15.906 -7.351 290 HE1 PHE 39 HE1 PHE 39 3.739 -19.644 -4.130 291 HE2 PHE 39 HE2 PHE 39 1.691 -17.133 -6.905 292 HZ PHE 39 HZ PHE 39 1.672 -18.997 -5.300 293 H ASP 40 H ASP 40 7.899 -15.978 -9.660 294 HA ASP 40 HA ASP 40 10.318 -14.603 -8.631 295 HB2 ASP 40 2HB ASP 40 9.380 -15.221 -11.463 296 HB3 ASP 40 1HB ASP 40 10.726 -14.132 -11.139 297 H GLY 41 H GLY 41 9.081 -13.068 -7.458 298 HA2 GLY 41 2HA GLY 41 9.000 -10.524 -8.167 299 HA3 GLY 41 1HA GLY 41 7.501 -11.072 -8.927 300 H LEU 42 H LEU 42 6.538 -9.492 -7.404 301 HA LEU 42 HA LEU 42 6.080 -10.218 -4.684 302 HB2 LEU 42 2HB LEU 42 4.430 -8.622 -6.676 303 HB3 LEU 42 1HB LEU 42 3.878 -8.893 -5.030 304 HG LEU 42 HG LEU 42 6.479 -7.464 -5.729 305 HD11 LEU 42 1HD1 LEU 42 5.334 -5.383 -5.156 306 HD12 LEU 42 2HD1 LEU 42 3.817 -6.253 -4.904 307 HD13 LEU 42 3HD1 LEU 42 4.535 -6.170 -6.516 308 HD21 LEU 42 3HD2 LEU 42 4.992 -7.728 -3.086 309 HD22 LEU 42 1HD2 LEU 42 6.455 -6.777 -3.367 310 HD23 LEU 42 2HD2 LEU 42 6.506 -8.530 -3.514 311 H SER 43 H SER 43 5.289 -12.237 -4.133 312 HA SER 43 HA SER 43 2.979 -13.407 -5.466 313 HB2 SER 43 2HB SER 43 4.688 -14.826 -4.278 314 HB3 SER 43 1HB SER 43 4.267 -14.046 -2.756 315 HG SER 43 HG SER 43 2.272 -15.318 -4.298 316 H TYR 44 H TYR 44 0.892 -12.703 -5.018 317 HA TYR 44 HA TYR 44 0.106 -11.470 -2.524 318 HB2 TYR 44 2HB TYR 44 -0.221 -9.167 -3.302 319 HB3 TYR 44 1HB TYR 44 1.458 -9.618 -3.557 320 HD1 TYR 44 HD2 TYR 44 1.901 -10.680 -6.030 321 HD2 TYR 44 HD1 TYR 44 -1.251 -7.970 -5.062 322 HE1 TYR 44 HE2 TYR 44 1.724 -10.047 -8.390 323 HE2 TYR 44 HE1 TYR 44 -1.425 -7.346 -7.429 324 HH TYR 44 HH TYR 44 0.045 -9.112 -9.908 325 H PHE 45 H PHE 45 -2.030 -9.949 -3.348 326 HA PHE 45 HA PHE 45 -3.986 -12.010 -3.951 327 HB2 PHE 45 2HB PHE 45 -4.448 -9.043 -3.387 328 HB3 PHE 45 1HB PHE 45 -5.654 -10.324 -3.323 329 HD1 PHE 45 HD1 PHE 45 -5.284 -12.218 -1.554 330 HD2 PHE 45 HD2 PHE 45 -3.283 -8.430 -1.396 331 HE1 PHE 45 HE1 PHE 45 -4.821 -12.553 0.841 332 HE2 PHE 45 HE2 PHE 45 -2.825 -8.781 1.000 333 HZ PHE 45 HZ PHE 45 -3.595 -10.838 2.119 334 H ASP 46 H ASP 46 -5.340 -12.057 -5.824 335 HA ASP 46 HA ASP 46 -4.349 -10.449 -8.091 336 HB2 ASP 46 2HB ASP 46 -5.547 -12.008 -9.590 337 HB3 ASP 46 1HB ASP 46 -4.391 -12.835 -8.564 338 HA PRO 47 HA PRO 47 -7.307 -7.355 -8.097 339 HB2 PRO 47 2HB PRO 47 -8.044 -7.832 -10.985 340 HB3 PRO 47 1HB PRO 47 -7.376 -6.376 -10.210 341 HG2 PRO 47 2HG PRO 47 -5.828 -7.891 -11.729 342 HG3 PRO 47 1HG PRO 47 -5.202 -7.198 -10.213 343 HD2 PRO 47 2HD PRO 47 -6.141 -10.013 -10.751 344 HD3 PRO 47 1HD PRO 47 -4.711 -9.449 -9.855 345 H ASP 48 H ASP 48 -9.201 -7.448 -7.040 346 HA ASP 48 HA ASP 48 -11.545 -8.721 -8.321 347 HB2 ASP 48 2HB ASP 48 -10.914 -9.618 -6.037 348 HB3 ASP 48 1HB ASP 48 -11.192 -8.014 -5.369 349 HA PRO 49 HA PRO 49 -12.225 -4.281 -9.121 350 HB2 PRO 49 2HB PRO 49 -14.655 -4.562 -10.454 351 HB3 PRO 49 1HB PRO 49 -13.071 -4.837 -11.205 352 HG2 PRO 49 2HG PRO 49 -14.970 -6.858 -10.043 353 HG3 PRO 49 1HG PRO 49 -14.076 -6.913 -11.581 354 HD2 PRO 49 2HD PRO 49 -13.203 -8.273 -9.435 355 HD3 PRO 49 1HD PRO 49 -12.047 -7.477 -10.531 356 H ASP 50 H ASP 50 -14.458 -6.380 -7.396 357 HA ASP 50 HA ASP 50 -16.154 -4.180 -6.462 358 HB2 ASP 50 2HB ASP 50 -17.190 -6.292 -7.204 359 HB3 ASP 50 1HB ASP 50 -16.297 -7.188 -5.984 360 H TYR 51 H TYR 51 -13.320 -5.778 -5.435 361 HA TYR 51 HA TYR 51 -13.735 -5.259 -2.555 362 HB2 TYR 51 2HB TYR 51 -12.390 -7.334 -3.810 363 HB3 TYR 51 1HB TYR 51 -11.047 -6.247 -3.488 364 HD1 TYR 51 HD2 TYR 51 -10.760 -5.414 -1.007 365 HD2 TYR 51 HD1 TYR 51 -13.212 -8.742 -2.109 366 HE1 TYR 51 HE2 TYR 51 -10.723 -6.222 1.317 367 HE2 TYR 51 HE1 TYR 51 -13.178 -9.528 0.202 368 HH TYR 51 HH TYR 51 -12.174 -7.652 2.776 369 H ARG 52 H ARG 52 -13.228 -3.423 -4.997 370 HA ARG 52 HA ARG 52 -11.025 -1.739 -4.054 371 HB2 ARG 52 2HB ARG 52 -11.014 -2.449 -6.406 372 HB3 ARG 52 1HB ARG 52 -12.670 -1.897 -6.623 373 HG2 ARG 52 2HG ARG 52 -11.939 0.429 -6.320 374 HG3 ARG 52 1HG ARG 52 -10.274 -0.125 -6.088 375 HD2 ARG 52 2HD ARG 52 -10.582 0.661 -8.370 376 HD3 ARG 52 1HD ARG 52 -10.288 -1.076 -8.374 377 HE ARG 52 HE ARG 52 -12.895 -1.160 -8.491 378 HH11 ARG 52 1HH1 ARG 52 -10.835 1.173 -10.116 379 HH12 ARG 52 2HH1 ARG 52 -11.941 1.426 -11.426 380 HH21 ARG 52 1HH2 ARG 52 -14.351 -0.815 -10.211 381 HH22 ARG 52 2HH2 ARG 52 -13.941 0.289 -11.482 382 H VAL 53 H VAL 53 -11.625 0.028 -2.817 383 HA VAL 53 HA VAL 53 -14.480 0.856 -2.787 384 HB VAL 53 HB VAL 53 -14.278 1.427 -0.425 385 HG11 VAL 53 1HG1 VAL 53 -13.241 -1.398 -0.897 386 HG12 VAL 53 2HG1 VAL 53 -14.931 -0.887 -0.933 387 HG13 VAL 53 3HG1 VAL 53 -14.025 -0.817 0.579 388 HG21 VAL 53 3HG2 VAL 53 -12.254 0.949 0.929 389 HG22 VAL 53 1HG2 VAL 53 -11.926 2.148 -0.325 390 HG23 VAL 53 2HG2 VAL 53 -11.381 0.483 -0.534 391 H GLU 54 H GLU 54 -14.766 3.131 -1.977 392 HA GLU 54 HA GLU 54 -12.833 4.974 -3.259 393 HB2 GLU 54 2HB GLU 54 -14.779 6.556 -3.260 394 HB3 GLU 54 1HB GLU 54 -15.110 5.074 -4.152 395 HG2 GLU 54 2HG GLU 54 -16.333 4.203 -2.134 396 HG3 GLU 54 1HG GLU 54 -16.096 5.771 -1.365 397 H ALA 55 H ALA 55 -12.078 6.855 -2.044 398 HA ALA 55 HA ALA 55 -12.674 6.946 0.847 399 HB1 ALA 55 3HB ALA 55 -10.283 6.882 1.445 400 HB2 ALA 55 1HB ALA 55 -9.849 6.632 -0.251 401 HB3 ALA 55 2HB ALA 55 -10.761 5.398 0.620 402 H THR 56 H THR 56 -12.853 9.016 1.528 403 HA THR 56 HA THR 56 -12.167 11.254 -0.173 404 HB THR 56 HB THR 56 -13.378 11.161 2.629 405 HG1 THR 56 HG1 THR 56 -14.601 11.522 0.070 406 HG21 THR 56 3HG2 THR 56 -13.233 13.483 0.662 407 HG22 THR 56 1HG2 THR 56 -12.354 13.373 2.194 408 HG23 THR 56 2HG2 THR 56 -14.114 13.486 2.189 409 H VAL 57 H VAL 57 -10.302 12.332 -0.062 410 HA VAL 57 HA VAL 57 -8.180 11.719 1.763 411 HB VAL 57 HB VAL 57 -8.327 13.937 -0.337 412 HG11 VAL 57 1HG1 VAL 57 -5.903 12.594 0.921 413 HG12 VAL 57 2HG1 VAL 57 -6.458 14.237 1.247 414 HG13 VAL 57 3HG1 VAL 57 -5.860 13.812 -0.357 415 HG21 VAL 57 3HG2 VAL 57 -8.835 11.753 -1.360 416 HG22 VAL 57 1HG2 VAL 57 -7.352 11.078 -0.682 417 HG23 VAL 57 2HG2 VAL 57 -7.268 12.351 -1.898 418 H THR 58 H THR 58 -7.384 12.954 3.419 419 HA THR 58 HA THR 58 -8.504 15.619 4.023 420 HB THR 58 HB THR 58 -8.101 13.393 6.083 421 HG1 THR 58 HG1 THR 58 -10.257 14.075 4.526 422 HG21 THR 58 3HG2 THR 58 -7.700 15.628 7.055 423 HG22 THR 58 1HG2 THR 58 -9.213 14.951 7.664 424 HG23 THR 58 2HG2 THR 58 -9.246 16.197 6.414 425 H VAL 59 H VAL 59 -6.732 16.895 3.803 426 HA VAL 59 HA VAL 59 -4.024 15.822 4.165 427 HB VAL 59 HB VAL 59 -4.960 18.472 2.959 428 HG11 VAL 59 1HG1 VAL 59 -2.668 18.672 3.874 429 HG12 VAL 59 2HG1 VAL 59 -2.648 18.724 2.110 430 HG13 VAL 59 3HG1 VAL 59 -2.169 17.249 2.955 431 HG21 VAL 59 3HG2 VAL 59 -4.381 17.451 0.790 432 HG22 VAL 59 1HG2 VAL 59 -5.641 16.529 1.618 433 HG23 VAL 59 2HG2 VAL 59 -3.975 15.938 1.605 434 H HIS 60 H HIS 60 -2.594 16.643 5.670 435 HA HIS 60 HA HIS 60 -3.716 18.406 7.769 436 HB2 HIS 60 2HB HIS 60 -1.653 16.162 7.980 437 HB3 HIS 60 1HB HIS 60 -2.167 17.196 9.320 438 HD1 HIS 60 HD1 HIS 60 -3.008 14.042 7.737 439 HD2 HIS 60 HD2 HIS 60 -5.131 17.024 9.714 440 HE1 HIS 60 HE1 HIS 60 -5.257 13.058 8.263 441 HE2 HIS 60 HE2 HIS 60 -6.433 14.809 9.608 442 H GLU 61 H GLU 61 -2.775 20.210 8.190 443 HA GLU 61 HA GLU 61 -0.697 21.295 6.512 444 HB2 GLU 61 2HB GLU 61 -1.096 23.414 7.748 445 HB3 GLU 61 1HB GLU 61 -2.594 22.698 7.163 446 HG2 GLU 61 2HG GLU 61 -2.987 21.777 9.466 447 HG3 GLU 61 1HG GLU 61 -1.555 22.645 10.014 448 H THR 62 H THR 62 -0.766 19.796 9.637 449 HA THR 62 HA THR 62 2.128 20.319 9.986 450 HB THR 62 HB THR 62 1.728 19.886 12.453 451 HG1 THR 62 HG1 THR 62 -0.276 18.851 12.359 452 HG21 THR 62 3HG2 THR 62 1.930 22.219 11.616 453 HG22 THR 62 1HG2 THR 62 0.816 22.112 12.984 454 HG23 THR 62 2HG2 THR 62 0.187 22.263 11.342 455 HA PRO 63 HA PRO 63 1.684 15.807 9.134 456 HB2 PRO 63 2HB PRO 63 4.137 15.413 8.005 457 HB3 PRO 63 1HB PRO 63 2.816 16.207 7.120 458 HG2 PRO 63 2HG PRO 63 5.161 17.455 8.517 459 HG3 PRO 63 1HG PRO 63 4.455 17.852 6.934 460 HD2 PRO 63 2HD PRO 63 3.912 19.280 9.229 461 HD3 PRO 63 1HD PRO 63 2.785 19.165 7.860 462 H GLU 64 H GLU 64 1.955 14.298 10.750 463 HA GLU 64 HA GLU 64 4.028 14.576 12.760 464 HB2 GLU 64 2HB GLU 64 2.969 12.598 13.811 465 HB3 GLU 64 1HB GLU 64 1.780 13.840 13.444 466 HG2 GLU 64 2HG GLU 64 1.105 12.569 11.425 467 HG3 GLU 64 1HG GLU 64 2.260 11.306 11.844 468 H SER 65 H SER 65 5.568 12.849 13.246 469 HA SER 65 HA SER 65 6.800 11.877 10.758 470 HB2 SER 65 2HB SER 65 8.841 11.677 12.255 471 HB3 SER 65 1HB SER 65 8.199 13.309 12.098 472 HG SER 65 HG SER 65 7.724 11.530 14.266 473 H VAL 66 H VAL 66 6.341 9.851 10.231 474 HA VAL 66 HA VAL 66 5.867 7.752 12.267 475 HB VAL 66 HB VAL 66 4.742 7.858 9.424 476 HG11 VAL 66 1HG1 VAL 66 3.170 6.120 10.211 477 HG12 VAL 66 2HG1 VAL 66 3.965 6.109 11.786 478 HG13 VAL 66 3HG1 VAL 66 4.848 5.588 10.349 479 HG21 VAL 66 3HG2 VAL 66 3.825 9.769 10.642 480 HG22 VAL 66 1HG2 VAL 66 3.363 8.729 11.997 481 HG23 VAL 66 2HG2 VAL 66 2.568 8.546 10.431 482 H ASP 67 H ASP 67 7.467 6.231 12.278 483 HA ASP 67 HA ASP 67 9.469 6.140 10.156 484 HB2 ASP 67 2HB ASP 67 9.285 4.585 12.780 485 HB3 ASP 67 1HB ASP 67 10.633 4.484 11.650 486 H LEU 68 H LEU 68 9.200 4.849 8.445 487 HA LEU 68 HA LEU 68 7.788 2.253 8.740 488 HB2 LEU 68 2HB LEU 68 7.736 4.036 6.276 489 HB3 LEU 68 1HB LEU 68 6.881 2.516 6.485 490 HG LEU 68 HG LEU 68 6.305 5.062 8.064 491 HD11 LEU 68 1HD1 LEU 68 4.275 5.257 6.734 492 HD12 LEU 68 2HD1 LEU 68 4.750 3.860 5.764 493 HD13 LEU 68 3HD1 LEU 68 5.713 5.338 5.719 494 HD21 LEU 68 3HD2 LEU 68 4.767 2.442 7.984 495 HD22 LEU 68 1HD2 LEU 68 4.280 3.907 8.845 496 HD23 LEU 68 2HD2 LEU 68 5.732 3.040 9.335 497 H GLU 69 H GLU 69 8.359 0.819 6.768 498 HA GLU 69 HA GLU 69 11.201 0.420 6.688 499 HB2 GLU 69 2HB GLU 69 10.687 -1.602 5.430 500 HB3 GLU 69 1HB GLU 69 9.508 -1.453 6.729 501 HG2 GLU 69 2HG GLU 69 7.899 -0.451 5.058 502 HG3 GLU 69 1HG GLU 69 9.057 -0.831 3.787 503 H THR 70 H THR 70 12.552 0.561 4.877 504 HA THR 70 HA THR 70 11.424 1.618 2.341 505 HB THR 70 HB THR 70 13.000 3.232 3.462 506 HG1 THR 70 HG1 THR 70 14.450 3.314 1.482 507 HG21 THR 70 3HG2 THR 70 15.406 2.763 3.505 508 HG22 THR 70 1HG2 THR 70 15.123 1.132 2.894 509 HG23 THR 70 2HG2 THR 70 14.544 1.590 4.498 510 H SER 71 H SER 71 13.067 1.060 0.508 511 HA SER 71 HA SER 71 12.739 -1.642 -0.025 512 HB2 SER 71 2HB SER 71 14.627 0.296 -1.413 513 HB3 SER 71 1HB SER 71 13.998 -1.213 -2.085 514 HG SER 71 HG SER 71 11.880 0.080 -1.330 515 H ASP 72 H ASP 72 15.849 0.058 0.753 516 HA ASP 72 HA ASP 72 17.280 -2.465 0.936 517 HB2 ASP 72 2HB ASP 72 18.196 0.417 1.321 518 HB3 ASP 72 1HB ASP 72 19.273 -0.973 1.415 519 H ASP 73 H ASP 73 15.409 -2.666 2.825 520 HA ASP 73 HA ASP 73 15.091 -3.416 4.897 521 HB2 ASP 73 2HB ASP 73 16.886 -4.708 5.950 522 HB3 ASP 73 1HB ASP 73 16.846 -4.977 4.217 523 H ARG 74 H ARG 74 15.876 -0.479 4.746 524 HA ARG 74 HA ARG 74 17.047 -0.042 7.425 525 HB2 ARG 74 2HB ARG 74 18.167 0.899 5.371 526 HB3 ARG 74 1HB ARG 74 16.745 1.880 5.070 527 HG2 ARG 74 2HG ARG 74 17.161 3.237 7.004 528 HG3 ARG 74 1HG ARG 74 18.391 2.120 7.603 529 HD2 ARG 74 2HD ARG 74 18.593 3.794 5.075 530 HD3 ARG 74 1HD ARG 74 19.422 4.123 6.603 531 HE ARG 74 HE ARG 74 20.310 1.661 6.108 532 HH11 ARG 74 1HH1 ARG 74 20.080 4.391 3.917 533 HH12 ARG 74 2HH1 ARG 74 21.416 3.882 2.937 534 HH21 ARG 74 1HH2 ARG 74 22.032 0.965 4.804 535 HH22 ARG 74 2HH2 ARG 74 22.535 1.919 3.445 536 H THR 75 H THR 75 16.103 2.145 8.382 537 HA THR 75 HA THR 75 13.149 2.042 8.306 538 HB THR 75 HB THR 75 14.859 2.466 10.816 539 HG1 THR 75 HG1 THR 75 14.637 0.246 9.959 540 HG21 THR 75 3HG2 THR 75 11.826 2.317 10.494 541 HG22 THR 75 1HG2 THR 75 12.748 3.776 10.878 542 HG23 THR 75 2HG2 THR 75 12.690 2.438 12.029 543 H VAL 76 H VAL 76 12.329 4.031 7.940 544 HA VAL 76 HA VAL 76 14.087 6.392 8.041 545 HB VAL 76 HB VAL 76 13.351 7.081 5.699 546 HG11 VAL 76 1HG1 VAL 76 15.064 5.748 4.521 547 HG12 VAL 76 2HG1 VAL 76 15.098 4.590 5.853 548 HG13 VAL 76 3HG1 VAL 76 15.634 6.252 6.114 549 HG21 VAL 76 3HG2 VAL 76 12.556 4.156 5.419 550 HG22 VAL 76 1HG2 VAL 76 12.590 5.356 4.120 551 HG23 VAL 76 2HG2 VAL 76 11.448 5.526 5.452 552 H ARG 77 H ARG 77 13.083 8.290 8.166 553 HA ARG 77 HA ARG 77 10.556 8.410 9.460 554 HB2 ARG 77 2HB ARG 77 12.577 9.825 9.983 555 HB3 ARG 77 1HB ARG 77 12.411 10.618 8.432 556 HG2 ARG 77 2HG ARG 77 10.307 10.779 10.620 557 HG3 ARG 77 1HG ARG 77 11.634 11.924 10.462 558 HD2 ARG 77 2HD ARG 77 9.285 11.509 8.603 559 HD3 ARG 77 1HD ARG 77 9.771 12.978 9.448 560 HE ARG 77 HE ARG 77 11.127 11.799 7.089 561 HH11 ARG 77 1HH1 ARG 77 10.488 14.622 9.090 562 HH12 ARG 77 2HH1 ARG 77 11.319 15.704 8.022 563 HH21 ARG 77 1HH2 ARG 77 12.229 13.222 5.741 564 HH22 ARG 77 2HH2 ARG 77 12.300 14.905 6.135 565 H TYR 78 H TYR 78 8.648 8.533 8.447 566 HA TYR 78 HA TYR 78 8.370 9.868 5.816 567 HB2 TYR 78 2HB TYR 78 6.686 7.751 7.211 568 HB3 TYR 78 1HB TYR 78 6.018 8.737 5.920 569 HD1 TYR 78 HD2 TYR 78 9.019 6.524 6.561 570 HD2 TYR 78 HD1 TYR 78 6.108 7.883 3.749 571 HE1 TYR 78 HE2 TYR 78 9.846 4.911 4.906 572 HE2 TYR 78 HE1 TYR 78 6.944 6.277 2.095 573 HH TYR 78 HH TYR 78 9.076 3.738 2.909 574 H LEU 79 H LEU 79 6.768 11.453 5.625 575 HA LEU 79 HA LEU 79 5.794 12.703 8.102 576 HB2 LEU 79 2HB LEU 79 6.334 13.830 5.325 577 HB3 LEU 79 1HB LEU 79 5.507 14.743 6.583 578 HG LEU 79 HG LEU 79 8.340 13.653 6.869 579 HD11 LEU 79 1HD1 LEU 79 7.477 16.478 6.191 580 HD12 LEU 79 2HD1 LEU 79 8.285 15.342 5.106 581 HD13 LEU 79 3HD1 LEU 79 9.127 15.942 6.531 582 HD21 LEU 79 3HD2 LEU 79 8.467 15.155 8.822 583 HD22 LEU 79 1HD2 LEU 79 7.201 13.943 9.017 584 HD23 LEU 79 2HD2 LEU 79 6.773 15.605 8.597 585 H HIS 80 H HIS 80 3.686 12.762 8.481 586 HA HIS 80 HA HIS 80 1.871 11.333 6.740 587 HB2 HIS 80 2HB HIS 80 1.810 10.907 9.143 588 HB3 HIS 80 1HB HIS 80 1.530 12.615 9.483 589 HD2 HIS 80 HD2 HIS 80 -0.505 10.329 6.984 590 HE1 HIS 80 HE1 HIS 80 -3.068 11.900 9.940 591 HE2 HIS 80 HE2 HIS 80 -2.886 10.341 7.965 592 H VAL 81 H VAL 81 1.352 12.510 5.016 593 HA VAL 81 HA VAL 81 0.777 15.378 5.224 594 HB VAL 81 HB VAL 81 0.876 15.361 2.742 595 HG11 VAL 81 1HG1 VAL 81 3.303 14.916 2.571 596 HG12 VAL 81 2HG1 VAL 81 3.262 14.028 4.095 597 HG13 VAL 81 3HG1 VAL 81 2.916 15.760 4.073 598 HG21 VAL 81 3HG2 VAL 81 1.609 13.313 1.532 599 HG22 VAL 81 1HG2 VAL 81 0.035 13.079 2.299 600 HG23 VAL 81 2HG2 VAL 81 1.483 12.381 3.028 601 H ALA 82 H ALA 82 -0.948 12.354 4.638 602 HA ALA 82 HA ALA 82 -3.502 13.825 4.634 603 HB1 ALA 82 3HB ALA 82 -2.748 11.992 2.321 604 HB2 ALA 82 1HB ALA 82 -2.902 13.750 2.240 605 HB3 ALA 82 2HB ALA 82 -4.322 12.756 2.566 606 H THR 83 H THR 83 -5.366 12.440 4.909 607 HA THR 83 HA THR 83 -4.877 9.620 5.618 608 HB THR 83 HB THR 83 -6.706 11.524 7.178 609 HG1 THR 83 HG1 THR 83 -4.995 10.449 8.797 610 HG21 THR 83 3HG2 THR 83 -6.114 8.570 7.657 611 HG22 THR 83 1HG2 THR 83 -7.647 9.222 7.062 612 HG23 THR 83 2HG2 THR 83 -7.095 9.609 8.693 613 H LEU 84 H LEU 84 -6.285 8.308 4.641 614 HA LEU 84 HA LEU 84 -8.296 9.466 2.819 615 HB2 LEU 84 2HB LEU 84 -7.113 6.659 2.654 616 HB3 LEU 84 1HB LEU 84 -7.904 7.582 1.384 617 HG LEU 84 HG LEU 84 -5.128 8.122 2.528 618 HD11 LEU 84 1HD1 LEU 84 -4.279 7.463 0.321 619 HD12 LEU 84 2HD1 LEU 84 -5.919 7.046 -0.189 620 HD13 LEU 84 3HD1 LEU 84 -5.144 6.150 1.119 621 HD21 LEU 84 3HD2 LEU 84 -6.558 9.612 0.303 622 HD22 LEU 84 1HD2 LEU 84 -4.868 9.835 0.772 623 HD23 LEU 84 2HD2 LEU 84 -6.158 10.244 1.900 624 H SER 85 H SER 85 -10.116 9.507 4.061 625 HA SER 85 HA SER 85 -10.847 7.352 5.883 626 HB2 SER 85 2HB SER 85 -12.213 10.003 5.224 627 HB3 SER 85 1HB SER 85 -12.702 8.894 6.513 628 HG SER 85 HG SER 85 -10.119 9.324 6.812 629 H PHE 86 H PHE 86 -12.451 5.871 5.513 630 HA PHE 86 HA PHE 86 -14.330 6.047 3.324 631 HB2 PHE 86 2HB PHE 86 -13.517 3.996 2.148 632 HB3 PHE 86 1HB PHE 86 -12.376 5.319 2.052 633 HD1 PHE 86 HD1 PHE 86 -10.239 5.234 3.315 634 HD2 PHE 86 HD2 PHE 86 -12.926 1.909 3.288 635 HE1 PHE 86 HE1 PHE 86 -8.446 3.777 4.136 636 HE2 PHE 86 HE2 PHE 86 -11.125 0.459 4.116 637 HZ PHE 86 HZ PHE 86 -8.887 1.389 4.541 638 H ASP 87 H ASP 87 -15.341 3.767 3.041 639 HA ASP 87 HA ASP 87 -15.807 2.460 5.653 640 HB2 ASP 87 2HB ASP 87 -17.855 3.507 4.846 641 HB3 ASP 87 1HB ASP 87 -17.649 2.802 3.246 642 H LEU 88 H LEU 88 -15.636 0.264 5.729 643 HA LEU 88 HA LEU 88 -15.279 -1.438 3.410 644 HB2 LEU 88 2HB LEU 88 -12.970 -0.555 3.717 645 HB3 LEU 88 1HB LEU 88 -13.014 -1.012 5.414 646 HG LEU 88 HG LEU 88 -13.246 -3.446 4.658 647 HD11 LEU 88 1HD1 LEU 88 -14.045 -3.085 2.384 648 HD12 LEU 88 2HD1 LEU 88 -12.566 -4.042 2.380 649 HD13 LEU 88 3HD1 LEU 88 -12.510 -2.333 1.935 650 HD21 LEU 88 3HD2 LEU 88 -10.699 -2.016 3.863 651 HD22 LEU 88 1HD2 LEU 88 -10.861 -3.739 4.214 652 HD23 LEU 88 2HD2 LEU 88 -11.130 -2.553 5.489 653 H ASP 89 H ASP 89 -16.319 -3.292 3.951 654 HA ASP 89 HA ASP 89 -17.249 -5.026 5.090 655 HB2 ASP 89 2HB ASP 89 -14.884 -5.358 5.883 656 HB3 ASP 89 1HB ASP 89 -15.241 -4.359 7.289 657 H GLY 90 H GLY 90 -18.134 -2.166 5.478 658 HA2 GLY 90 2HA GLY 90 -19.903 -1.136 6.500 659 HA3 GLY 90 1HA GLY 90 -20.153 -2.572 7.474 660 H GLU 91 H GLU 91 -16.979 -1.208 7.651 661 HA GLU 91 HA GLU 91 -17.656 0.330 10.098 662 HB2 GLU 91 2HB GLU 91 -15.481 -0.402 11.094 663 HB3 GLU 91 1HB GLU 91 -16.575 -1.753 10.827 664 HG2 GLU 91 2HG GLU 91 -15.340 -2.453 8.874 665 HG3 GLU 91 1HG GLU 91 -14.322 -1.021 8.939 666 H SER 92 H SER 92 -16.709 2.320 10.274 667 HA SER 92 HA SER 92 -15.587 3.604 8.017 668 HB2 SER 92 2HB SER 92 -16.981 4.755 9.759 669 HB3 SER 92 1HB SER 92 -15.673 4.556 10.916 670 HG SER 92 HG SER 92 -15.706 6.624 9.897 671 H ARG 93 H ARG 93 -13.660 2.888 7.349 672 HA ARG 93 HA ARG 93 -11.379 2.637 9.234 673 HB2 ARG 93 2HB ARG 93 -11.816 1.425 6.470 674 HB3 ARG 93 1HB ARG 93 -10.337 1.258 7.404 675 HG2 ARG 93 2HG ARG 93 -13.060 0.185 8.203 676 HG3 ARG 93 1HG ARG 93 -11.742 -0.758 7.503 677 HD2 ARG 93 2HD ARG 93 -11.523 -1.221 9.780 678 HD3 ARG 93 1HD ARG 93 -10.362 0.092 9.572 679 HE ARG 93 HE ARG 93 -13.059 0.843 10.407 680 HH11 ARG 93 1HH1 ARG 93 -9.800 0.102 11.456 681 HH12 ARG 93 2HH1 ARG 93 -9.983 0.882 12.990 682 HH21 ARG 93 1HH2 ARG 93 -13.272 1.901 12.426 683 HH22 ARG 93 2HH2 ARG 93 -11.945 1.901 13.540 684 H ASP 94 H ASP 94 -9.487 3.761 8.790 685 HA ASP 94 HA ASP 94 -9.359 5.411 6.333 686 HB2 ASP 94 2HB ASP 94 -8.451 7.316 7.656 687 HB3 ASP 94 1HB ASP 94 -10.105 6.921 8.097 688 H LEU 95 H LEU 95 -7.462 5.334 5.303 689 HA LEU 95 HA LEU 95 -5.099 4.133 6.639 690 HB2 LEU 95 2HB LEU 95 -5.739 4.255 3.662 691 HB3 LEU 95 1HB LEU 95 -4.259 3.604 4.356 692 HG LEU 95 HG LEU 95 -7.057 2.444 4.512 693 HD11 LEU 95 1HD1 LEU 95 -4.447 1.312 3.469 694 HD12 LEU 95 2HD1 LEU 95 -5.787 1.930 2.497 695 HD13 LEU 95 3HD1 LEU 95 -6.010 0.488 3.485 696 HD21 LEU 95 3HD2 LEU 95 -4.646 1.537 6.117 697 HD22 LEU 95 1HD2 LEU 95 -6.178 0.668 5.977 698 HD23 LEU 95 2HD2 LEU 95 -6.131 2.244 6.759 699 H HIS 96 H HIS 96 -3.301 5.340 6.794 700 HA HIS 96 HA HIS 96 -3.554 8.177 6.126 701 HB2 HIS 96 2HB HIS 96 -1.534 6.680 7.860 702 HB3 HIS 96 1HB HIS 96 -1.651 8.430 7.705 703 HD2 HIS 96 HD2 HIS 96 -3.992 5.507 9.020 704 HE1 HIS 96 HE1 HIS 96 -4.693 9.043 11.216 705 HE2 HIS 96 HE2 HIS 96 -5.484 6.689 10.759 706 H ALA 97 H ALA 97 -2.278 9.173 4.645 707 HA ALA 97 HA ALA 97 -0.489 7.566 2.945 708 HB1 ALA 97 3HB ALA 97 -2.412 8.608 1.799 709 HB2 ALA 97 1HB ALA 97 -0.894 9.292 1.215 710 HB3 ALA 97 2HB ALA 97 -1.898 10.204 2.349 711 H PHE 98 H PHE 98 1.641 8.021 2.857 712 HA PHE 98 HA PHE 98 2.672 10.483 4.136 713 HB2 PHE 98 2HB PHE 98 4.173 7.854 4.372 714 HB3 PHE 98 1HB PHE 98 4.297 9.300 5.357 715 HD1 PHE 98 HD1 PHE 98 2.710 9.692 7.207 716 HD2 PHE 98 HD2 PHE 98 2.528 6.133 4.863 717 HE1 PHE 98 HE1 PHE 98 1.334 8.617 8.930 718 HE2 PHE 98 HE2 PHE 98 1.155 5.067 6.597 719 HZ PHE 98 HZ PHE 98 0.562 6.308 8.623 720 H ARG 99 H ARG 99 5.046 10.714 3.637 721 HA ARG 99 HA ARG 99 6.269 9.185 1.518 722 HB2 ARG 99 2HB ARG 99 6.934 11.096 0.124 723 HB3 ARG 99 1HB ARG 99 5.191 10.926 0.148 724 HG2 ARG 99 2HG ARG 99 6.105 12.809 2.224 725 HG3 ARG 99 1HG ARG 99 6.664 13.289 0.619 726 HD2 ARG 99 2HD ARG 99 3.799 12.739 1.432 727 HD3 ARG 99 1HD ARG 99 4.526 14.325 1.151 728 HE ARG 99 HE ARG 99 4.795 12.655 -1.149 729 HH11 ARG 99 1HH1 ARG 99 2.421 14.608 0.552 730 HH12 ARG 99 2HH1 ARG 99 1.478 14.915 -0.868 731 HH21 ARG 99 1HH2 ARG 99 3.572 13.062 -2.991 732 HH22 ARG 99 2HH2 ARG 99 2.133 14.035 -2.889 733 H GLN 100 H GLN 100 8.623 9.595 1.490 734 HA GLN 100 HA GLN 100 9.705 9.506 4.024 735 HB2 GLN 100 2HB GLN 100 11.048 10.164 1.378 736 HB3 GLN 100 1HB GLN 100 11.949 9.866 2.864 737 HG2 GLN 100 2HG GLN 100 11.110 7.584 2.979 738 HG3 GLN 100 1HG GLN 100 10.066 7.861 1.583 739 HE21 GLN 100 1HE2 GLN 100 13.433 7.679 2.619 740 HE22 GLN 100 2HE2 GLN 100 14.075 7.251 1.072 741 H ALA 101 H ALA 101 10.629 12.223 1.824 742 HA ALA 101 HA ALA 101 10.713 13.993 4.206 743 HB1 ALA 101 3HB ALA 101 12.962 13.395 3.387 744 HB2 ALA 101 1HB ALA 101 12.640 15.124 3.232 745 HB3 ALA 101 2HB ALA 101 12.576 14.079 1.806 746 H ALA 102 H ALA 102 11.002 14.713 0.680 747 HA ALA 102 HA ALA 102 8.823 16.700 0.981 748 HB1 ALA 102 3HB ALA 102 11.550 17.135 -0.298 749 HB2 ALA 102 1HB ALA 102 11.050 17.738 1.286 750 HB3 ALA 102 2HB ALA 102 10.256 18.328 -0.176 751 H ASP 103 H ASP 103 8.400 14.173 -0.275 752 HA ASP 103 HA ASP 103 8.800 14.234 -3.099 753 HB2 ASP 103 2HB ASP 103 8.389 12.064 -2.175 754 HB3 ASP 103 1HB ASP 103 6.982 12.621 -1.288 755 H GLU 104 H GLU 104 7.605 15.084 -4.672 756 HA GLU 104 HA GLU 104 4.887 16.155 -4.190 757 HB2 GLU 104 2HB GLU 104 7.024 17.532 -5.893 758 HB3 GLU 104 1HB GLU 104 5.381 18.107 -5.605 759 HG2 GLU 104 2HG GLU 104 5.924 18.359 -3.184 760 HG3 GLU 104 1HG GLU 104 7.578 17.857 -3.525 761 H SER 105 H SER 105 6.555 13.816 -5.577 762 HA SER 105 HA SER 105 5.607 13.924 -8.331 763 HB2 SER 105 2HB SER 105 7.245 11.787 -6.891 764 HB3 SER 105 1HB SER 105 6.999 11.917 -8.634 765 HG SER 105 HG SER 105 9.015 12.785 -7.805 766 H ARG 106 H ARG 106 3.930 13.422 -5.748 767 HA ARG 106 HA ARG 106 1.785 12.699 -5.484 768 HB2 ARG 106 2HB ARG 106 2.098 11.172 -8.107 769 HB3 ARG 106 1HB ARG 106 0.588 11.393 -7.237 770 HG2 ARG 106 2HG ARG 106 2.195 13.669 -8.448 771 HG3 ARG 106 1HG ARG 106 0.871 12.843 -9.268 772 HD2 ARG 106 2HD ARG 106 -0.079 14.817 -8.384 773 HD3 ARG 106 1HD ARG 106 -0.603 13.536 -7.297 774 HE ARG 106 HE ARG 106 0.958 14.321 -5.667 775 HH11 ARG 106 1HH1 ARG 106 0.567 16.508 -8.384 776 HH12 ARG 106 2HH1 ARG 106 1.193 17.877 -7.522 777 HH21 ARG 106 1HH2 ARG 106 1.783 16.134 -4.552 778 HH22 ARG 106 2HH2 ARG 106 1.878 17.661 -5.365 779 H THR 107 H THR 107 4.395 11.057 -4.882 780 HA THR 107 HA THR 107 3.534 8.293 -4.997 781 HB THR 107 HB THR 107 6.027 9.435 -3.654 782 HG1 THR 107 HG1 THR 107 5.330 9.168 -6.312 783 HG21 THR 107 3HG2 THR 107 5.549 7.054 -3.097 784 HG22 THR 107 1HG2 THR 107 6.999 7.208 -4.093 785 HG23 THR 107 2HG2 THR 107 5.481 6.670 -4.818 786 H LEU 108 H LEU 108 1.696 8.289 -3.693 787 HA LEU 108 HA LEU 108 1.890 8.962 -0.845 788 HB2 LEU 108 2HB LEU 108 -0.479 7.900 -2.430 789 HB3 LEU 108 1HB LEU 108 -0.524 8.483 -0.773 790 HG LEU 108 HG LEU 108 -0.059 10.138 -3.284 791 HD11 LEU 108 1HD1 LEU 108 -2.165 11.242 -2.682 792 HD12 LEU 108 2HD1 LEU 108 -2.345 10.168 -1.290 793 HD13 LEU 108 3HD1 LEU 108 -2.393 9.511 -2.928 794 HD21 LEU 108 3HD2 LEU 108 0.009 11.059 -0.382 795 HD22 LEU 108 1HD2 LEU 108 0.026 12.121 -1.793 796 HD23 LEU 108 2HD2 LEU 108 1.373 11.026 -1.504 797 H PHE 109 H PHE 109 2.670 7.477 0.449 798 HA PHE 109 HA PHE 109 2.597 4.606 -0.238 799 HB2 PHE 109 2HB PHE 109 4.803 5.790 0.254 800 HB3 PHE 109 1HB PHE 109 4.237 6.072 1.894 801 HD1 PHE 109 HD1 PHE 109 5.014 3.339 -0.556 802 HD2 PHE 109 HD2 PHE 109 4.607 4.409 3.571 803 HE1 PHE 109 HE1 PHE 109 5.979 1.174 0.112 804 HE2 PHE 109 HE2 PHE 109 5.571 2.241 4.222 805 HZ PHE 109 HZ PHE 109 6.260 0.624 2.499 806 H VAL 110 H VAL 110 0.796 3.662 0.614 807 HA VAL 110 HA VAL 110 -0.170 4.481 3.303 808 HB VAL 110 HB VAL 110 -2.485 3.655 2.539 809 HG11 VAL 110 1HG1 VAL 110 -3.077 5.777 1.446 810 HG12 VAL 110 2HG1 VAL 110 -1.367 6.115 1.167 811 HG13 VAL 110 3HG1 VAL 110 -1.993 6.030 2.814 812 HG21 VAL 110 3HG2 VAL 110 -2.997 3.683 0.126 813 HG22 VAL 110 1HG2 VAL 110 -1.810 2.436 0.505 814 HG23 VAL 110 2HG2 VAL 110 -1.288 3.942 -0.243 815 HA PRO 111 HA PRO 111 0.816 0.014 3.945 816 HB2 PRO 111 2HB PRO 111 1.474 0.824 6.712 817 HB3 PRO 111 1HB PRO 111 2.525 0.067 5.500 818 HG2 PRO 111 2HG PRO 111 2.835 2.652 6.350 819 HG3 PRO 111 1HG PRO 111 3.351 2.067 4.754 820 HD2 PRO 111 2HD PRO 111 0.898 3.643 5.481 821 HD3 PRO 111 1HD PRO 111 1.944 3.770 4.048 822 H PHE 112 H PHE 112 -0.590 -1.435 4.969 823 HA PHE 112 HA PHE 112 -2.422 -0.438 7.015 824 HB2 PHE 112 2HB PHE 112 -4.439 -1.139 5.980 825 HB3 PHE 112 1HB PHE 112 -3.594 -0.193 4.774 826 HD1 PHE 112 HD1 PHE 112 -2.484 -1.405 2.806 827 HD2 PHE 112 HD2 PHE 112 -5.063 -3.410 5.577 828 HE1 PHE 112 HE1 PHE 112 -2.828 -3.239 1.204 829 HE2 PHE 112 HE2 PHE 112 -5.395 -5.218 3.957 830 HZ PHE 112 HZ PHE 112 -4.284 -5.134 1.774 831 H ARG 113 H ARG 113 -3.028 -1.976 8.469 832 HA ARG 113 HA ARG 113 -1.968 -4.721 8.104 833 HB2 ARG 113 2HB ARG 113 -0.495 -3.417 9.612 834 HB3 ARG 113 1HB ARG 113 -1.873 -3.003 10.629 835 HG2 ARG 113 2HG ARG 113 -2.168 -5.379 11.213 836 HG3 ARG 113 1HG ARG 113 -0.811 -5.810 10.168 837 HD2 ARG 113 2HD ARG 113 0.677 -4.395 11.604 838 HD3 ARG 113 1HD ARG 113 -0.697 -4.113 12.683 839 HE ARG 113 HE ARG 113 -0.753 -6.626 12.926 840 HH11 ARG 113 1HH1 ARG 113 2.245 -4.927 12.268 841 HH12 ARG 113 2HH1 ARG 113 3.237 -6.145 13.008 842 HH21 ARG 113 1HH2 ARG 113 0.540 -8.219 13.870 843 HH22 ARG 113 2HH2 ARG 113 2.266 -8.023 13.921 844 H ASP 114 H ASP 114 -3.680 -6.071 8.055 845 HA ASP 114 HA ASP 114 -6.115 -5.418 9.593 846 HB2 ASP 114 2HB ASP 114 -7.495 -6.136 7.746 847 HB3 ASP 114 1HB ASP 114 -6.358 -4.956 7.102 848 H LYS 115 H LYS 115 -7.384 -7.928 8.823 849 HA LYS 115 HA LYS 115 -6.082 -9.535 10.859 850 HB2 LYS 115 2HB LYS 115 -8.676 -10.119 9.413 851 HB3 LYS 115 1HB LYS 115 -8.103 -10.845 10.919 852 HG2 LYS 115 2HG LYS 115 -8.120 -8.367 11.819 853 HG3 LYS 115 1HG LYS 115 -9.170 -8.061 10.443 854 HD2 LYS 115 2HD LYS 115 -10.786 -8.544 12.014 855 HD3 LYS 115 1HD LYS 115 -10.491 -10.179 11.428 856 HE2 LYS 115 2HE LYS 115 -9.305 -8.925 13.926 857 HE3 LYS 115 1HE LYS 115 -10.591 -10.128 13.873 858 HZ1 LYS 115 3HZ LYS 115 -7.776 -10.540 13.022 859 HZ2 LYS 115 1HZ LYS 115 -9.006 -11.691 12.902 860 HZ3 LYS 115 2HZ LYS 115 -8.505 -11.151 14.418 861 H THR 116 H THR 116 -5.608 -9.412 7.555 862 HA THR 116 HA THR 116 -5.159 -12.155 6.944 863 HB THR 116 HB THR 116 -3.468 -11.317 5.259 864 HG1 THR 116 HG1 THR 116 -4.149 -8.670 5.611 865 HG21 THR 116 3HG2 THR 116 -5.071 -10.037 3.849 866 HG22 THR 116 1HG2 THR 116 -6.152 -9.888 5.239 867 HG23 THR 116 2HG2 THR 116 -5.805 -11.476 4.552 868 H THR 117 H THR 117 -3.491 -9.909 8.983 869 HA THR 117 HA THR 117 -0.937 -11.126 9.140 870 HB THR 117 HB THR 117 -2.388 -9.485 11.275 871 HG1 THR 117 HG1 THR 117 -2.300 -8.103 9.623 872 HG21 THR 117 3HG2 THR 117 -0.346 -10.615 12.119 873 HG22 THR 117 1HG2 THR 117 -0.120 -8.865 12.031 874 HG23 THR 117 2HG2 THR 117 0.586 -9.909 10.795 875 H GLY 118 H GLY 118 -0.705 -13.212 9.702 876 HA2 GLY 118 2HA GLY 118 -0.584 -14.970 11.282 877 HA3 GLY 118 1HA GLY 118 -1.999 -14.335 12.110 878 H GLN 119 H GLN 119 -2.883 -14.149 8.969 879 HA GLN 119 HA GLN 119 -4.140 -16.840 8.942 880 HB2 GLN 119 2HB GLN 119 -5.311 -14.137 8.141 881 HB3 GLN 119 1HB GLN 119 -6.068 -15.670 7.720 882 HG2 GLN 119 2HG GLN 119 -5.511 -14.763 10.560 883 HG3 GLN 119 1HG GLN 119 -7.056 -14.568 9.735 884 HE21 GLN 119 1HE2 GLN 119 -6.397 -16.080 12.167 885 HE22 GLN 119 2HE2 GLN 119 -6.917 -17.700 11.865 886 H GLN 120 H GLN 120 -4.211 -14.317 6.417 887 HA GLN 120 HA GLN 120 -3.368 -16.204 4.364 888 HB2 GLN 120 2HB GLN 120 -4.207 -13.281 4.243 889 HB3 GLN 120 1HB GLN 120 -3.782 -14.236 2.823 890 HG2 GLN 120 2HG GLN 120 -5.655 -15.745 3.224 891 HG3 GLN 120 1HG GLN 120 -6.061 -14.887 4.716 892 HE21 GLN 120 1HE2 GLN 120 -7.060 -12.883 4.586 893 HE22 GLN 120 2HE2 GLN 120 -7.701 -12.247 3.117 894 H SER 121 H SER 121 -1.856 -14.127 6.438 895 HA SER 121 HA SER 121 0.731 -14.459 5.167 896 HB2 SER 121 2HB SER 121 -0.312 -11.708 6.045 897 HB3 SER 121 1HB SER 121 1.355 -12.055 5.582 898 HG SER 121 HG SER 121 0.075 -12.915 3.563 899 H TYR 122 H TYR 122 2.445 -13.851 6.897 900 HA TYR 122 HA TYR 122 1.581 -14.827 9.523 901 HB2 TYR 122 2HB TYR 122 4.266 -14.355 8.187 902 HB3 TYR 122 1HB TYR 122 4.179 -14.543 9.931 903 HD1 TYR 122 HD2 TYR 122 3.437 -16.258 6.714 904 HD2 TYR 122 HD1 TYR 122 4.001 -16.705 10.925 905 HE1 TYR 122 HE2 TYR 122 3.481 -18.687 6.464 906 HE2 TYR 122 HE1 TYR 122 4.049 -19.147 10.664 907 HH TYR 122 HH TYR 122 4.438 -20.643 7.702 908 H ASP 123 H ASP 123 3.670 -13.389 10.972 909 HA ASP 123 HA ASP 123 2.073 -11.114 11.761 910 HB2 ASP 123 2HB ASP 123 3.045 -12.504 13.501 911 HB3 ASP 123 1HB ASP 123 4.668 -12.291 12.842 912 H GLY 124 H GLY 124 2.344 -9.104 11.004 913 HA2 GLY 124 2HA GLY 124 4.547 -7.570 10.663 914 HA3 GLY 124 1HA GLY 124 4.466 -8.452 9.140 915 H GLY 125 H GLY 125 2.041 -8.521 8.274 916 HA2 GLY 125 2HA GLY 125 -0.021 -7.090 8.206 917 HA3 GLY 125 1HA GLY 125 1.059 -5.702 8.235 918 H ARG 126 H ARG 126 -0.162 -5.146 6.259 919 HA ARG 126 HA ARG 126 1.238 -6.170 3.843 920 HB2 ARG 126 2HB ARG 126 -1.624 -5.081 3.928 921 HB3 ARG 126 1HB ARG 126 -0.780 -5.665 2.501 922 HG2 ARG 126 2HG ARG 126 -1.722 -7.337 4.852 923 HG3 ARG 126 1HG ARG 126 -2.441 -7.278 3.242 924 HD2 ARG 126 2HD ARG 126 0.304 -8.353 3.962 925 HD3 ARG 126 1HD ARG 126 -1.109 -9.298 3.485 926 HE ARG 126 HE ARG 126 -0.363 -7.390 1.472 927 HH11 ARG 126 1HH1 ARG 126 0.509 -10.532 2.778 928 HH12 ARG 126 2HH1 ARG 126 1.217 -11.095 1.299 929 HH21 ARG 126 1HH2 ARG 126 0.509 -8.161 -0.498 930 HH22 ARG 126 2HH2 ARG 126 1.219 -9.746 -0.565 931 H TYR 127 H TYR 127 1.102 -4.351 2.031 932 HA TYR 127 HA TYR 127 0.382 -1.708 3.041 933 HB2 TYR 127 2HB TYR 127 2.386 -0.566 2.504 934 HB3 TYR 127 1HB TYR 127 2.928 -2.006 3.347 935 HD1 TYR 127 HD2 TYR 127 3.793 -3.988 1.884 936 HD2 TYR 127 HD1 TYR 127 3.255 -0.036 0.357 937 HE1 TYR 127 HE2 TYR 127 5.331 -4.479 0.036 938 HE2 TYR 127 HE1 TYR 127 4.785 -0.538 -1.491 939 HH TYR 127 HH TYR 127 5.887 -3.734 -2.156 940 H MET 128 H MET 128 0.321 -0.101 1.343 941 HA MET 128 HA MET 128 -0.277 -1.072 -1.375 942 HB2 MET 128 2HB MET 128 -2.040 0.548 0.510 943 HB3 MET 128 1HB MET 128 -2.189 0.766 -1.229 944 HG2 MET 128 2HG MET 128 -2.451 -1.952 0.040 945 HG3 MET 128 1HG MET 128 -3.817 -0.843 -0.080 946 HE1 MET 128 3HE MET 128 -3.331 0.590 -2.916 947 HE2 MET 128 1HE MET 128 -4.857 0.000 -2.239 948 HE3 MET 128 2HE MET 128 -4.367 -0.473 -3.870 949 H GLU 129 H GLU 129 0.277 0.417 -2.978 950 HA GLU 129 HA GLU 129 1.322 3.071 -2.195 951 HB2 GLU 129 2HB GLU 129 3.230 1.547 -2.541 952 HB3 GLU 129 1HB GLU 129 2.608 1.078 -4.120 953 HG2 GLU 129 2HG GLU 129 2.961 3.391 -4.946 954 HG3 GLU 129 1HG GLU 129 3.577 3.861 -3.359 955 H LEU 130 H LEU 130 0.288 4.636 -3.300 956 HA LEU 130 HA LEU 130 -0.771 4.140 -6.002 957 HB2 LEU 130 2HB LEU 130 -2.770 5.779 -5.001 958 HB3 LEU 130 1HB LEU 130 -2.893 4.038 -5.201 959 HG LEU 130 HG LEU 130 -2.167 3.830 -2.739 960 HD11 LEU 130 1HD1 LEU 130 -1.198 6.049 -2.426 961 HD12 LEU 130 2HD1 LEU 130 -2.505 5.767 -1.279 962 HD13 LEU 130 3HD1 LEU 130 -2.775 6.798 -2.689 963 HD21 LEU 130 3HD2 LEU 130 -4.485 3.492 -3.452 964 HD22 LEU 130 1HD2 LEU 130 -4.795 5.226 -3.325 965 HD23 LEU 130 2HD2 LEU 130 -4.423 4.283 -1.879 966 H GLU 131 H GLU 131 -1.014 5.950 -7.305 967 HA GLU 131 HA GLU 131 0.090 8.525 -6.405 968 HB2 GLU 131 2HB GLU 131 0.932 7.118 -8.982 969 HB3 GLU 131 1HB GLU 131 1.345 8.775 -8.548 970 HG2 GLU 131 2HG GLU 131 2.570 7.884 -6.542 971 HG3 GLU 131 1HG GLU 131 2.257 6.252 -7.132 972 HA PRO 132 HA PRO 132 -3.794 9.574 -8.643 973 HB2 PRO 132 2HB PRO 132 -4.041 12.114 -7.664 974 HB3 PRO 132 1HB PRO 132 -4.420 10.685 -6.675 975 HG2 PRO 132 2HG PRO 132 -1.884 12.313 -6.719 976 HG3 PRO 132 1HG PRO 132 -2.838 11.768 -5.319 977 HD2 PRO 132 2HD PRO 132 -0.625 10.440 -6.127 978 HD3 PRO 132 1HD PRO 132 -2.023 9.589 -5.431 979 H ASP 133 H ASP 133 -4.437 11.390 -10.069 980 HA ASP 133 HA ASP 133 -2.435 12.017 -12.057 981 HB2 ASP 133 2HB ASP 133 -4.656 11.308 -12.775 982 HB3 ASP 133 1HB ASP 133 -5.425 12.583 -11.843 983 H ARG 134 H ARG 134 -3.572 13.570 -9.266 984 HA ARG 134 HA ARG 134 -2.217 16.038 -9.793 985 HB2 ARG 134 2HB ARG 134 -4.256 17.509 -9.311 986 HB3 ARG 134 1HB ARG 134 -4.205 16.765 -10.899 987 HG2 ARG 134 2HG ARG 134 -6.475 16.708 -10.097 988 HG3 ARG 134 1HG ARG 134 -5.859 15.059 -10.131 989 HD2 ARG 134 2HD ARG 134 -5.720 14.958 -7.746 990 HD3 ARG 134 1HD ARG 134 -5.854 16.708 -7.590 991 HE ARG 134 HE ARG 134 -8.109 16.523 -7.601 992 HH11 ARG 134 1HH1 ARG 134 -6.891 13.475 -8.902 993 HH12 ARG 134 2HH1 ARG 134 -8.457 12.736 -8.915 994 HH21 ARG 134 1HH2 ARG 134 -10.109 15.524 -7.610 995 HH22 ARG 134 2HH2 ARG 134 -10.282 13.896 -8.184 996 H ASP 135 H ASP 135 -2.743 17.598 -7.783 997 HA ASP 135 HA ASP 135 -1.993 16.083 -5.454 998 HB2 ASP 135 2HB ASP 135 -1.034 18.308 -5.781 999 HB3 ASP 135 1HB ASP 135 -2.638 19.045 -5.784 1000 H LEU 136 H LEU 136 -3.333 15.180 -4.040 1001 HA LEU 136 HA LEU 136 -6.227 15.606 -4.174 1002 HB2 LEU 136 2HB LEU 136 -4.543 13.662 -2.549 1003 HB3 LEU 136 1HB LEU 136 -6.299 13.680 -2.579 1004 HG LEU 136 HG LEU 136 -4.493 13.038 -4.942 1005 HD11 LEU 136 1HD1 LEU 136 -6.234 11.202 -3.268 1006 HD12 LEU 136 2HD1 LEU 136 -4.471 11.270 -3.254 1007 HD13 LEU 136 3HD1 LEU 136 -5.315 10.741 -4.705 1008 HD21 LEU 136 3HD2 LEU 136 -6.554 14.115 -5.706 1009 HD22 LEU 136 1HD2 LEU 136 -7.526 12.981 -4.763 1010 HD23 LEU 136 2HD2 LEU 136 -6.564 12.405 -6.127 1011 H SER 137 H SER 137 -6.453 17.660 -3.253 1012 HA SER 137 HA SER 137 -5.554 18.302 -0.592 1013 HB2 SER 137 2HB SER 137 -7.672 19.666 -2.310 1014 HB3 SER 137 1HB SER 137 -6.866 20.357 -0.895 1015 HG SER 137 HG SER 137 -4.967 19.506 -2.544 1016 H ASP 138 H ASP 138 -7.334 19.081 1.060 1017 HA ASP 138 HA ASP 138 -8.818 16.761 1.831 1018 HB2 ASP 138 2HB ASP 138 -9.469 17.996 3.828 1019 HB3 ASP 138 1HB ASP 138 -7.770 18.279 3.508 1020 H GLY 139 H GLY 139 -10.595 16.178 0.762 1021 HA2 GLY 139 2HA GLY 139 -13.031 16.846 0.480 1022 HA3 GLY 139 1HA GLY 139 -12.408 18.229 -0.417 1023 H ASP 140 H ASP 140 -10.206 16.658 -1.637 1024 HA ASP 140 HA ASP 140 -11.492 15.416 -3.876 1025 HB2 ASP 140 2HB ASP 140 -8.601 15.355 -2.896 1026 HB3 ASP 140 1HB ASP 140 -9.111 14.511 -4.356 1027 H GLU 141 H GLU 141 -11.000 13.085 -4.473 1028 HA GLU 141 HA GLU 141 -11.048 11.256 -2.139 1029 HB2 GLU 141 2HB GLU 141 -12.776 11.147 -4.649 1030 HB3 GLU 141 1HB GLU 141 -12.636 9.829 -3.488 1031 HG2 GLU 141 2HG GLU 141 -13.626 11.187 -1.731 1032 HG3 GLU 141 1HG GLU 141 -13.643 12.601 -2.785 1033 H ILE 142 H ILE 142 -10.682 8.906 -2.991 1034 HA ILE 142 HA ILE 142 -8.762 8.593 -5.126 1035 HB ILE 142 HB ILE 142 -7.314 9.568 -3.381 1036 HG12 ILE 142 2HG1 ILE 142 -5.583 7.748 -3.162 1037 HG13 ILE 142 1HG1 ILE 142 -6.767 6.578 -3.731 1038 HG21 ILE 142 1HG2 ILE 142 -8.608 9.023 -1.391 1039 HG22 ILE 142 2HG2 ILE 142 -6.944 8.472 -1.200 1040 HG23 ILE 142 3HG2 ILE 142 -8.217 7.312 -1.571 1041 HD11 ILE 142 3HD1 ILE 142 -6.838 7.695 -5.907 1042 HD12 ILE 142 1HD1 ILE 142 -5.191 7.232 -5.478 1043 HD13 ILE 142 2HD1 ILE 142 -5.698 8.914 -5.327 1044 H THR 143 H THR 143 -8.276 6.363 -5.482 1045 HA THR 143 HA THR 143 -10.418 4.552 -4.645 1046 HB THR 143 HB THR 143 -8.350 4.225 -6.865 1047 HG1 THR 143 HG1 THR 143 -9.622 5.419 -8.127 1048 HG21 THR 143 3HG2 THR 143 -9.575 2.167 -6.254 1049 HG22 THR 143 1HG2 THR 143 -10.042 2.736 -7.860 1050 HG23 THR 143 2HG2 THR 143 -11.109 3.010 -6.480 1051 H LEU 144 H LEU 144 -10.005 2.813 -3.310 1052 HA LEU 144 HA LEU 144 -7.232 2.146 -2.561 1053 HB2 LEU 144 2HB LEU 144 -9.616 2.805 -0.839 1054 HB3 LEU 144 1HB LEU 144 -8.594 1.498 -0.291 1055 HG LEU 144 HG LEU 144 -7.983 3.599 0.811 1056 HD11 LEU 144 1HD1 LEU 144 -6.213 1.937 0.449 1057 HD12 LEU 144 2HD1 LEU 144 -5.565 3.575 0.415 1058 HD13 LEU 144 3HD1 LEU 144 -5.799 2.689 -1.096 1059 HD21 LEU 144 3HD2 LEU 144 -7.288 4.682 -1.939 1060 HD22 LEU 144 1HD2 LEU 144 -7.032 5.495 -0.393 1061 HD23 LEU 144 2HD2 LEU 144 -8.667 5.175 -0.956 1062 H ASP 145 H ASP 145 -7.078 0.400 -3.850 1063 HA ASP 145 HA ASP 145 -9.081 -1.774 -3.697 1064 HB2 ASP 145 2HB ASP 145 -7.351 -2.533 -5.751 1065 HB3 ASP 145 1HB ASP 145 -8.868 -1.677 -5.965 1066 H PHE 146 H PHE 146 -8.547 -2.857 -1.879 1067 HA PHE 146 HA PHE 146 -5.835 -3.418 -1.063 1068 HB2 PHE 146 2HB PHE 146 -8.360 -4.663 0.083 1069 HB3 PHE 146 1HB PHE 146 -6.807 -4.429 0.888 1070 HD1 PHE 146 HD2 PHE 146 -6.031 -1.752 0.564 1071 HD2 PHE 146 HD1 PHE 146 -10.014 -3.272 0.972 1072 HE1 PHE 146 HE2 PHE 146 -6.788 0.426 1.361 1073 HE2 PHE 146 HE1 PHE 146 -10.756 -1.076 1.777 1074 HZ PHE 146 HZ PHE 146 -9.143 0.772 1.973 1075 H ASN 147 H ASN 147 -7.985 -4.882 -3.161 1076 HA ASN 147 HA ASN 147 -7.031 -7.568 -3.152 1077 HB2 ASN 147 2HB ASN 147 -8.143 -7.651 -5.416 1078 HB3 ASN 147 1HB ASN 147 -9.192 -7.077 -4.125 1079 HD21 ASN 147 1HD2 ASN 147 -9.772 -4.852 -4.083 1080 HD22 ASN 147 2HD2 ASN 147 -9.631 -3.864 -5.492 1081 H LEU 148 H LEU 148 -5.540 -4.681 -3.994 1082 HA LEU 148 HA LEU 148 -3.611 -5.945 -5.844 1083 HB2 LEU 148 2HB LEU 148 -4.207 -2.990 -5.376 1084 HB3 LEU 148 1HB LEU 148 -3.056 -3.633 -6.541 1085 HG LEU 148 HG LEU 148 -6.087 -3.771 -6.637 1086 HD11 LEU 148 1HD1 LEU 148 -5.093 -1.713 -7.489 1087 HD12 LEU 148 2HD1 LEU 148 -5.822 -2.644 -8.794 1088 HD13 LEU 148 3HD1 LEU 148 -4.067 -2.634 -8.593 1089 HD21 LEU 148 3HD2 LEU 148 -4.153 -5.334 -8.382 1090 HD22 LEU 148 1HD2 LEU 148 -5.882 -5.142 -8.696 1091 HD23 LEU 148 2HD2 LEU 148 -5.341 -5.993 -7.255 1092 H ALA 149 H ALA 149 -3.836 -5.782 -2.731 1093 HA ALA 149 HA ALA 149 -1.842 -4.092 -1.724 1094 HB1 ALA 149 3HB ALA 149 -3.601 -5.089 -0.319 1095 HB2 ALA 149 1HB ALA 149 -1.997 -5.403 0.351 1096 HB3 ALA 149 2HB ALA 149 -2.864 -6.681 -0.511 1097 H TYR 150 H TYR 150 0.282 -4.197 -1.648 1098 HA TYR 150 HA TYR 150 1.721 -6.385 -2.936 1099 HB2 TYR 150 2HB TYR 150 2.894 -3.815 -1.795 1100 HB3 TYR 150 1HB TYR 150 3.594 -4.862 -3.027 1101 HD1 TYR 150 HD1 TYR 150 1.837 -5.205 -5.141 1102 HD2 TYR 150 HD2 TYR 150 2.077 -1.768 -2.605 1103 HE1 TYR 150 HE1 TYR 150 0.801 -3.832 -6.883 1104 HE2 TYR 150 HE2 TYR 150 1.053 -0.392 -4.365 1105 HH TYR 150 HH TYR 150 0.704 -0.398 -6.749 1106 H SER 151 H SER 151 3.338 -7.603 -1.936 1107 HA SER 151 HA SER 151 3.132 -8.122 0.835 1108 HB2 SER 151 2HB SER 151 5.118 -9.058 -1.266 1109 HB3 SER 151 1HB SER 151 4.999 -9.725 0.369 1110 HG SER 151 HG SER 151 3.727 -10.989 -0.878 1111 HA PRO 152 HA PRO 152 6.070 -4.914 2.166 1112 HB2 PRO 152 2HB PRO 152 6.061 -5.518 4.850 1113 HB3 PRO 152 1HB PRO 152 4.725 -4.656 4.060 1114 HG2 PRO 152 2HG PRO 152 4.926 -7.573 4.750 1115 HG3 PRO 152 1HG PRO 152 3.562 -6.454 4.983 1116 HD2 PRO 152 2HD PRO 152 3.645 -8.176 2.890 1117 HD3 PRO 152 1HD PRO 152 2.902 -6.567 2.749 1118 H PHE 153 H PHE 153 8.254 -4.938 2.246 1119 HA PHE 153 HA PHE 153 9.846 -7.144 1.782 1120 HB2 PHE 153 2HB PHE 153 10.716 -4.544 3.130 1121 HB3 PHE 153 1HB PHE 153 11.758 -5.667 2.280 1122 HD1 PHE 153 HD1 PHE 153 8.910 -3.277 1.731 1123 HD2 PHE 153 HD2 PHE 153 12.258 -5.308 -0.002 1124 HE1 PHE 153 HE1 PHE 153 8.726 -1.873 -0.284 1125 HE2 PHE 153 HE2 PHE 153 12.056 -3.911 -2.016 1126 HZ PHE 153 HZ PHE 153 10.296 -2.191 -2.158 1127 H CYS 154 H CYS 154 8.921 -5.616 4.818 1128 HA CYS 154 HA CYS 154 10.885 -6.575 6.555 1129 HB2 CYS 154 2HB CYS 154 9.260 -5.858 8.333 1130 HB3 CYS 154 1HB CYS 154 9.567 -4.641 7.097 1131 HG CYS 154 HG CYS 154 7.173 -4.469 6.116 1132 H ALA 155 H ALA 155 7.479 -7.720 6.281 1133 HA ALA 155 HA ALA 155 7.733 -9.844 8.129 1134 HB1 ALA 155 3HB ALA 155 5.755 -9.553 5.838 1135 HB2 ALA 155 1HB ALA 155 5.557 -8.906 7.466 1136 HB3 ALA 155 2HB ALA 155 5.585 -10.653 7.213 1137 H TYR 156 H TYR 156 8.408 -9.605 4.717 1138 HA TYR 156 HA TYR 156 8.497 -12.472 4.276 1139 HB2 TYR 156 2HB TYR 156 8.768 -10.042 2.472 1140 HB3 TYR 156 1HB TYR 156 9.084 -11.673 1.880 1141 HD1 TYR 156 HD1 TYR 156 6.409 -9.945 3.921 1142 HD2 TYR 156 HD2 TYR 156 7.262 -12.718 0.785 1143 HE1 TYR 156 HE1 TYR 156 4.005 -10.323 3.613 1144 HE2 TYR 156 HE2 TYR 156 4.857 -13.090 0.475 1145 HH TYR 156 HH TYR 156 2.776 -12.905 1.904 1146 H SER 157 H SER 157 10.836 -10.115 5.223 1147 HA SER 157 HA SER 157 12.845 -12.239 5.274 1148 HB2 SER 157 2HB SER 157 13.348 -9.611 3.826 1149 HB3 SER 157 1HB SER 157 14.647 -10.673 4.366 1150 HG SER 157 HG SER 157 12.552 -11.551 2.679 1151 H ASP 158 H ASP 158 14.017 -12.189 7.076 1152 HA ASP 158 HA ASP 158 13.183 -10.690 9.316 1153 HB2 ASP 158 2HB ASP 158 15.683 -12.419 9.003 1154 HB3 ASP 158 1HB ASP 158 14.993 -11.888 10.538 1155 H THR 159 H THR 159 15.881 -10.276 7.118 1156 HA THR 159 HA THR 159 17.490 -8.585 8.762 1157 HB THR 159 HB THR 159 18.481 -9.926 6.953 1158 HG1 THR 159 HG1 THR 159 18.951 -7.283 7.318 1159 HG21 THR 159 3HG2 THR 159 18.260 -9.312 4.588 1160 HG22 THR 159 1HG2 THR 159 17.089 -8.059 5.008 1161 HG23 THR 159 2HG2 THR 159 16.690 -9.760 5.260 1162 H PHE 160 H PHE 160 14.577 -7.952 7.183 1163 HA PHE 160 HA PHE 160 15.037 -5.049 6.887 1164 HB2 PHE 160 2HB PHE 160 12.648 -6.800 6.126 1165 HB3 PHE 160 1HB PHE 160 12.709 -5.055 5.910 1166 HD1 PHE 160 HD2 PHE 160 14.633 -8.133 4.965 1167 HD2 PHE 160 HD1 PHE 160 13.350 -4.245 3.810 1168 HE1 PHE 160 HE2 PHE 160 15.621 -8.464 2.743 1169 HE2 PHE 160 HE1 PHE 160 14.335 -4.590 1.594 1170 HZ PHE 160 HZ PHE 160 15.474 -6.690 1.053 1171 H SER 161 H SER 161 14.148 -3.630 8.344 1172 HA SER 161 HA SER 161 12.914 -4.643 10.781 1173 HB2 SER 161 2HB SER 161 13.556 -1.775 9.957 1174 HB3 SER 161 1HB SER 161 13.111 -2.323 11.579 1175 HG SER 161 HG SER 161 15.081 -3.840 11.019 1176 H CYS 162 H CYS 162 10.770 -4.371 11.399 1177 HA CYS 162 HA CYS 162 8.802 -4.029 9.375 1178 HB2 CYS 162 2HB CYS 162 8.560 -5.630 11.252 1179 HB3 CYS 162 1HB CYS 162 8.511 -4.295 12.396 1180 HG CYS 162 HG CYS 162 5.937 -4.853 12.402 1181 HA PRO 163 HA PRO 163 7.911 0.402 9.809 1182 HB2 PRO 163 2HB PRO 163 5.070 -0.294 9.125 1183 HB3 PRO 163 1HB PRO 163 6.208 0.769 8.271 1184 HG2 PRO 163 2HG PRO 163 5.528 -1.609 7.264 1185 HG3 PRO 163 1HG PRO 163 7.177 -0.963 7.093 1186 HD2 PRO 163 2HD PRO 163 6.162 -3.043 9.023 1187 HD3 PRO 163 1HD PRO 163 7.667 -3.023 8.072 1188 H LEU 164 H LEU 164 6.413 1.848 11.001 1189 HA LEU 164 HA LEU 164 5.160 0.611 13.391 1190 HB2 LEU 164 2HB LEU 164 6.507 3.347 13.199 1191 HB3 LEU 164 1HB LEU 164 5.726 2.682 14.627 1192 HG LEU 164 HG LEU 164 8.238 1.539 13.330 1193 HD11 LEU 164 1HD1 LEU 164 9.464 2.421 15.261 1194 HD12 LEU 164 2HD1 LEU 164 7.992 3.193 15.858 1195 HD13 LEU 164 3HD1 LEU 164 8.707 3.713 14.330 1196 HD21 LEU 164 3HD2 LEU 164 8.426 0.142 15.357 1197 HD22 LEU 164 1HD2 LEU 164 6.945 -0.204 14.464 1198 HD23 LEU 164 2HD2 LEU 164 6.878 0.765 15.937 1199 HA PRO 165 HA PRO 165 2.110 2.716 10.657 1200 HB2 PRO 165 2HB PRO 165 0.158 0.852 10.621 1201 HB3 PRO 165 1HB PRO 165 1.699 0.567 9.781 1202 HG2 PRO 165 2HG PRO 165 0.783 -0.492 12.434 1203 HG3 PRO 165 1HG PRO 165 1.655 -1.328 11.129 1204 HD2 PRO 165 2HD PRO 165 2.879 -0.231 13.394 1205 HD3 PRO 165 1HD PRO 165 3.713 -0.592 11.869 1206 HA PRO 166 HA PRO 166 -0.256 4.685 14.017 1207 HB2 PRO 166 2HB PRO 166 -1.967 6.177 12.436 1208 HB3 PRO 166 1HB PRO 166 -0.274 6.640 12.711 1209 HG2 PRO 166 2HG PRO 166 -1.464 5.160 10.376 1210 HG3 PRO 166 1HG PRO 166 -0.325 6.523 10.369 1211 HD2 PRO 166 2HD PRO 166 0.545 4.006 10.018 1212 HD3 PRO 166 1HD PRO 166 1.506 5.172 10.957 1213 H GLU 167 H GLU 167 -1.593 3.305 15.048 1214 HA GLU 167 HA GLU 167 -2.739 1.058 13.936 1215 HB2 GLU 167 2HB GLU 167 -3.348 2.302 16.638 1216 HB3 GLU 167 1HB GLU 167 -3.706 0.637 16.177 1217 HG2 GLU 167 2HG GLU 167 -1.306 0.194 15.834 1218 HG3 GLU 167 1HG GLU 167 -0.927 1.862 16.257 1219 H SER 168 H SER 168 -4.226 4.138 13.924 1220 HA SER 168 HA SER 168 -6.969 3.379 13.731 1221 HB2 SER 168 2HB SER 168 -5.573 5.794 12.498 1222 HB3 SER 168 1HB SER 168 -7.308 5.628 12.796 1223 HG SER 168 HG SER 168 -6.601 6.697 14.535 1224 H ASN 169 H ASN 169 -4.364 2.713 11.664 1225 HA ASN 169 HA ASN 169 -5.910 2.622 9.171 1226 HB2 ASN 169 2HB ASN 169 -3.842 2.310 8.010 1227 HB3 ASN 169 1HB ASN 169 -3.529 3.563 9.200 1228 HD21 ASN 169 1HD2 ASN 169 -1.646 1.805 7.836 1229 HD22 ASN 169 2HD2 ASN 169 -0.785 0.964 9.066 1230 H TRP 170 H TRP 170 -5.604 0.734 11.795 1231 HA TRP 170 HA TRP 170 -5.197 -1.858 10.584 1232 HB2 TRP 170 2HB TRP 170 -6.026 -0.982 13.379 1233 HB3 TRP 170 1HB TRP 170 -6.001 -2.677 12.902 1234 HD1 TRP 170 HD1 TRP 170 -3.096 -0.898 11.358 1235 HE1 TRP 170 HE1 TRP 170 -0.954 -1.409 12.678 1236 HE3 TRP 170 HE3 TRP 170 -5.183 -2.997 15.532 1237 HZ2 TRP 170 HZ2 TRP 170 -0.233 -2.548 15.144 1238 HZ3 TRP 170 HZ3 TRP 170 -3.689 -3.770 17.332 1239 HH2 TRP 170 HH2 TRP 170 -1.262 -3.544 17.140 1240 H LEU 171 H LEU 171 -6.694 -2.834 9.439 1241 HA LEU 171 HA LEU 171 -9.516 -2.029 9.562 1242 HB2 LEU 171 2HB LEU 171 -8.321 -4.116 7.703 1243 HB3 LEU 171 1HB LEU 171 -9.758 -3.137 7.459 1244 HG LEU 171 HG LEU 171 -6.892 -2.089 7.369 1245 HD11 LEU 171 1HD1 LEU 171 -7.172 -1.890 4.959 1246 HD12 LEU 171 2HD1 LEU 171 -8.780 -2.607 5.059 1247 HD13 LEU 171 3HD1 LEU 171 -7.358 -3.564 5.473 1248 HD21 LEU 171 3HD2 LEU 171 -7.855 -0.016 6.471 1249 HD22 LEU 171 1HD2 LEU 171 -8.451 -0.353 8.095 1250 HD23 LEU 171 2HD2 LEU 171 -9.482 -0.662 6.696 1251 H GLU 172 H GLU 172 -10.844 -3.193 10.965 1252 HA GLU 172 HA GLU 172 -9.855 -5.718 12.065 1253 HB2 GLU 172 2HB GLU 172 -10.833 -3.894 13.519 1254 HB3 GLU 172 1HB GLU 172 -12.412 -4.237 12.816 1255 HG2 GLU 172 2HG GLU 172 -12.432 -6.466 13.757 1256 HG3 GLU 172 1HG GLU 172 -10.745 -6.338 14.253 1257 H THR 173 H THR 173 -10.064 -6.357 9.722 1258 HA THR 173 HA THR 173 -12.204 -8.219 9.347 1259 HB THR 173 HB THR 173 -13.251 -6.131 8.447 1260 HG1 THR 173 HG1 THR 173 -14.097 -7.655 7.280 1261 HG21 THR 173 3HG2 THR 173 -11.171 -4.959 7.703 1262 HG22 THR 173 1HG2 THR 173 -12.382 -5.050 6.415 1263 HG23 THR 173 2HG2 THR 173 -10.991 -6.137 6.402 1264 H ALA 174 H ALA 174 -11.689 -9.646 7.535 1265 HA ALA 174 HA ALA 174 -8.778 -9.839 7.060 1266 HB1 ALA 174 3HB ALA 174 -9.228 -12.195 6.481 1267 HB2 ALA 174 1HB ALA 174 -10.955 -11.934 6.744 1268 HB3 ALA 174 2HB ALA 174 -9.826 -11.806 8.095 1269 H VAL 175 H VAL 175 -8.560 -8.401 5.392 1270 HA VAL 175 HA VAL 175 -9.966 -8.213 3.008 1271 HB VAL 175 HB VAL 175 -6.980 -7.784 3.473 1272 HG11 VAL 175 1HG1 VAL 175 -8.622 -6.937 1.049 1273 HG12 VAL 175 2HG1 VAL 175 -7.338 -8.148 1.061 1274 HG13 VAL 175 3HG1 VAL 175 -6.953 -6.455 1.375 1275 HG21 VAL 175 3HG2 VAL 175 -9.296 -5.804 3.344 1276 HG22 VAL 175 1HG2 VAL 175 -7.594 -5.373 3.556 1277 HG23 VAL 175 2HG2 VAL 175 -8.432 -6.299 4.802 1278 H THR 176 H THR 176 -10.663 -10.235 2.378 1279 HA THR 176 HA THR 176 -8.748 -12.225 1.375 1280 HB THR 176 HB THR 176 -10.888 -13.658 1.243 1281 HG1 THR 176 HG1 THR 176 -11.933 -11.430 2.711 1282 HG21 THR 176 3HG2 THR 176 -10.151 -12.576 3.993 1283 HG22 THR 176 1HG2 THR 176 -9.338 -13.903 3.152 1284 HG23 THR 176 2HG2 THR 176 -11.012 -14.083 3.674 1285 H ALA 177 H ALA 177 -8.194 -11.747 -0.680 1286 HA ALA 177 HA ALA 177 -10.294 -11.322 -2.709 1287 HB1 ALA 177 3HB ALA 177 -9.512 -9.071 -2.060 1288 HB2 ALA 177 1HB ALA 177 -9.025 -9.459 -3.712 1289 HB3 ALA 177 2HB ALA 177 -7.844 -9.538 -2.400 1290 H GLY 178 H GLY 178 -9.917 -12.578 -4.424 1291 HA2 GLY 178 2HA GLY 178 -9.058 -14.345 -5.620 1292 HA3 GLY 178 1HA GLY 178 -7.638 -13.317 -5.697 1293 H GLU 179 H GLU 179 -6.235 -15.029 -5.704 1294 HA GLU 179 HA GLU 179 -5.979 -16.908 -3.527 1295 HB2 GLU 179 2HB GLU 179 -4.132 -16.228 -5.856 1296 HB3 GLU 179 1HB GLU 179 -3.854 -17.541 -4.708 1297 HG2 GLU 179 2HG GLU 179 -5.878 -18.682 -5.446 1298 HG3 GLU 179 1HG GLU 179 -6.295 -17.332 -6.503 1299 H ARG 180 H ARG 180 -3.897 -17.023 -2.333 1300 HA ARG 180 HA ARG 180 -2.806 -14.402 -1.541 1301 HB2 ARG 180 2HB ARG 180 -3.190 -15.068 0.899 1302 HB3 ARG 180 1HB ARG 180 -4.634 -14.656 -0.005 1303 HG2 ARG 180 2HG ARG 180 -5.343 -16.527 1.190 1304 HG3 ARG 180 1HG ARG 180 -4.892 -17.244 -0.354 1305 HD2 ARG 180 2HD ARG 180 -2.614 -17.766 0.742 1306 HD3 ARG 180 1HD ARG 180 -3.374 -17.339 2.273 1307 HE ARG 180 HE ARG 180 -5.002 -19.163 1.809 1308 HH11 ARG 180 1HH1 ARG 180 -1.866 -19.283 0.222 1309 HH12 ARG 180 2HH1 ARG 180 -1.891 -21.010 0.047 1310 HH21 ARG 180 1HH2 ARG 180 -4.994 -21.426 1.576 1311 HH22 ARG 180 2HH2 ARG 180 -3.654 -22.213 0.808 1312 H THR 181 H THR 181 -0.527 -14.548 -1.068 1313 HA THR 181 HA THR 181 1.205 -16.463 -1.082 1314 HB THR 181 HB THR 181 2.342 -15.487 0.984 1315 HG1 THR 181 HG1 THR 181 0.232 -14.929 1.988 1316 HG21 THR 181 3HG2 THR 181 1.289 -13.491 -1.046 1317 HG22 THR 181 1HG2 THR 181 2.714 -14.515 -1.239 1318 HG23 THR 181 2HG2 THR 181 2.693 -13.261 -0.000 1319 H ASP 182 H ASP 182 1.477 -18.502 -0.364 1320 HA ASP 182 HA ASP 182 -0.329 -19.642 1.573 1321 HB2 ASP 182 2HB ASP 182 0.451 -20.858 -0.501 1322 HB3 ASP 182 1HB ASP 182 2.064 -20.951 0.202 1323 H LEU 183 H LEU 183 0.277 -20.684 3.500 1324 HA LEU 183 HA LEU 183 1.997 -19.145 5.147 1325 HB2 LEU 183 2HB LEU 183 1.301 -20.518 6.983 1326 HB3 LEU 183 1HB LEU 183 -0.097 -20.219 5.970 1327 HG LEU 183 HG LEU 183 1.466 -22.838 5.899 1328 HD11 LEU 183 1HD1 LEU 183 -1.038 -22.240 7.491 1329 HD12 LEU 183 2HD1 LEU 183 0.579 -22.523 8.142 1330 HD13 LEU 183 3HD1 LEU 183 -0.263 -23.819 7.304 1331 HD21 LEU 183 3HD2 LEU 183 0.115 -22.450 3.887 1332 HD22 LEU 183 1HD2 LEU 183 -1.321 -22.183 4.880 1333 HD23 LEU 183 2HD2 LEU 183 -0.549 -23.773 4.841 1334 H GLU 184 H GLU 184 2.382 -22.364 3.673 1335 HA GLU 184 HA GLU 184 4.748 -23.025 5.213 1336 HB2 GLU 184 2HB GLU 184 3.550 -24.408 2.775 1337 HB3 GLU 184 1HB GLU 184 4.820 -25.063 3.811 1338 HG2 GLU 184 2HG GLU 184 3.210 -24.963 5.730 1339 HG3 GLU 184 1HG GLU 184 1.952 -24.483 4.592 1340 H HIS 185 H HIS 185 6.534 -21.871 4.827 1341 HA HIS 185 HA HIS 185 7.859 -21.888 2.274 1342 HB2 HIS 185 2HB HIS 185 7.978 -19.347 2.076 1343 HB3 HIS 185 1HB HIS 185 6.411 -20.050 1.721 1344 HD1 HIS 185 HD1 HIS 185 4.716 -18.398 2.435 1345 HD2 HIS 185 HD2 HIS 185 7.786 -18.665 5.215 1346 HE1 HIS 185 HE1 HIS 185 4.077 -16.861 4.311 1347 HE2 HIS 185 HE2 HIS 185 6.052 -16.883 5.845 Start of MODEL 11 1 H1 MET 1 1H MET 1 -19.031 4.134 -18.447 2 H2 MET 1 2H MET 1 -19.598 2.923 -17.415 3 H3 MET 1 3H MET 1 -20.655 3.663 -18.509 4 HA MET 1 HA MET 1 -20.042 1.478 -19.276 5 HB2 MET 1 2HB MET 1 -18.746 3.706 -20.919 6 HB3 MET 1 1HB MET 1 -19.186 2.117 -21.537 7 HG2 MET 1 2HG MET 1 -21.546 2.586 -21.118 8 HG3 MET 1 1HG MET 1 -21.125 4.158 -20.436 9 HE1 MET 1 3HE MET 1 -22.859 5.394 -22.097 10 HE2 MET 1 1HE MET 1 -23.318 3.813 -22.739 11 HE3 MET 1 2HE MET 1 -22.872 5.117 -23.839 12 H ASP 2 H ASP 2 -18.226 0.205 -20.344 13 HA ASP 2 HA ASP 2 -16.227 -0.299 -18.399 14 HB2 ASP 2 2HB ASP 2 -16.674 -1.387 -21.202 15 HB3 ASP 2 1HB ASP 2 -15.279 -1.888 -20.250 16 H GLU 3 H GLU 3 -16.176 1.758 -21.183 17 HA GLU 3 HA GLU 3 -13.451 1.814 -21.850 18 HB2 GLU 3 2HB GLU 3 -15.391 4.155 -22.005 19 HB3 GLU 3 1HB GLU 3 -13.895 3.985 -22.921 20 HG2 GLU 3 2HG GLU 3 -14.809 2.107 -24.155 21 HG3 GLU 3 1HG GLU 3 -16.268 2.119 -23.165 22 H ASP 4 H ASP 4 -15.205 3.531 -19.328 23 HA ASP 4 HA ASP 4 -12.916 5.101 -18.458 24 HB2 ASP 4 2HB ASP 4 -15.239 5.983 -18.282 25 HB3 ASP 4 1HB ASP 4 -15.650 4.697 -17.150 26 H THR 5 H THR 5 -14.624 2.162 -17.478 27 HA THR 5 HA THR 5 -13.387 1.802 -14.942 28 HB THR 5 HB THR 5 -14.779 -0.301 -16.660 29 HG1 THR 5 HG1 THR 5 -15.872 1.650 -14.875 30 HG21 THR 5 3HG2 THR 5 -14.525 -0.087 -13.620 31 HG22 THR 5 1HG2 THR 5 -13.663 -1.239 -14.641 32 HG23 THR 5 2HG2 THR 5 -15.418 -1.333 -14.498 33 H GLU 6 H GLU 6 -12.472 0.835 -18.196 34 HA GLU 6 HA GLU 6 -10.563 -1.201 -17.407 35 HB2 GLU 6 2HB GLU 6 -10.012 -1.329 -19.807 36 HB3 GLU 6 1HB GLU 6 -11.753 -1.383 -19.559 37 HG2 GLU 6 2HG GLU 6 -11.843 1.070 -20.128 38 HG3 GLU 6 1HG GLU 6 -10.126 0.983 -20.513 39 H ASP 7 H ASP 7 -10.496 2.148 -17.316 40 HA ASP 7 HA ASP 7 -7.739 2.654 -17.919 41 HB2 ASP 7 2HB ASP 7 -9.468 4.451 -17.867 42 HB3 ASP 7 1HB ASP 7 -9.634 4.226 -16.129 43 H TRP 8 H TRP 8 -9.528 1.827 -14.956 44 HA TRP 8 HA TRP 8 -7.422 1.531 -13.157 45 HB2 TRP 8 2HB TRP 8 -9.626 1.207 -12.309 46 HB3 TRP 8 1HB TRP 8 -10.000 -0.031 -13.498 47 HD1 TRP 8 HD1 TRP 8 -7.442 0.306 -10.525 48 HE1 TRP 8 HE1 TRP 8 -7.388 -1.940 -9.289 49 HE3 TRP 8 HE3 TRP 8 -10.669 -2.355 -13.492 50 HZ2 TRP 8 HZ2 TRP 8 -8.542 -4.501 -9.519 51 HZ3 TRP 8 HZ3 TRP 8 -11.140 -4.702 -12.909 52 HH2 TRP 8 HH2 TRP 8 -10.096 -5.756 -10.961 53 H GLU 9 H GLU 9 -8.542 -0.747 -15.666 54 HA GLU 9 HA GLU 9 -6.676 -2.815 -15.045 55 HB2 GLU 9 2HB GLU 9 -8.859 -3.099 -16.264 56 HB3 GLU 9 1HB GLU 9 -8.153 -2.313 -17.664 57 HG2 GLU 9 2HG GLU 9 -6.889 -4.803 -16.519 58 HG3 GLU 9 1HG GLU 9 -8.308 -4.932 -17.546 59 H THR 10 H THR 10 -6.533 0.062 -17.042 60 HA THR 10 HA THR 10 -4.207 -0.522 -18.574 61 HB THR 10 HB THR 10 -5.374 2.204 -17.818 62 HG1 THR 10 HG1 THR 10 -6.378 0.241 -19.341 63 HG21 THR 10 3HG2 THR 10 -3.578 1.425 -20.156 64 HG22 THR 10 1HG2 THR 10 -3.113 2.433 -18.788 65 HG23 THR 10 2HG2 THR 10 -4.335 3.005 -19.928 66 H GLN 11 H GLN 11 -4.655 1.526 -15.615 67 HA GLN 11 HA GLN 11 -1.889 1.839 -15.093 68 HB2 GLN 11 2HB GLN 11 -2.531 2.716 -12.899 69 HB3 GLN 11 1HB GLN 11 -3.578 3.367 -14.154 70 HG2 GLN 11 2HG GLN 11 -5.343 1.745 -13.510 71 HG3 GLN 11 1HG GLN 11 -4.294 1.128 -12.238 72 HE21 GLN 11 1HE2 GLN 11 -5.863 1.630 -10.658 73 HE22 GLN 11 2HE2 GLN 11 -6.145 3.257 -10.150 74 H LEU 12 H LEU 12 -4.108 -0.773 -14.337 75 HA LEU 12 HA LEU 12 -2.720 -2.026 -12.211 76 HB2 LEU 12 2HB LEU 12 -4.994 -2.642 -12.543 77 HB3 LEU 12 1HB LEU 12 -4.750 -2.965 -14.248 78 HG LEU 12 HG LEU 12 -3.502 -5.032 -13.694 79 HD11 LEU 12 1HD1 LEU 12 -4.130 -4.407 -10.797 80 HD12 LEU 12 2HD1 LEU 12 -2.535 -4.465 -11.551 81 HD13 LEU 12 3HD1 LEU 12 -3.486 -5.939 -11.398 82 HD21 LEU 12 3HD2 LEU 12 -5.425 -6.371 -12.901 83 HD22 LEU 12 1HD2 LEU 12 -5.893 -5.199 -14.132 84 HD23 LEU 12 2HD2 LEU 12 -6.264 -4.889 -12.434 85 H GLN 13 H GLN 13 -2.775 -2.804 -15.706 86 HA GLN 13 HA GLN 13 -0.871 -4.871 -15.640 87 HB2 GLN 13 2HB GLN 13 -0.719 -4.585 -18.096 88 HB3 GLN 13 1HB GLN 13 -2.389 -4.576 -17.544 89 HG2 GLN 13 2HG GLN 13 -2.411 -2.108 -17.693 90 HG3 GLN 13 1HG GLN 13 -0.755 -2.138 -18.287 91 HE21 GLN 13 1HE2 GLN 13 -4.085 -2.826 -19.049 92 HE22 GLN 13 2HE2 GLN 13 -3.864 -2.955 -20.760 93 H ALA 14 H ALA 14 -0.482 -1.382 -15.778 94 HA ALA 14 HA ALA 14 2.322 -1.338 -16.416 95 HB1 ALA 14 3HB ALA 14 0.840 0.558 -16.931 96 HB2 ALA 14 1HB ALA 14 2.176 1.066 -15.891 97 HB3 ALA 14 2HB ALA 14 0.562 0.828 -15.211 98 H ASN 15 H ASN 15 0.453 -0.994 -13.368 99 HA ASN 15 HA ASN 15 2.379 -0.645 -11.434 100 HB2 ASN 15 2HB ASN 15 -0.109 -2.409 -11.302 101 HB3 ASN 15 1HB ASN 15 0.901 -2.110 -9.895 102 HD21 ASN 15 1HD2 ASN 15 -1.946 -1.468 -10.476 103 HD22 ASN 15 2HD2 ASN 15 -2.094 0.229 -10.197 104 H ARG 16 H ARG 16 1.215 -3.778 -12.646 105 HA ARG 16 HA ARG 16 3.098 -5.325 -11.132 106 HB2 ARG 16 2HB ARG 16 2.197 -7.283 -12.354 107 HB3 ARG 16 1HB ARG 16 0.919 -6.286 -11.669 108 HG2 ARG 16 2HG ARG 16 0.358 -5.372 -13.825 109 HG3 ARG 16 1HG ARG 16 1.784 -6.099 -14.566 110 HD2 ARG 16 2HD ARG 16 -0.253 -7.334 -15.144 111 HD3 ARG 16 1HD ARG 16 0.863 -8.334 -14.215 112 HE ARG 16 HE ARG 16 -0.719 -7.463 -12.274 113 HH11 ARG 16 1HH1 ARG 16 -1.607 -8.736 -15.431 114 HH12 ARG 16 2HH1 ARG 16 -3.117 -9.385 -14.868 115 HH21 ARG 16 1HH2 ARG 16 -2.661 -8.360 -11.546 116 HH22 ARG 16 2HH2 ARG 16 -3.716 -9.171 -12.662 117 H ASP 17 H ASP 17 2.987 -4.122 -14.464 118 HA ASP 17 HA ASP 17 4.927 -5.643 -15.722 119 HB2 ASP 17 2HB ASP 17 3.554 -4.057 -16.961 120 HB3 ASP 17 1HB ASP 17 4.265 -2.693 -16.106 121 H GLU 18 H GLU 18 5.398 -2.641 -13.866 122 HA GLU 18 HA GLU 18 8.298 -2.813 -14.112 123 HB2 GLU 18 2HB GLU 18 8.325 -0.632 -12.935 124 HB3 GLU 18 1HB GLU 18 7.301 -0.620 -14.361 125 HG2 GLU 18 2HG GLU 18 5.293 -0.732 -12.973 126 HG3 GLU 18 1HG GLU 18 6.280 -0.881 -11.518 127 H LYS 19 H LYS 19 5.853 -3.231 -11.516 128 HA LYS 19 HA LYS 19 7.855 -3.114 -9.423 129 HB2 LYS 19 2HB LYS 19 5.499 -2.252 -9.146 130 HB3 LYS 19 1HB LYS 19 4.942 -3.920 -9.091 131 HG2 LYS 19 2HG LYS 19 6.342 -4.305 -7.072 132 HG3 LYS 19 1HG LYS 19 6.882 -2.628 -7.134 133 HD2 LYS 19 2HD LYS 19 4.028 -3.581 -6.671 134 HD3 LYS 19 1HD LYS 19 5.111 -2.910 -5.449 135 HE2 LYS 19 2HE LYS 19 4.005 -1.444 -7.869 136 HE3 LYS 19 1HE LYS 19 3.497 -1.219 -6.196 137 HZ1 LYS 19 3HZ LYS 19 6.217 -0.656 -7.253 138 HZ2 LYS 19 1HZ LYS 19 5.685 -0.386 -5.665 139 HZ3 LYS 19 2HZ LYS 19 5.026 0.504 -6.945 140 H ASP 20 H ASP 20 5.983 -5.681 -10.963 141 HA ASP 20 HA ASP 20 6.785 -7.813 -9.232 142 HB2 ASP 20 2HB ASP 20 4.747 -8.023 -10.528 143 HB3 ASP 20 1HB ASP 20 5.607 -7.799 -12.041 144 H ARG 21 H ARG 21 8.443 -6.139 -11.757 145 HA ARG 21 HA ARG 21 10.578 -8.191 -11.735 146 HB2 ARG 21 2HB ARG 21 11.420 -7.417 -13.764 147 HB3 ARG 21 1HB ARG 21 9.683 -7.310 -13.990 148 HG2 ARG 21 2HG ARG 21 9.697 -4.935 -13.880 149 HG3 ARG 21 1HG ARG 21 11.313 -4.894 -13.171 150 HD2 ARG 21 2HD ARG 21 12.197 -5.874 -15.327 151 HD3 ARG 21 1HD ARG 21 10.588 -5.649 -16.016 152 HE ARG 21 HE ARG 21 10.882 -3.227 -15.539 153 HH11 ARG 21 1HH1 ARG 21 13.759 -5.223 -15.945 154 HH12 ARG 21 2HH1 ARG 21 14.743 -3.893 -16.460 155 HH21 ARG 21 1HH2 ARG 21 12.176 -1.519 -16.236 156 HH22 ARG 21 2HH2 ARG 21 13.846 -1.786 -16.628 157 H PHE 22 H PHE 22 9.762 -5.059 -10.565 158 HA PHE 22 HA PHE 22 12.145 -3.674 -10.249 159 HB2 PHE 22 2HB PHE 22 9.857 -2.819 -9.687 160 HB3 PHE 22 1HB PHE 22 9.813 -3.847 -8.270 161 HD1 PHE 22 HD2 PHE 22 11.272 -3.301 -6.294 162 HD2 PHE 22 HD1 PHE 22 10.974 -0.679 -9.658 163 HE1 PHE 22 HE2 PHE 22 12.175 -1.456 -4.947 164 HE2 PHE 22 HE1 PHE 22 11.873 1.160 -8.297 165 HZ PHE 22 HZ PHE 22 12.475 0.772 -5.942 166 H PHE 23 H PHE 23 10.748 -6.161 -8.138 167 HA PHE 23 HA PHE 23 12.820 -6.092 -6.148 168 HB2 PHE 23 2HB PHE 23 10.575 -8.057 -6.706 169 HB3 PHE 23 1HB PHE 23 11.700 -8.255 -5.370 170 HD1 PHE 23 HD2 PHE 23 10.062 -5.047 -6.528 171 HD2 PHE 23 HD1 PHE 23 10.287 -8.066 -3.509 172 HE1 PHE 23 HE2 PHE 23 8.551 -3.740 -5.082 173 HE2 PHE 23 HE1 PHE 23 8.785 -6.756 -2.083 174 HZ PHE 23 HZ PHE 23 7.925 -4.605 -2.855 175 H SER 24 H SER 24 12.841 -7.426 -9.257 176 HA SER 24 HA SER 24 14.936 -9.404 -8.539 177 HB2 SER 24 2HB SER 24 12.953 -9.525 -10.844 178 HB3 SER 24 1HB SER 24 14.227 -10.711 -10.525 179 HG SER 24 HG SER 24 12.103 -11.253 -9.673 180 H GLU 25 H GLU 25 14.406 -6.468 -10.189 181 HA GLU 25 HA GLU 25 16.700 -6.880 -12.026 182 HB2 GLU 25 2HB GLU 25 14.095 -5.350 -12.499 183 HB3 GLU 25 1HB GLU 25 15.502 -5.171 -13.540 184 HG2 GLU 25 2HG GLU 25 14.141 -7.834 -13.046 185 HG3 GLU 25 1HG GLU 25 13.679 -6.750 -14.356 186 H HIS 26 H HIS 26 14.750 -4.365 -10.430 187 HA HIS 26 HA HIS 26 16.804 -2.347 -10.650 188 HB2 HIS 26 2HB HIS 26 14.411 -1.746 -10.820 189 HB3 HIS 26 1HB HIS 26 14.121 -2.335 -9.185 190 HD2 HIS 26 HD2 HIS 26 15.657 0.737 -11.009 191 HE1 HIS 26 HE1 HIS 26 15.573 1.535 -6.858 192 HE2 HIS 26 HE2 HIS 26 15.802 2.561 -9.162 193 H ARG 27 H ARG 27 15.329 -4.219 -8.106 194 HA ARG 27 HA ARG 27 17.395 -3.516 -6.124 195 HB2 ARG 27 2HB ARG 27 14.391 -3.292 -5.942 196 HB3 ARG 27 1HB ARG 27 15.233 -3.839 -4.502 197 HG2 ARG 27 2HG ARG 27 15.902 -1.257 -5.948 198 HG3 ARG 27 1HG ARG 27 14.770 -1.366 -4.596 199 HD2 ARG 27 2HD ARG 27 17.731 -2.048 -4.548 200 HD3 ARG 27 1HD ARG 27 16.945 -0.679 -3.753 201 HE ARG 27 HE ARG 27 15.636 -2.716 -2.640 202 HH11 ARG 27 1HH1 ARG 27 19.095 -2.257 -3.041 203 HH12 ARG 27 2HH1 ARG 27 19.494 -3.184 -1.629 204 HH21 ARG 27 1HH2 ARG 27 16.180 -3.932 -0.810 205 HH22 ARG 27 2HH2 ARG 27 17.846 -4.140 -0.360 206 H GLN 28 H GLN 28 17.811 -5.153 -4.580 207 HA GLN 28 HA GLN 28 17.607 -7.845 -5.461 208 HB2 GLN 28 2HB GLN 28 18.655 -8.422 -3.295 209 HB3 GLN 28 1HB GLN 28 19.473 -7.066 -4.064 210 HG2 GLN 28 2HG GLN 28 18.157 -5.525 -2.565 211 HG3 GLN 28 1HG GLN 28 17.569 -6.951 -1.713 212 HE21 GLN 28 1HE2 GLN 28 20.336 -4.931 -2.356 213 HE22 GLN 28 2HE2 GLN 28 21.337 -5.550 -1.093 214 H SER 29 H SER 29 16.223 -9.430 -4.928 215 HA SER 29 HA SER 29 13.646 -8.970 -3.977 216 HB2 SER 29 2HB SER 29 13.508 -11.524 -3.898 217 HB3 SER 29 1HB SER 29 14.022 -10.832 -5.432 218 HG SER 29 HG SER 29 15.762 -11.959 -5.256 219 HA PRO 30 HA PRO 30 14.173 -9.432 0.571 220 HB2 PRO 30 2HB PRO 30 11.564 -8.876 1.176 221 HB3 PRO 30 1HB PRO 30 12.717 -7.578 0.806 222 HG2 PRO 30 2HG PRO 30 10.706 -8.859 -1.013 223 HG3 PRO 30 1HG PRO 30 11.056 -7.133 -0.754 224 HD2 PRO 30 2HD PRO 30 12.088 -8.457 -2.867 225 HD3 PRO 30 1HD PRO 30 13.008 -7.188 -2.029 226 H ILE 31 H ILE 31 11.843 -10.726 -1.720 227 HA ILE 31 HA ILE 31 10.764 -12.869 -0.304 228 HB ILE 31 HB ILE 31 11.425 -13.064 -3.280 229 HG12 ILE 31 2HG1 ILE 31 10.484 -10.796 -2.946 230 HG13 ILE 31 1HG1 ILE 31 9.384 -11.814 -3.858 231 HG21 ILE 31 1HG2 ILE 31 10.414 -15.051 -2.237 232 HG22 ILE 31 2HG2 ILE 31 9.314 -14.336 -3.415 233 HG23 ILE 31 3HG2 ILE 31 9.043 -14.087 -1.686 234 HD11 ILE 31 3HD1 ILE 31 9.120 -11.010 -0.964 235 HD12 ILE 31 1HD1 ILE 31 8.029 -12.111 -1.810 236 HD13 ILE 31 2HD1 ILE 31 8.163 -10.432 -2.328 237 HA PRO 32 HA PRO 32 14.689 -15.106 0.394 238 HB2 PRO 32 2HB PRO 32 13.478 -17.509 1.280 239 HB3 PRO 32 1HB PRO 32 13.894 -16.128 2.313 240 HG2 PRO 32 2HG PRO 32 11.267 -16.847 1.088 241 HG3 PRO 32 1HG PRO 32 11.621 -16.179 2.697 242 HD2 PRO 32 2HD PRO 32 10.655 -14.606 0.752 243 HD3 PRO 32 1HD PRO 32 11.877 -13.999 1.890 244 HA PRO 33 HA PRO 33 15.224 -17.223 -3.603 245 HB2 PRO 33 2HB PRO 33 17.357 -18.657 -1.995 246 HB3 PRO 33 1HB PRO 33 17.481 -17.885 -3.594 247 HG2 PRO 33 2HG PRO 33 18.453 -16.708 -1.418 248 HG3 PRO 33 1HG PRO 33 17.685 -15.754 -2.712 249 HD2 PRO 33 2HD PRO 33 16.652 -16.458 0.003 250 HD3 PRO 33 1HD PRO 33 16.333 -15.020 -0.990 251 H GLU 34 H GLU 34 14.992 -18.844 -0.522 252 HA GLU 34 HA GLU 34 14.675 -21.516 -1.357 253 HB2 GLU 34 2HB GLU 34 13.469 -20.351 1.184 254 HB3 GLU 34 1HB GLU 34 14.060 -21.987 0.917 255 HG2 GLU 34 2HG GLU 34 15.701 -19.456 1.225 256 HG3 GLU 34 1HG GLU 34 15.619 -20.823 2.335 257 H GLU 35 H GLU 35 12.222 -19.052 -0.428 258 HA GLU 35 HA GLU 35 10.018 -20.834 -0.983 259 HB2 GLU 35 2HB GLU 35 9.977 -17.878 -0.261 260 HB3 GLU 35 1HB GLU 35 8.568 -18.933 -0.366 261 HG2 GLU 35 2HG GLU 35 9.662 -20.365 1.419 262 HG3 GLU 35 1HG GLU 35 10.816 -19.048 1.642 263 H ARG 36 H ARG 36 11.629 -18.174 -2.754 264 HA ARG 36 HA ARG 36 9.442 -17.624 -4.502 265 HB2 ARG 36 2HB ARG 36 10.947 -16.184 -5.709 266 HB3 ARG 36 1HB ARG 36 11.334 -16.025 -4.002 267 HG2 ARG 36 2HG ARG 36 13.292 -17.472 -4.288 268 HG3 ARG 36 1HG ARG 36 12.896 -17.695 -5.994 269 HD2 ARG 36 2HD ARG 36 13.688 -15.092 -4.639 270 HD3 ARG 36 1HD ARG 36 14.670 -16.035 -5.764 271 HE ARG 36 HE ARG 36 12.191 -15.253 -6.954 272 HH11 ARG 36 1HH1 ARG 36 15.379 -13.949 -6.159 273 HH12 ARG 36 2HH1 ARG 36 15.308 -12.732 -7.396 274 HH21 ARG 36 1HH2 ARG 36 12.115 -13.646 -8.533 275 HH22 ARG 36 2HH2 ARG 36 13.458 -12.561 -8.739 276 H ASP 37 H ASP 37 11.524 -20.274 -4.373 277 HA ASP 37 HA ASP 37 11.519 -21.050 -7.136 278 HB2 ASP 37 2HB ASP 37 13.207 -21.947 -5.595 279 HB3 ASP 37 1HB ASP 37 11.958 -22.651 -4.573 280 H ASP 38 H ASP 38 9.485 -21.794 -4.300 281 HA ASP 38 HA ASP 38 7.587 -23.442 -5.718 282 HB2 ASP 38 2HB ASP 38 7.919 -23.679 -3.276 283 HB3 ASP 38 1HB ASP 38 7.397 -22.018 -3.023 284 H PHE 39 H PHE 39 7.806 -20.064 -4.764 285 HA PHE 39 HA PHE 39 5.140 -19.370 -5.687 286 HB2 PHE 39 2HB PHE 39 7.406 -17.746 -4.465 287 HB3 PHE 39 1HB PHE 39 5.962 -16.976 -5.109 288 HD1 PHE 39 HD2 PHE 39 3.731 -17.388 -4.036 289 HD2 PHE 39 HD1 PHE 39 7.356 -18.834 -2.283 290 HE1 PHE 39 HE2 PHE 39 2.587 -17.657 -1.872 291 HE2 PHE 39 HE1 PHE 39 6.197 -19.103 -0.127 292 HZ PHE 39 HZ PHE 39 3.821 -18.510 0.077 293 H ASP 40 H ASP 40 4.709 -17.929 -7.344 294 HA ASP 40 HA ASP 40 6.602 -17.413 -9.463 295 HB2 ASP 40 2HB ASP 40 4.094 -17.770 -9.825 296 HB3 ASP 40 1HB ASP 40 3.824 -16.216 -9.044 297 H GLY 41 H GLY 41 6.669 -14.811 -10.047 298 HA2 GLY 41 2HA GLY 41 7.984 -13.204 -8.299 299 HA3 GLY 41 1HA GLY 41 6.882 -12.577 -9.505 300 H LEU 42 H LEU 42 6.134 -10.780 -8.247 301 HA LEU 42 HA LEU 42 5.809 -10.866 -5.443 302 HB2 LEU 42 2HB LEU 42 4.685 -8.887 -7.429 303 HB3 LEU 42 1HB LEU 42 4.554 -8.701 -5.685 304 HG LEU 42 HG LEU 42 7.043 -8.552 -7.402 305 HD11 LEU 42 1HD1 LEU 42 5.766 -6.485 -7.183 306 HD12 LEU 42 2HD1 LEU 42 7.305 -6.349 -6.337 307 HD13 LEU 42 3HD1 LEU 42 5.817 -6.611 -5.423 308 HD21 LEU 42 3HD2 LEU 42 6.966 -8.797 -4.370 309 HD22 LEU 42 1HD2 LEU 42 8.390 -8.407 -5.336 310 HD23 LEU 42 2HD2 LEU 42 7.632 -9.982 -5.498 311 H SER 43 H SER 43 4.428 -12.158 -4.460 312 HA SER 43 HA SER 43 1.797 -12.776 -5.451 313 HB2 SER 43 2HB SER 43 3.057 -13.329 -2.733 314 HB3 SER 43 1HB SER 43 1.598 -14.084 -3.376 315 HG SER 43 HG SER 43 4.109 -14.246 -4.683 316 H TYR 44 H TYR 44 0.229 -11.362 -5.315 317 HA TYR 44 HA TYR 44 -0.204 -9.776 -2.879 318 HB2 TYR 44 2HB TYR 44 -0.796 -7.759 -4.213 319 HB3 TYR 44 1HB TYR 44 0.884 -8.207 -4.413 320 HD1 TYR 44 HD2 TYR 44 1.605 -9.329 -6.618 321 HD2 TYR 44 HD1 TYR 44 -2.241 -7.534 -6.136 322 HE1 TYR 44 HE2 TYR 44 1.329 -9.226 -9.061 323 HE2 TYR 44 HE1 TYR 44 -2.502 -7.432 -8.569 324 HH TYR 44 HH TYR 44 -0.460 -9.086 -10.712 325 H PHE 45 H PHE 45 -2.519 -8.593 -3.378 326 HA PHE 45 HA PHE 45 -4.394 -10.797 -3.506 327 HB2 PHE 45 2HB PHE 45 -4.870 -7.799 -3.242 328 HB3 PHE 45 1HB PHE 45 -6.135 -9.021 -3.148 329 HD1 PHE 45 HD1 PHE 45 -3.242 -7.537 -1.419 330 HD2 PHE 45 HD2 PHE 45 -6.359 -10.442 -1.164 331 HE1 PHE 45 HE1 PHE 45 -2.844 -7.754 0.995 332 HE2 PHE 45 HE2 PHE 45 -5.953 -10.654 1.249 333 HZ PHE 45 HZ PHE 45 -4.199 -9.311 2.335 334 H ASP 46 H ASP 46 -5.895 -11.207 -5.177 335 HA ASP 46 HA ASP 46 -4.936 -10.432 -7.809 336 HB2 ASP 46 2HB ASP 46 -5.515 -12.772 -7.352 337 HB3 ASP 46 1HB ASP 46 -7.151 -12.320 -6.906 338 HA PRO 47 HA PRO 47 -7.415 -6.779 -8.260 339 HB2 PRO 47 2HB PRO 47 -8.122 -7.105 -11.011 340 HB3 PRO 47 1HB PRO 47 -6.684 -6.284 -10.379 341 HG2 PRO 47 2HG PRO 47 -6.964 -9.100 -11.366 342 HG3 PRO 47 1HG PRO 47 -5.625 -7.946 -11.585 343 HD2 PRO 47 2HD PRO 47 -5.367 -9.900 -9.813 344 HD3 PRO 47 1HD PRO 47 -4.825 -8.257 -9.396 345 H ASP 48 H ASP 48 -9.223 -6.935 -7.085 346 HA ASP 48 HA ASP 48 -11.589 -8.425 -8.044 347 HB2 ASP 48 2HB ASP 48 -10.455 -9.556 -6.154 348 HB3 ASP 48 1HB ASP 48 -10.516 -8.072 -5.210 349 HA PRO 49 HA PRO 49 -13.122 -4.111 -7.693 350 HB2 PRO 49 2HB PRO 49 -15.462 -4.443 -9.051 351 HB3 PRO 49 1HB PRO 49 -13.894 -4.393 -9.881 352 HG2 PRO 49 2HG PRO 49 -15.551 -6.779 -9.127 353 HG3 PRO 49 1HG PRO 49 -14.682 -6.442 -10.642 354 HD2 PRO 49 2HD PRO 49 -13.680 -8.071 -8.681 355 HD3 PRO 49 1HD PRO 49 -12.652 -7.141 -9.796 356 H ASP 50 H ASP 50 -14.771 -7.000 -6.628 357 HA ASP 50 HA ASP 50 -17.038 -5.970 -5.351 358 HB2 ASP 50 2HB ASP 50 -15.440 -8.499 -4.769 359 HB3 ASP 50 1HB ASP 50 -17.037 -8.162 -4.100 360 H TYR 51 H TYR 51 -13.725 -6.238 -4.202 361 HA TYR 51 HA TYR 51 -14.494 -5.353 -1.484 362 HB2 TYR 51 2HB TYR 51 -12.920 -7.383 -1.956 363 HB3 TYR 51 1HB TYR 51 -11.690 -6.183 -2.331 364 HD1 TYR 51 HD1 TYR 51 -13.744 -7.683 0.341 365 HD2 TYR 51 HD2 TYR 51 -10.712 -4.797 -0.507 366 HE1 TYR 51 HE1 TYR 51 -13.277 -7.467 2.739 367 HE2 TYR 51 HE2 TYR 51 -10.242 -4.588 1.893 368 HH TYR 51 HH TYR 51 -11.454 -6.732 4.228 369 H ARG 52 H ARG 52 -13.398 -4.101 -4.426 370 HA ARG 52 HA ARG 52 -11.500 -2.146 -3.607 371 HB2 ARG 52 2HB ARG 52 -11.782 -3.047 -5.958 372 HB3 ARG 52 1HB ARG 52 -13.245 -2.080 -6.114 373 HG2 ARG 52 2HG ARG 52 -11.867 -0.017 -5.742 374 HG3 ARG 52 1HG ARG 52 -10.430 -1.038 -5.658 375 HD2 ARG 52 2HD ARG 52 -10.966 -1.829 -8.008 376 HD3 ARG 52 1HD ARG 52 -12.214 -0.571 -8.074 377 HE ARG 52 HE ARG 52 -9.423 0.086 -7.435 378 HH11 ARG 52 1HH1 ARG 52 -12.121 0.549 -9.623 379 HH12 ARG 52 2HH1 ARG 52 -11.334 1.842 -10.468 380 HH21 ARG 52 1HH2 ARG 52 -8.428 1.716 -8.498 381 HH22 ARG 52 2HH2 ARG 52 -9.223 2.514 -9.828 382 H VAL 53 H VAL 53 -11.781 -0.115 -2.782 383 HA VAL 53 HA VAL 53 -14.510 1.036 -2.618 384 HB VAL 53 HB VAL 53 -14.031 1.805 -0.313 385 HG11 VAL 53 1HG1 VAL 53 -13.709 -1.208 -0.574 386 HG12 VAL 53 2HG1 VAL 53 -15.235 -0.322 -0.574 387 HG13 VAL 53 3HG1 VAL 53 -14.233 -0.345 0.877 388 HG21 VAL 53 3HG2 VAL 53 -11.454 0.195 -0.508 389 HG22 VAL 53 1HG2 VAL 53 -12.070 0.974 0.953 390 HG23 VAL 53 2HG2 VAL 53 -11.577 1.954 -0.428 391 H GLU 54 H GLU 54 -14.291 3.386 -1.746 392 HA GLU 54 HA GLU 54 -12.022 4.842 -2.971 393 HB2 GLU 54 2HB GLU 54 -13.707 6.549 -3.782 394 HB3 GLU 54 1HB GLU 54 -13.825 4.991 -4.596 395 HG2 GLU 54 2HG GLU 54 -15.775 4.381 -3.266 396 HG3 GLU 54 1HG GLU 54 -15.621 5.845 -2.302 397 H ALA 55 H ALA 55 -11.766 7.058 -1.998 398 HA ALA 55 HA ALA 55 -12.858 7.352 0.715 399 HB1 ALA 55 3HB ALA 55 -10.905 5.849 0.972 400 HB2 ALA 55 1HB ALA 55 -10.638 7.409 1.759 401 HB3 ALA 55 2HB ALA 55 -9.878 7.058 0.203 402 H THR 56 H THR 56 -12.213 9.373 1.754 403 HA THR 56 HA THR 56 -11.532 11.570 -0.100 404 HB THR 56 HB THR 56 -12.666 11.665 2.738 405 HG1 THR 56 HG1 THR 56 -13.894 11.907 0.170 406 HG21 THR 56 3HG2 THR 56 -11.458 13.754 2.186 407 HG22 THR 56 1HG2 THR 56 -13.198 14.033 2.246 408 HG23 THR 56 2HG2 THR 56 -12.380 13.904 0.686 409 H VAL 57 H VAL 57 -9.623 12.535 0.037 410 HA VAL 57 HA VAL 57 -7.508 11.790 1.824 411 HB VAL 57 HB VAL 57 -7.631 14.116 -0.173 412 HG11 VAL 57 1HG1 VAL 57 -5.213 12.639 0.937 413 HG12 VAL 57 2HG1 VAL 57 -5.726 14.266 1.386 414 HG13 VAL 57 3HG1 VAL 57 -5.177 13.941 -0.259 415 HG21 VAL 57 3HG2 VAL 57 -6.660 12.605 -1.847 416 HG22 VAL 57 1HG2 VAL 57 -8.217 11.995 -1.287 417 HG23 VAL 57 2HG2 VAL 57 -6.721 11.264 -0.702 418 H THR 58 H THR 58 -7.271 12.631 3.818 419 HA THR 58 HA THR 58 -8.395 15.301 4.487 420 HB THR 58 HB THR 58 -7.821 12.967 6.375 421 HG1 THR 58 HG1 THR 58 -10.077 13.676 4.875 422 HG21 THR 58 3HG2 THR 58 -7.727 15.136 7.523 423 HG22 THR 58 1HG2 THR 58 -9.183 14.260 8.002 424 HG23 THR 58 2HG2 THR 58 -9.291 15.591 6.844 425 H VAL 59 H VAL 59 -6.659 16.701 4.259 426 HA VAL 59 HA VAL 59 -3.938 15.679 4.665 427 HB VAL 59 HB VAL 59 -4.932 18.278 3.385 428 HG11 VAL 59 1HG1 VAL 59 -2.564 18.790 2.836 429 HG12 VAL 59 2HG1 VAL 59 -2.033 17.400 3.787 430 HG13 VAL 59 3HG1 VAL 59 -2.818 18.765 4.581 431 HG21 VAL 59 3HG2 VAL 59 -5.186 16.241 2.017 432 HG22 VAL 59 1HG2 VAL 59 -3.473 15.864 2.232 433 HG23 VAL 59 2HG2 VAL 59 -3.958 17.302 1.326 434 H HIS 60 H HIS 60 -2.794 16.115 6.405 435 HA HIS 60 HA HIS 60 -3.855 17.855 8.520 436 HB2 HIS 60 2HB HIS 60 -1.893 15.517 8.518 437 HB3 HIS 60 1HB HIS 60 -2.167 16.528 9.938 438 HD1 HIS 60 HD1 HIS 60 -3.864 13.923 7.805 439 HD2 HIS 60 HD2 HIS 60 -4.620 16.137 11.240 440 HE1 HIS 60 HE1 HIS 60 -5.958 12.951 8.791 441 HE2 HIS 60 HE2 HIS 60 -6.481 14.410 10.770 442 H GLU 61 H GLU 61 -2.802 19.596 9.192 443 HA GLU 61 HA GLU 61 -0.896 20.846 7.457 444 HB2 GLU 61 2HB GLU 61 -1.089 22.778 9.011 445 HB3 GLU 61 1HB GLU 61 -2.658 22.173 8.498 446 HG2 GLU 61 2HG GLU 61 -2.952 21.035 10.664 447 HG3 GLU 61 1HG GLU 61 -1.353 21.569 11.175 448 H THR 62 H THR 62 -0.658 19.199 10.548 449 HA THR 62 HA THR 62 2.237 19.795 10.711 450 HB THR 62 HB THR 62 1.965 19.366 13.216 451 HG1 THR 62 HG1 THR 62 -0.441 18.596 12.526 452 HG21 THR 62 3HG2 THR 62 0.973 21.576 13.741 453 HG22 THR 62 1HG2 THR 62 0.391 21.706 12.076 454 HG23 THR 62 2HG2 THR 62 2.126 21.684 12.412 455 HA PRO 63 HA PRO 63 1.832 15.292 9.839 456 HB2 PRO 63 2HB PRO 63 4.060 15.010 8.332 457 HB3 PRO 63 1HB PRO 63 2.601 15.785 7.692 458 HG2 PRO 63 2HG PRO 63 5.115 17.049 8.716 459 HG3 PRO 63 1HG PRO 63 4.139 17.476 7.290 460 HD2 PRO 63 2HD PRO 63 3.975 18.793 9.712 461 HD3 PRO 63 1HD PRO 63 2.658 18.735 8.523 462 H GLU 64 H GLU 64 2.378 13.773 11.288 463 HA GLU 64 HA GLU 64 4.646 14.067 13.094 464 HB2 GLU 64 2HB GLU 64 3.614 12.046 14.219 465 HB3 GLU 64 1HB GLU 64 2.544 13.434 14.090 466 HG2 GLU 64 2HG GLU 64 1.453 12.368 12.110 467 HG3 GLU 64 1HG GLU 64 2.475 10.953 12.350 468 H SER 65 H SER 65 6.192 12.346 13.485 469 HA SER 65 HA SER 65 7.235 11.300 10.965 470 HB2 SER 65 2HB SER 65 9.283 10.857 12.428 471 HB3 SER 65 1HB SER 65 8.787 12.545 12.313 472 HG SER 65 HG SER 65 9.017 11.004 14.492 473 H VAL 66 H VAL 66 6.555 9.333 10.358 474 HA VAL 66 HA VAL 66 6.077 7.166 12.331 475 HB VAL 66 HB VAL 66 4.673 7.659 9.659 476 HG11 VAL 66 1HG1 VAL 66 3.107 5.874 10.336 477 HG12 VAL 66 2HG1 VAL 66 4.084 5.560 11.772 478 HG13 VAL 66 3HG1 VAL 66 4.758 5.279 10.168 479 HG21 VAL 66 3HG2 VAL 66 2.661 8.255 10.993 480 HG22 VAL 66 1HG2 VAL 66 4.001 9.362 11.297 481 HG23 VAL 66 2HG2 VAL 66 3.606 8.111 12.478 482 H ASP 67 H ASP 67 7.570 5.578 12.128 483 HA ASP 67 HA ASP 67 9.392 5.472 9.862 484 HB2 ASP 67 2HB ASP 67 9.244 3.874 12.451 485 HB3 ASP 67 1HB ASP 67 10.471 3.590 11.215 486 H LEU 68 H LEU 68 8.940 4.392 8.078 487 HA LEU 68 HA LEU 68 7.430 1.842 8.144 488 HB2 LEU 68 2HB LEU 68 7.175 3.922 5.943 489 HB3 LEU 68 1HB LEU 68 6.232 2.453 6.129 490 HG LEU 68 HG LEU 68 6.103 4.860 7.983 491 HD11 LEU 68 1HD1 LEU 68 4.123 3.968 5.885 492 HD12 LEU 68 2HD1 LEU 68 5.197 5.365 5.775 493 HD13 LEU 68 3HD1 LEU 68 3.935 5.323 7.003 494 HD21 LEU 68 3HD2 LEU 68 4.085 3.767 8.931 495 HD22 LEU 68 1HD2 LEU 68 5.547 2.823 9.200 496 HD23 LEU 68 2HD2 LEU 68 4.408 2.338 7.947 497 H GLU 69 H GLU 69 7.900 0.422 6.330 498 HA GLU 69 HA GLU 69 10.677 0.086 5.888 499 HB2 GLU 69 2HB GLU 69 10.009 -1.871 4.546 500 HB3 GLU 69 1HB GLU 69 9.062 -1.799 6.029 501 HG2 GLU 69 2HG GLU 69 7.190 -0.728 4.678 502 HG3 GLU 69 1HG GLU 69 8.135 -1.053 3.229 503 H THR 70 H THR 70 11.971 0.474 4.114 504 HA THR 70 HA THR 70 10.738 1.488 1.604 505 HB THR 70 HB THR 70 12.209 3.193 2.759 506 HG1 THR 70 HG1 THR 70 11.913 3.070 0.413 507 HG21 THR 70 3HG2 THR 70 14.669 2.930 2.675 508 HG22 THR 70 1HG2 THR 70 14.473 1.266 2.117 509 HG23 THR 70 2HG2 THR 70 13.931 1.727 3.731 510 H SER 71 H SER 71 12.392 1.029 -0.302 511 HA SER 71 HA SER 71 12.545 -1.841 -0.464 512 HB2 SER 71 2HB SER 71 11.782 -0.406 -2.398 513 HB3 SER 71 1HB SER 71 13.430 0.208 -2.543 514 HG SER 71 HG SER 71 12.374 -2.167 -3.369 515 H ASP 72 H ASP 72 14.948 0.802 -0.869 516 HA ASP 72 HA ASP 72 17.234 -0.674 -1.013 517 HB2 ASP 72 2HB ASP 72 16.801 1.781 -1.580 518 HB3 ASP 72 1HB ASP 72 17.057 2.164 0.118 519 H ASP 73 H ASP 73 16.367 -2.158 1.062 520 HA ASP 73 HA ASP 73 17.308 -3.341 2.735 521 HB2 ASP 73 2HB ASP 73 19.720 -1.586 2.165 522 HB3 ASP 73 1HB ASP 73 19.765 -2.976 3.247 523 H ARG 74 H ARG 74 15.824 -0.836 3.510 524 HA ARG 74 HA ARG 74 16.919 -0.430 6.195 525 HB2 ARG 74 2HB ARG 74 18.094 1.115 4.420 526 HB3 ARG 74 1HB ARG 74 16.571 1.978 4.350 527 HG2 ARG 74 2HG ARG 74 16.801 2.648 6.688 528 HG3 ARG 74 1HG ARG 74 18.247 1.661 6.865 529 HD2 ARG 74 2HD ARG 74 19.486 3.117 5.386 530 HD3 ARG 74 1HD ARG 74 18.027 4.005 4.945 531 HE ARG 74 HE ARG 74 19.585 4.259 7.403 532 HH11 ARG 74 1HH1 ARG 74 16.631 5.131 5.711 533 HH12 ARG 74 2HH1 ARG 74 16.300 6.489 6.733 534 HH21 ARG 74 1HH2 ARG 74 19.143 6.052 8.739 535 HH22 ARG 74 2HH2 ARG 74 17.727 7.018 8.458 536 H THR 75 H THR 75 15.533 1.651 6.988 537 HA THR 75 HA THR 75 12.699 1.473 6.393 538 HB THR 75 HB THR 75 13.836 1.181 9.227 539 HG1 THR 75 HG1 THR 75 12.231 -0.703 7.827 540 HG21 THR 75 3HG2 THR 75 11.724 2.470 9.228 541 HG22 THR 75 1HG2 THR 75 11.485 0.871 9.934 542 HG23 THR 75 2HG2 THR 75 10.935 1.198 8.290 543 H VAL 76 H VAL 76 11.758 3.534 6.876 544 HA VAL 76 HA VAL 76 13.704 5.723 7.216 545 HB VAL 76 HB VAL 76 12.700 6.911 5.179 546 HG11 VAL 76 1HG1 VAL 76 14.963 5.967 5.116 547 HG12 VAL 76 2HG1 VAL 76 14.177 5.803 3.547 548 HG13 VAL 76 3HG1 VAL 76 14.318 4.402 4.614 549 HG21 VAL 76 3HG2 VAL 76 11.675 5.557 3.400 550 HG22 VAL 76 1HG2 VAL 76 10.704 5.493 4.869 551 HG23 VAL 76 2HG2 VAL 76 11.728 4.125 4.432 552 H ARG 77 H ARG 77 12.847 7.640 7.844 553 HA ARG 77 HA ARG 77 10.358 7.598 9.269 554 HB2 ARG 77 2HB ARG 77 12.253 8.825 10.167 555 HB3 ARG 77 1HB ARG 77 12.428 9.769 8.701 556 HG2 ARG 77 2HG ARG 77 9.866 10.020 10.262 557 HG3 ARG 77 1HG ARG 77 11.321 10.777 10.898 558 HD2 ARG 77 2HD ARG 77 10.114 11.326 8.156 559 HD3 ARG 77 1HD ARG 77 9.961 12.357 9.580 560 HE ARG 77 HE ARG 77 12.339 12.775 9.484 561 HH11 ARG 77 1HH1 ARG 77 11.026 11.317 6.558 562 HH12 ARG 77 2HH1 ARG 77 12.346 11.861 5.574 563 HH21 ARG 77 1HH2 ARG 77 14.040 13.481 8.166 564 HH22 ARG 77 2HH2 ARG 77 14.051 13.082 6.477 565 H TYR 78 H TYR 78 8.486 7.922 8.355 566 HA TYR 78 HA TYR 78 8.120 9.603 5.953 567 HB2 TYR 78 2HB TYR 78 6.425 7.461 7.279 568 HB3 TYR 78 1HB TYR 78 5.677 8.638 6.212 569 HD1 TYR 78 HD2 TYR 78 8.541 6.186 6.229 570 HD2 TYR 78 HD1 TYR 78 5.499 8.095 3.934 571 HE1 TYR 78 HE2 TYR 78 9.062 4.743 4.310 572 HE2 TYR 78 HE1 TYR 78 6.014 6.653 2.023 573 HH TYR 78 HH TYR 78 7.892 3.864 2.282 574 H LEU 79 H LEU 79 6.248 11.031 6.007 575 HA LEU 79 HA LEU 79 5.601 12.148 8.673 576 HB2 LEU 79 2HB LEU 79 6.080 13.572 6.021 577 HB3 LEU 79 1HB LEU 79 5.300 14.340 7.387 578 HG LEU 79 HG LEU 79 8.170 13.336 7.306 579 HD11 LEU 79 1HD1 LEU 79 8.796 15.699 7.522 580 HD12 LEU 79 2HD1 LEU 79 7.095 16.169 7.513 581 HD13 LEU 79 3HD1 LEU 79 7.816 15.442 6.078 582 HD21 LEU 79 3HD2 LEU 79 6.680 14.618 9.636 583 HD22 LEU 79 1HD2 LEU 79 8.416 14.289 9.589 584 HD23 LEU 79 2HD2 LEU 79 7.267 12.955 9.556 585 H HIS 80 H HIS 80 3.458 12.319 9.136 586 HA HIS 80 HA HIS 80 1.591 10.992 7.360 587 HB2 HIS 80 2HB HIS 80 1.463 10.465 9.727 588 HB3 HIS 80 1HB HIS 80 1.279 12.166 10.149 589 HD2 HIS 80 HD2 HIS 80 -0.855 10.062 7.570 590 HE1 HIS 80 HE1 HIS 80 -3.380 11.891 10.422 591 HE2 HIS 80 HE2 HIS 80 -3.277 10.302 8.456 592 H VAL 81 H VAL 81 1.032 12.193 5.666 593 HA VAL 81 HA VAL 81 0.480 15.068 5.951 594 HB VAL 81 HB VAL 81 0.716 15.235 3.543 595 HG11 VAL 81 1HG1 VAL 81 2.779 15.270 4.883 596 HG12 VAL 81 2HG1 VAL 81 3.078 14.557 3.298 597 HG13 VAL 81 3HG1 VAL 81 2.936 13.517 4.717 598 HG21 VAL 81 3HG2 VAL 81 1.202 13.266 2.107 599 HG22 VAL 81 1HG2 VAL 81 -0.380 13.125 2.872 600 HG23 VAL 81 2HG2 VAL 81 0.983 12.196 3.495 601 H ALA 82 H ALA 82 -1.192 12.045 5.348 602 HA ALA 82 HA ALA 82 -3.744 13.475 5.067 603 HB1 ALA 82 3HB ALA 82 -2.941 13.272 2.744 604 HB2 ALA 82 1HB ALA 82 -4.379 12.280 3.008 605 HB3 ALA 82 2HB ALA 82 -2.783 11.527 2.942 606 H THR 83 H THR 83 -5.596 12.168 5.413 607 HA THR 83 HA THR 83 -5.190 9.331 6.145 608 HB THR 83 HB THR 83 -7.098 11.278 7.553 609 HG1 THR 83 HG1 THR 83 -5.653 10.482 9.373 610 HG21 THR 83 3HG2 THR 83 -8.063 8.993 7.407 611 HG22 THR 83 1HG2 THR 83 -7.597 9.380 9.063 612 HG23 THR 83 2HG2 THR 83 -6.578 8.319 8.089 613 H LEU 84 H LEU 84 -6.048 8.313 4.498 614 HA LEU 84 HA LEU 84 -8.247 9.281 2.893 615 HB2 LEU 84 2HB LEU 84 -7.093 6.465 2.805 616 HB3 LEU 84 1HB LEU 84 -7.844 7.376 1.504 617 HG LEU 84 HG LEU 84 -5.088 7.859 2.702 618 HD11 LEU 84 1HD1 LEU 84 -5.859 6.909 -0.072 619 HD12 LEU 84 2HD1 LEU 84 -5.164 5.921 1.214 620 HD13 LEU 84 3HD1 LEU 84 -4.216 7.223 0.500 621 HD21 LEU 84 3HD2 LEU 84 -6.456 9.473 0.515 622 HD22 LEU 84 1HD2 LEU 84 -4.767 9.633 1.007 623 HD23 LEU 84 2HD2 LEU 84 -6.055 10.037 2.138 624 H SER 85 H SER 85 -10.166 9.331 3.990 625 HA SER 85 HA SER 85 -10.974 7.083 5.726 626 HB2 SER 85 2HB SER 85 -12.012 9.944 5.550 627 HB3 SER 85 1HB SER 85 -12.613 8.719 6.672 628 HG SER 85 HG SER 85 -10.098 8.643 7.089 629 H PHE 86 H PHE 86 -12.638 5.797 5.207 630 HA PHE 86 HA PHE 86 -14.448 6.344 2.976 631 HB2 PHE 86 2HB PHE 86 -13.800 4.127 1.906 632 HB3 PHE 86 1HB PHE 86 -12.586 5.381 1.788 633 HD1 PHE 86 HD1 PHE 86 -10.510 5.272 3.209 634 HD2 PHE 86 HD2 PHE 86 -13.316 2.048 3.068 635 HE1 PHE 86 HE1 PHE 86 -8.821 3.763 4.159 636 HE2 PHE 86 HE2 PHE 86 -11.620 0.551 4.020 637 HZ PHE 86 HZ PHE 86 -9.374 1.401 4.565 638 H ASP 87 H ASP 87 -15.857 4.314 2.642 639 HA ASP 87 HA ASP 87 -16.578 3.056 5.218 640 HB2 ASP 87 2HB ASP 87 -18.798 2.619 4.214 641 HB3 ASP 87 1HB ASP 87 -18.433 4.335 4.223 642 H LEU 88 H LEU 88 -16.458 0.915 5.405 643 HA LEU 88 HA LEU 88 -16.314 -0.972 3.256 644 HB2 LEU 88 2HB LEU 88 -13.977 -0.252 3.138 645 HB3 LEU 88 1HB LEU 88 -13.807 -0.364 4.878 646 HG LEU 88 HG LEU 88 -14.109 -2.875 4.681 647 HD11 LEU 88 1HD1 LEU 88 -15.262 -2.993 2.527 648 HD12 LEU 88 2HD1 LEU 88 -13.794 -3.964 2.503 649 HD13 LEU 88 3HD1 LEU 88 -13.822 -2.393 1.699 650 HD21 LEU 88 3HD2 LEU 88 -11.731 -1.690 3.218 651 HD22 LEU 88 1HD2 LEU 88 -11.809 -3.306 3.927 652 HD23 LEU 88 2HD2 LEU 88 -11.891 -1.883 4.966 653 H ASP 89 H ASP 89 -17.204 -2.783 4.016 654 HA ASP 89 HA ASP 89 -17.707 -4.585 5.287 655 HB2 ASP 89 2HB ASP 89 -15.303 -4.411 6.058 656 HB3 ASP 89 1HB ASP 89 -15.859 -3.461 7.435 657 H GLY 90 H GLY 90 -19.176 -2.016 5.388 658 HA2 GLY 90 2HA GLY 90 -21.264 -1.491 6.224 659 HA3 GLY 90 1HA GLY 90 -21.071 -2.734 7.452 660 H GLU 91 H GLU 91 -18.393 -0.641 7.425 661 HA GLU 91 HA GLU 91 -19.583 1.442 9.102 662 HB2 GLU 91 2HB GLU 91 -17.990 1.164 10.948 663 HB3 GLU 91 1HB GLU 91 -18.944 -0.300 10.752 664 HG2 GLU 91 2HG GLU 91 -17.088 -1.441 9.684 665 HG3 GLU 91 1HG GLU 91 -16.140 0.047 9.668 666 H SER 92 H SER 92 -17.701 3.003 9.797 667 HA SER 92 HA SER 92 -16.309 3.789 7.363 668 HB2 SER 92 2HB SER 92 -17.467 5.490 8.763 669 HB3 SER 92 1HB SER 92 -16.372 5.141 10.100 670 HG SER 92 HG SER 92 -15.431 5.980 7.547 671 H ARG 93 H ARG 93 -14.344 3.088 6.908 672 HA ARG 93 HA ARG 93 -12.389 2.397 9.042 673 HB2 ARG 93 2HB ARG 93 -12.379 1.468 6.133 674 HB3 ARG 93 1HB ARG 93 -11.305 0.923 7.410 675 HG2 ARG 93 2HG ARG 93 -14.290 0.391 7.357 676 HG3 ARG 93 1HG ARG 93 -13.075 -0.713 6.719 677 HD2 ARG 93 2HD ARG 93 -12.064 -0.826 9.012 678 HD3 ARG 93 1HD ARG 93 -13.415 0.145 9.606 679 HE ARG 93 HE ARG 93 -14.582 -1.961 8.278 680 HH11 ARG 93 1HH1 ARG 93 -12.483 -1.606 11.074 681 HH12 ARG 93 2HH1 ARG 93 -13.054 -3.065 11.820 682 HH21 ARG 93 1HH2 ARG 93 -15.318 -3.860 9.294 683 HH22 ARG 93 2HH2 ARG 93 -14.644 -4.330 10.822 684 H ASP 94 H ASP 94 -10.206 3.208 8.659 685 HA ASP 94 HA ASP 94 -9.801 5.049 6.407 686 HB2 ASP 94 2HB ASP 94 -8.887 6.834 7.817 687 HB3 ASP 94 1HB ASP 94 -10.555 6.499 8.254 688 H LEU 95 H LEU 95 -7.767 5.269 5.725 689 HA LEU 95 HA LEU 95 -5.556 3.876 7.113 690 HB2 LEU 95 2HB LEU 95 -6.066 3.951 4.109 691 HB3 LEU 95 1HB LEU 95 -4.574 3.385 4.848 692 HG LEU 95 HG LEU 95 -7.313 2.082 5.009 693 HD11 LEU 95 1HD1 LEU 95 -6.214 0.198 3.917 694 HD12 LEU 95 2HD1 LEU 95 -4.683 1.077 3.891 695 HD13 LEU 95 3HD1 LEU 95 -6.058 1.666 2.948 696 HD21 LEU 95 3HD2 LEU 95 -4.807 1.262 6.519 697 HD22 LEU 95 1HD2 LEU 95 -6.308 0.335 6.427 698 HD23 LEU 95 2HD2 LEU 95 -6.290 1.901 7.231 699 H HIS 96 H HIS 96 -3.684 5.040 7.233 700 HA HIS 96 HA HIS 96 -3.904 7.895 6.587 701 HB2 HIS 96 2HB HIS 96 -1.972 6.311 8.352 702 HB3 HIS 96 1HB HIS 96 -1.875 8.054 8.101 703 HD2 HIS 96 HD2 HIS 96 -5.018 5.833 9.114 704 HE1 HIS 96 HE1 HIS 96 -4.588 9.064 11.801 705 HE2 HIS 96 HE2 HIS 96 -6.130 7.229 10.979 706 H ALA 97 H ALA 97 -2.734 8.848 5.030 707 HA ALA 97 HA ALA 97 -0.853 7.269 3.398 708 HB1 ALA 97 3HB ALA 97 -1.315 8.920 1.622 709 HB2 ALA 97 1HB ALA 97 -2.362 9.829 2.719 710 HB3 ALA 97 2HB ALA 97 -2.811 8.200 2.214 711 H PHE 98 H PHE 98 1.235 7.847 3.281 712 HA PHE 98 HA PHE 98 2.151 10.261 4.754 713 HB2 PHE 98 2HB PHE 98 3.639 7.607 4.644 714 HB3 PHE 98 1HB PHE 98 3.968 8.990 5.673 715 HD1 PHE 98 HD2 PHE 98 1.866 6.005 5.206 716 HD2 PHE 98 HD1 PHE 98 2.673 9.338 7.747 717 HE1 PHE 98 HE2 PHE 98 0.605 4.927 7.016 718 HE2 PHE 98 HE1 PHE 98 1.399 8.256 9.553 719 HZ PHE 98 HZ PHE 98 0.363 6.056 9.187 720 H ARG 99 H ARG 99 4.112 11.184 4.052 721 HA ARG 99 HA ARG 99 5.350 10.251 1.507 722 HB2 ARG 99 2HB ARG 99 5.266 13.207 2.296 723 HB3 ARG 99 1HB ARG 99 5.692 12.516 0.735 724 HG2 ARG 99 2HG ARG 99 2.926 12.541 1.944 725 HG3 ARG 99 1HG ARG 99 3.514 13.695 0.757 726 HD2 ARG 99 2HD ARG 99 3.498 10.732 0.147 727 HD3 ARG 99 1HD ARG 99 2.040 11.708 -0.026 728 HE ARG 99 HE ARG 99 3.143 13.042 -1.660 729 HH11 ARG 99 1HH1 ARG 99 4.849 10.086 -0.891 730 HH12 ARG 99 2HH1 ARG 99 5.757 10.097 -2.372 731 HH21 ARG 99 1HH2 ARG 99 4.378 13.095 -3.521 732 HH22 ARG 99 2HH2 ARG 99 5.490 11.795 -3.858 733 H GLN 100 H GLN 100 7.601 10.003 1.755 734 HA GLN 100 HA GLN 100 8.678 9.484 4.182 735 HB2 GLN 100 2HB GLN 100 10.170 10.344 1.687 736 HB3 GLN 100 1HB GLN 100 10.941 9.600 3.083 737 HG2 GLN 100 2HG GLN 100 9.517 7.583 2.753 738 HG3 GLN 100 1HG GLN 100 8.830 8.336 1.318 739 HE21 GLN 100 1HE2 GLN 100 12.261 8.545 2.166 740 HE22 GLN 100 2HE2 GLN 100 12.816 7.574 0.856 741 H ALA 101 H ALA 101 10.065 12.347 2.477 742 HA ALA 101 HA ALA 101 9.988 13.815 5.068 743 HB1 ALA 101 3HB ALA 101 12.301 13.361 4.336 744 HB2 ALA 101 1HB ALA 101 11.961 15.092 4.293 745 HB3 ALA 101 2HB ALA 101 11.992 14.161 2.794 746 H ALA 102 H ALA 102 10.477 14.869 1.703 747 HA ALA 102 HA ALA 102 7.957 16.425 1.745 748 HB1 ALA 102 3HB ALA 102 9.886 17.914 2.244 749 HB2 ALA 102 1HB ALA 102 9.172 18.301 0.678 750 HB3 ALA 102 2HB ALA 102 10.680 17.386 0.761 751 H ASP 103 H ASP 103 8.246 13.839 0.639 752 HA ASP 103 HA ASP 103 9.364 13.700 -1.953 753 HB2 ASP 103 2HB ASP 103 8.884 11.731 -0.428 754 HB3 ASP 103 1HB ASP 103 7.177 11.900 -0.816 755 H GLU 104 H GLU 104 8.481 13.910 -3.987 756 HA GLU 104 HA GLU 104 5.766 15.103 -4.255 757 HB2 GLU 104 2HB GLU 104 8.344 15.904 -5.675 758 HB3 GLU 104 1HB GLU 104 6.751 16.535 -6.080 759 HG2 GLU 104 2HG GLU 104 6.576 17.521 -3.819 760 HG3 GLU 104 1HG GLU 104 8.186 16.912 -3.432 761 H SER 105 H SER 105 7.271 12.334 -4.880 762 HA SER 105 HA SER 105 6.705 11.954 -7.695 763 HB2 SER 105 2HB SER 105 8.642 10.894 -6.512 764 HB3 SER 105 1HB SER 105 7.517 9.922 -5.569 765 HG SER 105 HG SER 105 6.765 9.104 -7.673 766 H ARG 106 H ARG 106 4.481 12.429 -5.549 767 HA ARG 106 HA ARG 106 2.239 12.033 -5.360 768 HB2 ARG 106 2HB ARG 106 2.520 10.191 -7.767 769 HB3 ARG 106 1HB ARG 106 1.022 10.873 -7.156 770 HG2 ARG 106 2HG ARG 106 3.288 12.531 -8.309 771 HG3 ARG 106 1HG ARG 106 1.924 11.941 -9.251 772 HD2 ARG 106 2HD ARG 106 1.375 14.182 -8.738 773 HD3 ARG 106 1HD ARG 106 0.431 13.225 -7.604 774 HE ARG 106 HE ARG 106 1.721 14.025 -5.838 775 HH11 ARG 106 1HH1 ARG 106 2.950 15.319 -8.871 776 HH12 ARG 106 2HH1 ARG 106 3.914 16.527 -8.081 777 HH21 ARG 106 1HH2 ARG 106 2.939 15.652 -4.852 778 HH22 ARG 106 2HH2 ARG 106 3.911 16.717 -5.821 779 H THR 107 H THR 107 4.466 9.810 -4.524 780 HA THR 107 HA THR 107 2.949 7.369 -4.646 781 HB THR 107 HB THR 107 5.652 7.810 -3.294 782 HG1 THR 107 HG1 THR 107 5.012 7.374 -6.049 783 HG21 THR 107 3HG2 THR 107 4.594 5.604 -2.845 784 HG22 THR 107 1HG2 THR 107 6.036 5.433 -3.849 785 HG23 THR 107 2HG2 THR 107 4.433 5.328 -4.580 786 H LEU 108 H LEU 108 1.194 7.660 -3.283 787 HA LEU 108 HA LEU 108 1.476 8.310 -0.468 788 HB2 LEU 108 2HB LEU 108 -0.888 7.239 -2.065 789 HB3 LEU 108 1HB LEU 108 -0.962 7.722 -0.377 790 HG LEU 108 HG LEU 108 -0.388 9.577 -2.720 791 HD11 LEU 108 1HD1 LEU 108 -2.715 8.821 -2.692 792 HD12 LEU 108 2HD1 LEU 108 -2.611 10.521 -2.243 793 HD13 LEU 108 3HD1 LEU 108 -2.873 9.298 -0.997 794 HD21 LEU 108 3HD2 LEU 108 0.784 10.340 -0.696 795 HD22 LEU 108 1HD2 LEU 108 -0.716 10.243 0.232 796 HD23 LEU 108 2HD2 LEU 108 -0.555 11.417 -1.078 797 H PHE 109 H PHE 109 2.195 6.881 0.901 798 HA PHE 109 HA PHE 109 2.141 3.985 0.288 799 HB2 PHE 109 2HB PHE 109 4.350 5.229 0.620 800 HB3 PHE 109 1HB PHE 109 3.861 5.548 2.278 801 HD1 PHE 109 HD1 PHE 109 4.615 2.797 -0.127 802 HD2 PHE 109 HD2 PHE 109 4.282 3.914 3.978 803 HE1 PHE 109 HE1 PHE 109 5.678 0.678 0.544 804 HE2 PHE 109 HE2 PHE 109 5.321 1.785 4.648 805 HZ PHE 109 HZ PHE 109 6.027 0.169 2.929 806 H VAL 110 H VAL 110 0.379 3.092 1.259 807 HA VAL 110 HA VAL 110 -0.325 3.902 4.022 808 HB VAL 110 HB VAL 110 -2.687 3.242 3.628 809 HG11 VAL 110 1HG1 VAL 110 -3.381 5.164 2.238 810 HG12 VAL 110 2HG1 VAL 110 -1.725 5.344 1.655 811 HG13 VAL 110 3HG1 VAL 110 -2.094 5.602 3.360 812 HG21 VAL 110 3HG2 VAL 110 -1.918 2.885 0.702 813 HG22 VAL 110 1HG2 VAL 110 -3.572 2.913 1.325 814 HG23 VAL 110 2HG2 VAL 110 -2.474 1.621 1.804 815 HA PRO 111 HA PRO 111 0.808 -0.519 4.573 816 HB2 PRO 111 2HB PRO 111 2.073 -0.208 6.968 817 HB3 PRO 111 1HB PRO 111 2.897 0.128 5.431 818 HG2 PRO 111 2HG PRO 111 1.668 2.057 7.365 819 HG3 PRO 111 1HG PRO 111 3.212 2.167 6.490 820 HD2 PRO 111 2HD PRO 111 0.921 3.451 5.675 821 HD3 PRO 111 1HD PRO 111 2.219 2.962 4.566 822 H PHE 112 H PHE 112 -0.828 -1.713 5.376 823 HA PHE 112 HA PHE 112 -2.432 -0.732 7.632 824 HB2 PHE 112 2HB PHE 112 -4.487 -1.477 6.611 825 HB3 PHE 112 1HB PHE 112 -3.683 -0.376 5.510 826 HD1 PHE 112 HD1 PHE 112 -2.607 -1.266 3.414 827 HD2 PHE 112 HD2 PHE 112 -4.952 -3.771 5.973 828 HE1 PHE 112 HE1 PHE 112 -2.844 -2.914 1.607 829 HE2 PHE 112 HE2 PHE 112 -5.174 -5.411 4.154 830 HZ PHE 112 HZ PHE 112 -4.125 -4.984 1.972 831 H ARG 113 H ARG 113 -3.259 -2.315 8.992 832 HA ARG 113 HA ARG 113 -2.367 -5.106 8.534 833 HB2 ARG 113 2HB ARG 113 -1.170 -4.134 10.463 834 HB3 ARG 113 1HB ARG 113 -2.693 -3.616 11.184 835 HG2 ARG 113 2HG ARG 113 -3.370 -6.029 11.354 836 HG3 ARG 113 1HG ARG 113 -1.771 -6.478 10.756 837 HD2 ARG 113 2HD ARG 113 -2.284 -4.883 13.285 838 HD3 ARG 113 1HD ARG 113 -1.984 -6.623 13.229 839 HE ARG 113 HE ARG 113 0.114 -5.254 11.921 840 HH11 ARG 113 1HH1 ARG 113 -1.113 -5.795 15.169 841 HH12 ARG 113 2HH1 ARG 113 0.444 -5.621 15.910 842 HH21 ARG 113 1HH2 ARG 113 2.156 -5.112 12.888 843 HH22 ARG 113 2HH2 ARG 113 2.306 -5.234 14.612 844 H ASP 114 H ASP 114 -4.006 -6.577 8.448 845 HA ASP 114 HA ASP 114 -6.693 -5.810 9.412 846 HB2 ASP 114 2HB ASP 114 -7.686 -6.885 7.536 847 HB3 ASP 114 1HB ASP 114 -6.356 -5.980 6.834 848 H LYS 115 H LYS 115 -7.814 -8.392 9.253 849 HA LYS 115 HA LYS 115 -6.710 -9.414 11.731 850 HB2 LYS 115 2HB LYS 115 -9.089 -10.453 10.152 851 HB3 LYS 115 1HB LYS 115 -8.695 -10.832 11.828 852 HG2 LYS 115 2HG LYS 115 -9.645 -8.195 10.694 853 HG3 LYS 115 1HG LYS 115 -10.476 -9.240 11.839 854 HD2 LYS 115 2HD LYS 115 -7.928 -7.670 12.398 855 HD3 LYS 115 1HD LYS 115 -9.554 -7.215 12.907 856 HE2 LYS 115 2HE LYS 115 -9.699 -9.250 14.284 857 HE3 LYS 115 1HE LYS 115 -8.059 -9.700 13.792 858 HZ1 LYS 115 3HZ LYS 115 -8.039 -8.623 15.923 859 HZ2 LYS 115 1HZ LYS 115 -8.840 -7.270 15.301 860 HZ3 LYS 115 2HZ LYS 115 -7.265 -7.631 14.795 861 H THR 116 H THR 116 -6.356 -10.316 8.410 862 HA THR 116 HA THR 116 -5.665 -13.089 8.941 863 HB THR 116 HB THR 116 -5.117 -13.281 6.577 864 HG1 THR 116 HG1 THR 116 -5.211 -10.447 6.614 865 HG21 THR 116 3HG2 THR 116 -7.264 -12.639 5.540 866 HG22 THR 116 1HG2 THR 116 -7.640 -11.628 6.937 867 HG23 THR 116 2HG2 THR 116 -7.504 -13.379 7.124 868 H THR 117 H THR 117 -3.984 -10.029 8.660 869 HA THR 117 HA THR 117 -1.358 -10.980 8.095 870 HB THR 117 HB THR 117 -2.402 -8.345 9.222 871 HG1 THR 117 HG1 THR 117 -2.881 -8.623 7.064 872 HG21 THR 117 3HG2 THR 117 -0.175 -7.372 8.786 873 HG22 THR 117 1HG2 THR 117 0.455 -8.967 8.378 874 HG23 THR 117 2HG2 THR 117 -0.074 -8.621 10.027 875 H GLY 118 H GLY 118 0.319 -11.518 9.481 876 HA2 GLY 118 2HA GLY 118 1.380 -12.300 11.345 877 HA3 GLY 118 1HA GLY 118 0.334 -11.271 12.299 878 H GLN 119 H GLN 119 -1.778 -13.206 10.670 879 HA GLN 119 HA GLN 119 -1.919 -15.188 12.872 880 HB2 GLN 119 2HB GLN 119 -4.189 -14.108 11.125 881 HB3 GLN 119 1HB GLN 119 -4.363 -15.247 12.455 882 HG2 GLN 119 2HG GLN 119 -3.416 -12.371 12.736 883 HG3 GLN 119 1HG GLN 119 -5.049 -12.942 13.062 884 HE21 GLN 119 1HE2 GLN 119 -1.751 -12.909 14.215 885 HE22 GLN 119 2HE2 GLN 119 -2.087 -13.498 15.801 886 H GLN 120 H GLN 120 -3.416 -15.064 9.640 887 HA GLN 120 HA GLN 120 -2.363 -17.754 8.998 888 HB2 GLN 120 2HB GLN 120 -4.186 -17.868 7.321 889 HB3 GLN 120 1HB GLN 120 -4.830 -17.563 8.930 890 HG2 GLN 120 2HG GLN 120 -5.174 -15.222 8.405 891 HG3 GLN 120 1HG GLN 120 -4.396 -15.414 6.838 892 HE21 GLN 120 1HE2 GLN 120 -7.285 -16.064 8.707 893 HE22 GLN 120 2HE2 GLN 120 -8.290 -16.469 7.361 894 H SER 121 H SER 121 -1.134 -14.944 8.676 895 HA SER 121 HA SER 121 -0.092 -15.183 5.988 896 HB2 SER 121 2HB SER 121 -1.802 -12.754 6.721 897 HB3 SER 121 1HB SER 121 -0.785 -12.855 5.282 898 HG SER 121 HG SER 121 -2.212 -14.994 5.133 899 H TYR 122 H TYR 122 1.384 -13.215 5.606 900 HA TYR 122 HA TYR 122 3.525 -13.492 7.336 901 HB2 TYR 122 2HB TYR 122 3.044 -11.188 5.389 902 HB3 TYR 122 1HB TYR 122 4.604 -11.754 5.972 903 HD1 TYR 122 HD1 TYR 122 5.562 -13.884 5.104 904 HD2 TYR 122 HD2 TYR 122 1.858 -12.380 3.598 905 HE1 TYR 122 HE1 TYR 122 5.697 -15.437 3.206 906 HE2 TYR 122 HE2 TYR 122 1.995 -13.937 1.707 907 HH TYR 122 HH TYR 122 4.203 -16.517 1.590 908 H ASP 123 H ASP 123 4.389 -12.219 8.995 909 HA ASP 123 HA ASP 123 2.564 -10.725 10.584 910 HB2 ASP 123 2HB ASP 123 4.388 -10.454 12.165 911 HB3 ASP 123 1HB ASP 123 4.401 -12.096 11.541 912 H GLY 124 H GLY 124 3.214 -8.584 11.608 913 HA2 GLY 124 2HA GLY 124 3.830 -6.362 11.494 914 HA3 GLY 124 1HA GLY 124 4.548 -6.640 9.918 915 H GLY 125 H GLY 125 3.268 -6.477 8.071 916 HA2 GLY 125 2HA GLY 125 0.493 -5.851 8.039 917 HA3 GLY 125 1HA GLY 125 1.457 -4.375 7.995 918 H ARG 126 H ARG 126 -0.124 -4.789 5.918 919 HA ARG 126 HA ARG 126 1.582 -5.764 3.687 920 HB2 ARG 126 2HB ARG 126 -1.445 -5.224 3.670 921 HB3 ARG 126 1HB ARG 126 -0.496 -5.797 2.308 922 HG2 ARG 126 2HG ARG 126 -1.076 -7.341 4.845 923 HG3 ARG 126 1HG ARG 126 -1.884 -7.564 3.294 924 HD2 ARG 126 2HD ARG 126 -0.308 -9.319 3.388 925 HD3 ARG 126 1HD ARG 126 0.473 -8.113 2.366 926 HE ARG 126 HE ARG 126 2.001 -7.639 4.071 927 HH11 ARG 126 1HH1 ARG 126 -0.315 -10.059 5.146 928 HH12 ARG 126 2HH1 ARG 126 0.632 -10.521 6.524 929 HH21 ARG 126 1HH2 ARG 126 3.186 -8.198 5.914 930 HH22 ARG 126 2HH2 ARG 126 2.626 -9.461 6.962 931 H TYR 127 H TYR 127 2.386 -4.026 2.438 932 HA TYR 127 HA TYR 127 1.247 -1.377 2.997 933 HB2 TYR 127 2HB TYR 127 3.162 -0.396 2.008 934 HB3 TYR 127 1HB TYR 127 3.767 -1.734 2.966 935 HD1 TYR 127 HD1 TYR 127 3.309 -0.421 -0.448 936 HD2 TYR 127 HD2 TYR 127 4.822 -3.680 1.865 937 HE1 TYR 127 HE1 TYR 127 4.576 -1.221 -2.410 938 HE2 TYR 127 HE2 TYR 127 6.073 -4.477 -0.086 939 HH TYR 127 HH TYR 127 6.106 -4.316 -2.448 940 H MET 128 H MET 128 0.166 -0.225 1.577 941 HA MET 128 HA MET 128 -0.453 -1.367 -1.084 942 HB2 MET 128 2HB MET 128 -2.293 -1.252 0.944 943 HB3 MET 128 1HB MET 128 -2.496 0.373 0.298 944 HG2 MET 128 2HG MET 128 -2.672 -2.127 -1.385 945 HG3 MET 128 1HG MET 128 -4.064 -1.332 -0.655 946 HE1 MET 128 3HE MET 128 -3.919 1.634 -1.030 947 HE2 MET 128 1HE MET 128 -5.262 0.637 -1.600 948 HE3 MET 128 2HE MET 128 -4.545 1.849 -2.665 949 H GLU 129 H GLU 129 -0.136 0.061 -2.741 950 HA GLU 129 HA GLU 129 1.005 2.699 -1.995 951 HB2 GLU 129 2HB GLU 129 2.685 0.911 -2.542 952 HB3 GLU 129 1HB GLU 129 1.965 0.753 -4.138 953 HG2 GLU 129 2HG GLU 129 2.549 3.205 -4.505 954 HG3 GLU 129 1HG GLU 129 3.492 3.117 -3.015 955 H LEU 130 H LEU 130 -0.210 4.274 -2.813 956 HA LEU 130 HA LEU 130 -1.637 3.946 -5.393 957 HB2 LEU 130 2HB LEU 130 -2.152 6.252 -3.476 958 HB3 LEU 130 1HB LEU 130 -3.203 5.576 -4.704 959 HG LEU 130 HG LEU 130 -3.200 3.446 -3.072 960 HD11 LEU 130 1HD1 LEU 130 -3.122 4.075 -0.699 961 HD12 LEU 130 2HD1 LEU 130 -2.608 5.706 -1.137 962 HD13 LEU 130 3HD1 LEU 130 -1.561 4.324 -1.481 963 HD21 LEU 130 3HD2 LEU 130 -5.206 4.731 -3.712 964 HD22 LEU 130 1HD2 LEU 130 -4.851 5.911 -2.449 965 HD23 LEU 130 2HD2 LEU 130 -5.248 4.244 -2.020 966 H GLU 131 H GLU 131 -1.009 5.247 -7.079 967 HA GLU 131 HA GLU 131 0.497 7.732 -6.505 968 HB2 GLU 131 2HB GLU 131 1.056 5.873 -8.864 969 HB3 GLU 131 1HB GLU 131 1.768 7.467 -8.629 970 HG2 GLU 131 2HG GLU 131 2.793 6.621 -6.493 971 HG3 GLU 131 1HG GLU 131 2.188 5.018 -6.900 972 HA PRO 132 HA PRO 132 -3.497 8.817 -8.600 973 HB2 PRO 132 2HB PRO 132 -3.479 11.442 -7.648 974 HB3 PRO 132 1HB PRO 132 -4.133 10.058 -6.735 975 HG2 PRO 132 2HG PRO 132 -1.413 11.324 -6.519 976 HG3 PRO 132 1HG PRO 132 -2.534 10.843 -5.223 977 HD2 PRO 132 2HD PRO 132 -0.466 9.285 -5.860 978 HD3 PRO 132 1HD PRO 132 -2.041 8.567 -5.456 979 H ASP 133 H ASP 133 -3.980 10.349 -10.247 980 HA ASP 133 HA ASP 133 -1.855 10.801 -12.144 981 HB2 ASP 133 2HB ASP 133 -4.109 10.081 -12.828 982 HB3 ASP 133 1HB ASP 133 -4.819 11.538 -12.147 983 H ARG 134 H ARG 134 -2.998 12.496 -9.528 984 HA ARG 134 HA ARG 134 -1.865 15.065 -10.324 985 HB2 ARG 134 2HB ARG 134 -3.857 16.204 -9.257 986 HB3 ARG 134 1HB ARG 134 -4.243 15.368 -10.759 987 HG2 ARG 134 2HG ARG 134 -5.383 13.610 -9.633 988 HG3 ARG 134 1HG ARG 134 -4.673 14.033 -8.074 989 HD2 ARG 134 2HD ARG 134 -5.960 16.032 -7.977 990 HD3 ARG 134 1HD ARG 134 -6.631 15.780 -9.585 991 HE ARG 134 HE ARG 134 -7.319 14.370 -7.090 992 HH11 ARG 134 1HH1 ARG 134 -7.953 14.743 -10.532 993 HH12 ARG 134 2HH1 ARG 134 -9.463 13.894 -10.453 994 HH21 ARG 134 1HH2 ARG 134 -9.287 13.280 -7.009 995 HH22 ARG 134 2HH2 ARG 134 -10.224 13.061 -8.461 996 H ASP 135 H ASP 135 -1.677 16.454 -8.251 997 HA ASP 135 HA ASP 135 -0.978 14.790 -5.931 998 HB2 ASP 135 2HB ASP 135 0.484 16.724 -6.659 999 HB3 ASP 135 1HB ASP 135 -0.819 17.821 -6.217 1000 H LEU 136 H LEU 136 -2.189 14.819 -4.008 1001 HA LEU 136 HA LEU 136 -4.998 15.632 -4.390 1002 HB2 LEU 136 2HB LEU 136 -3.833 13.678 -2.363 1003 HB3 LEU 136 1HB LEU 136 -5.539 13.954 -2.693 1004 HG LEU 136 HG LEU 136 -3.531 12.717 -4.621 1005 HD11 LEU 136 1HD1 LEU 136 -5.903 11.419 -3.267 1006 HD12 LEU 136 2HD1 LEU 136 -4.231 11.255 -2.738 1007 HD13 LEU 136 3HD1 LEU 136 -4.711 10.642 -4.318 1008 HD21 LEU 136 3HD2 LEU 136 -6.501 13.212 -5.027 1009 HD22 LEU 136 1HD2 LEU 136 -5.466 12.264 -6.102 1010 HD23 LEU 136 2HD2 LEU 136 -5.178 13.989 -5.902 1011 H SER 137 H SER 137 -6.174 16.675 -2.804 1012 HA SER 137 HA SER 137 -4.703 18.073 -0.642 1013 HB2 SER 137 2HB SER 137 -6.869 19.222 -2.476 1014 HB3 SER 137 1HB SER 137 -6.117 20.076 -1.123 1015 HG SER 137 HG SER 137 -4.744 19.052 -3.386 1016 H ASP 138 H ASP 138 -6.373 19.062 0.959 1017 HA ASP 138 HA ASP 138 -7.945 16.983 2.094 1018 HB2 ASP 138 2HB ASP 138 -6.824 18.717 3.459 1019 HB3 ASP 138 1HB ASP 138 -7.868 19.957 2.775 1020 H GLY 139 H GLY 139 -9.804 16.313 1.201 1021 HA2 GLY 139 2HA GLY 139 -12.203 16.759 0.915 1022 HA3 GLY 139 1HA GLY 139 -11.775 18.289 0.157 1023 H ASP 140 H ASP 140 -9.455 16.568 -1.083 1024 HA ASP 140 HA ASP 140 -10.726 15.886 -3.582 1025 HB2 ASP 140 2HB ASP 140 -8.310 16.765 -3.168 1026 HB3 ASP 140 1HB ASP 140 -7.902 15.130 -2.685 1027 H GLU 141 H GLU 141 -10.778 13.643 -4.463 1028 HA GLU 141 HA GLU 141 -11.051 11.579 -2.359 1029 HB2 GLU 141 2HB GLU 141 -12.158 11.632 -5.198 1030 HB3 GLU 141 1HB GLU 141 -12.440 10.364 -4.006 1031 HG2 GLU 141 2HG GLU 141 -13.581 12.017 -2.544 1032 HG3 GLU 141 1HG GLU 141 -13.329 13.251 -3.779 1033 H ILE 142 H ILE 142 -10.564 9.313 -3.142 1034 HA ILE 142 HA ILE 142 -8.563 8.849 -5.144 1035 HB ILE 142 HB ILE 142 -7.102 9.839 -3.394 1036 HG12 ILE 142 2HG1 ILE 142 -5.457 7.922 -3.134 1037 HG13 ILE 142 1HG1 ILE 142 -6.690 6.829 -3.750 1038 HG21 ILE 142 1HG2 ILE 142 -8.435 9.343 -1.404 1039 HG22 ILE 142 2HG2 ILE 142 -6.776 8.784 -1.195 1040 HG23 ILE 142 3HG2 ILE 142 -8.061 7.625 -1.548 1041 HD11 ILE 142 3HD1 ILE 142 -6.646 7.968 -5.906 1042 HD12 ILE 142 1HD1 ILE 142 -5.032 7.425 -5.445 1043 HD13 ILE 142 2HD1 ILE 142 -5.468 9.127 -5.286 1044 H THR 143 H THR 143 -8.439 6.604 -5.598 1045 HA THR 143 HA THR 143 -10.492 4.946 -4.268 1046 HB THR 143 HB THR 143 -8.993 4.301 -6.851 1047 HG1 THR 143 HG1 THR 143 -10.429 6.371 -6.607 1048 HG21 THR 143 3HG2 THR 143 -11.644 3.350 -5.700 1049 HG22 THR 143 1HG2 THR 143 -10.179 2.393 -5.880 1050 HG23 THR 143 2HG2 THR 143 -11.043 2.954 -7.316 1051 H LEU 144 H LEU 144 -9.977 3.100 -3.123 1052 HA LEU 144 HA LEU 144 -7.136 2.644 -2.455 1053 HB2 LEU 144 2HB LEU 144 -9.699 2.632 -0.864 1054 HB3 LEU 144 1HB LEU 144 -8.433 1.539 -0.362 1055 HG LEU 144 HG LEU 144 -8.494 3.679 0.934 1056 HD11 LEU 144 1HD1 LEU 144 -6.076 4.094 0.951 1057 HD12 LEU 144 2HD1 LEU 144 -5.904 3.249 -0.589 1058 HD13 LEU 144 3HD1 LEU 144 -6.422 2.367 0.849 1059 HD21 LEU 144 3HD2 LEU 144 -7.697 5.770 -0.039 1060 HD22 LEU 144 1HD2 LEU 144 -9.151 5.225 -0.874 1061 HD23 LEU 144 2HD2 LEU 144 -7.569 5.019 -1.631 1062 H ASP 145 H ASP 145 -6.603 1.036 -3.901 1063 HA ASP 145 HA ASP 145 -8.187 -1.386 -4.229 1064 HB2 ASP 145 2HB ASP 145 -5.571 -0.373 -5.386 1065 HB3 ASP 145 1HB ASP 145 -6.067 -2.045 -5.629 1066 H PHE 146 H PHE 146 -8.151 -2.304 -2.077 1067 HA PHE 146 HA PHE 146 -5.626 -3.188 -0.892 1068 HB2 PHE 146 2HB PHE 146 -8.392 -4.266 -0.199 1069 HB3 PHE 146 1HB PHE 146 -6.949 -4.232 0.815 1070 HD1 PHE 146 HD2 PHE 146 -6.026 -1.461 0.548 1071 HD2 PHE 146 HD1 PHE 146 -9.986 -3.006 0.942 1072 HE1 PHE 146 HE2 PHE 146 -6.772 0.661 1.500 1073 HE2 PHE 146 HE1 PHE 146 -10.721 -0.876 1.899 1074 HZ PHE 146 HZ PHE 146 -9.110 0.960 2.176 1075 H ASN 147 H ASN 147 -7.867 -4.178 -3.215 1076 HA ASN 147 HA ASN 147 -7.237 -6.943 -3.464 1077 HB2 ASN 147 2HB ASN 147 -8.465 -6.715 -5.635 1078 HB3 ASN 147 1HB ASN 147 -9.365 -6.055 -4.274 1079 HD21 ASN 147 1HD2 ASN 147 -7.655 -5.272 -7.227 1080 HD22 ASN 147 2HD2 ASN 147 -8.178 -3.625 -7.319 1081 H LEU 148 H LEU 148 -5.209 -4.360 -3.906 1082 HA LEU 148 HA LEU 148 -3.489 -5.860 -5.778 1083 HB2 LEU 148 2HB LEU 148 -3.932 -2.838 -5.743 1084 HB3 LEU 148 1HB LEU 148 -2.700 -3.643 -6.699 1085 HG LEU 148 HG LEU 148 -5.718 -3.825 -7.088 1086 HD11 LEU 148 1HD1 LEU 148 -5.318 -2.733 -9.247 1087 HD12 LEU 148 2HD1 LEU 148 -3.590 -2.634 -8.896 1088 HD13 LEU 148 3HD1 LEU 148 -4.744 -1.729 -7.915 1089 HD21 LEU 148 3HD2 LEU 148 -4.733 -6.019 -7.555 1090 HD22 LEU 148 1HD2 LEU 148 -3.554 -5.280 -8.643 1091 HD23 LEU 148 2HD2 LEU 148 -5.274 -5.254 -9.045 1092 H ALA 149 H ALA 149 -3.689 -5.417 -2.676 1093 HA ALA 149 HA ALA 149 -1.452 -3.797 -1.920 1094 HB1 ALA 149 3HB ALA 149 -2.824 -5.968 -0.314 1095 HB2 ALA 149 1HB ALA 149 -3.290 -4.270 -0.362 1096 HB3 ALA 149 2HB ALA 149 -1.735 -4.739 0.329 1097 H TYR 150 H TYR 150 0.699 -4.324 -1.503 1098 HA TYR 150 HA TYR 150 1.566 -6.613 -3.167 1099 HB2 TYR 150 2HB TYR 150 3.233 -4.190 -2.389 1100 HB3 TYR 150 1HB TYR 150 3.517 -5.313 -3.715 1101 HD1 TYR 150 HD1 TYR 150 1.855 -5.283 -5.703 1102 HD2 TYR 150 HD2 TYR 150 1.918 -2.221 -2.721 1103 HE1 TYR 150 HE1 TYR 150 0.658 -3.768 -7.229 1104 HE2 TYR 150 HE2 TYR 150 0.725 -0.706 -4.244 1105 HH TYR 150 HH TYR 150 0.358 -0.422 -6.683 1106 H SER 151 H SER 151 3.497 -7.798 -2.681 1107 HA SER 151 HA SER 151 3.959 -8.846 -0.205 1108 HB2 SER 151 2HB SER 151 6.019 -8.523 -2.437 1109 HB3 SER 151 1HB SER 151 6.080 -9.710 -1.132 1110 HG SER 151 HG SER 151 4.020 -10.473 -1.974 1111 HA PRO 152 HA PRO 152 6.172 -5.303 1.761 1112 HB2 PRO 152 2HB PRO 152 5.920 -6.121 4.347 1113 HB3 PRO 152 1HB PRO 152 4.543 -5.451 3.444 1114 HG2 PRO 152 2HG PRO 152 5.222 -8.312 4.003 1115 HG3 PRO 152 1HG PRO 152 3.647 -7.492 4.092 1116 HD2 PRO 152 2HD PRO 152 4.431 -9.026 1.949 1117 HD3 PRO 152 1HD PRO 152 3.274 -7.686 1.822 1118 H PHE 153 H PHE 153 8.327 -5.167 1.694 1119 HA PHE 153 HA PHE 153 10.300 -6.992 1.579 1120 HB2 PHE 153 2HB PHE 153 10.591 -4.318 3.022 1121 HB3 PHE 153 1HB PHE 153 11.870 -5.216 2.207 1122 HD1 PHE 153 HD2 PHE 153 11.983 -5.252 -0.280 1123 HD2 PHE 153 HD1 PHE 153 8.991 -2.960 1.749 1124 HE1 PHE 153 HE2 PHE 153 11.516 -4.011 -2.352 1125 HE2 PHE 153 HE1 PHE 153 8.528 -1.731 -0.334 1126 HZ PHE 153 HZ PHE 153 9.788 -2.252 -2.382 1127 H CYS 154 H CYS 154 9.092 -5.518 4.544 1128 HA CYS 154 HA CYS 154 10.997 -6.431 6.363 1129 HB2 CYS 154 2HB CYS 154 9.297 -5.747 8.055 1130 HB3 CYS 154 1HB CYS 154 9.508 -4.548 6.783 1131 HG CYS 154 HG CYS 154 7.135 -4.789 5.639 1132 H ALA 155 H ALA 155 7.755 -7.741 5.623 1133 HA ALA 155 HA ALA 155 7.720 -9.805 7.509 1134 HB1 ALA 155 3HB ALA 155 6.328 -9.690 4.824 1135 HB2 ALA 155 1HB ALA 155 5.745 -8.988 6.335 1136 HB3 ALA 155 2HB ALA 155 5.890 -10.738 6.179 1137 H TYR 156 H TYR 156 8.931 -9.804 4.180 1138 HA TYR 156 HA TYR 156 9.523 -12.650 4.163 1139 HB2 TYR 156 2HB TYR 156 9.989 -10.433 2.145 1140 HB3 TYR 156 1HB TYR 156 10.541 -12.081 1.880 1141 HD1 TYR 156 HD1 TYR 156 7.497 -9.970 2.270 1142 HD2 TYR 156 HD2 TYR 156 8.992 -13.807 1.136 1143 HE1 TYR 156 HE1 TYR 156 5.335 -10.511 1.256 1144 HE2 TYR 156 HE2 TYR 156 6.819 -14.342 0.114 1145 HH TYR 156 HH TYR 156 4.522 -13.671 0.194 1146 H SER 157 H SER 157 11.256 -9.827 5.192 1147 HA SER 157 HA SER 157 13.628 -11.441 5.740 1148 HB2 SER 157 2HB SER 157 13.774 -8.963 3.977 1149 HB3 SER 157 1HB SER 157 15.180 -9.694 4.747 1150 HG SER 157 HG SER 157 13.462 -11.160 3.042 1151 H ASP 158 H ASP 158 14.317 -10.972 7.727 1152 HA ASP 158 HA ASP 158 13.170 -8.820 9.286 1153 HB2 ASP 158 2HB ASP 158 15.240 -10.931 10.031 1154 HB3 ASP 158 1HB ASP 158 14.517 -9.805 11.175 1155 H THR 159 H THR 159 15.849 -8.939 7.264 1156 HA THR 159 HA THR 159 17.548 -7.047 8.591 1157 HB THR 159 HB THR 159 18.417 -8.617 6.880 1158 HG1 THR 159 HG1 THR 159 19.388 -6.481 7.316 1159 HG21 THR 159 3HG2 THR 159 16.873 -6.933 4.869 1160 HG22 THR 159 1HG2 THR 159 16.521 -8.608 5.302 1161 HG23 THR 159 2HG2 THR 159 18.026 -8.209 4.476 1162 H PHE 160 H PHE 160 14.542 -6.750 6.999 1163 HA PHE 160 HA PHE 160 14.818 -3.800 6.787 1164 HB2 PHE 160 2HB PHE 160 12.541 -5.609 5.816 1165 HB3 PHE 160 1HB PHE 160 12.634 -3.867 5.599 1166 HD1 PHE 160 HD2 PHE 160 13.935 -7.136 4.454 1167 HD2 PHE 160 HD1 PHE 160 14.004 -2.910 3.809 1168 HE1 PHE 160 HE2 PHE 160 14.973 -7.486 2.248 1169 HE2 PHE 160 HE1 PHE 160 15.037 -3.274 1.613 1170 HZ PHE 160 HZ PHE 160 15.525 -5.552 0.825 1171 H SER 161 H SER 161 14.025 -2.759 8.650 1172 HA SER 161 HA SER 161 12.563 -4.203 10.671 1173 HB2 SER 161 2HB SER 161 13.046 -1.200 10.426 1174 HB3 SER 161 1HB SER 161 12.471 -2.042 11.867 1175 HG SER 161 HG SER 161 14.427 -3.060 12.042 1176 H CYS 162 H CYS 162 10.355 -4.128 11.116 1177 HA CYS 162 HA CYS 162 8.630 -3.921 8.897 1178 HB2 CYS 162 2HB CYS 162 8.293 -5.571 10.674 1179 HB3 CYS 162 1HB CYS 162 8.064 -4.293 11.861 1180 HG CYS 162 HG CYS 162 5.681 -3.372 10.631 1181 HA PRO 163 HA PRO 163 7.226 0.369 9.175 1182 HB2 PRO 163 2HB PRO 163 4.629 0.046 8.210 1183 HB3 PRO 163 1HB PRO 163 6.062 0.160 7.169 1184 HG2 PRO 163 2HG PRO 163 4.590 -2.281 8.087 1185 HG3 PRO 163 1HG PRO 163 5.249 -1.896 6.479 1186 HD2 PRO 163 2HD PRO 163 6.558 -3.555 8.149 1187 HD3 PRO 163 1HD PRO 163 7.439 -2.426 7.094 1188 H LEU 164 H LEU 164 5.710 1.641 10.441 1189 HA LEU 164 HA LEU 164 4.483 0.190 12.709 1190 HB2 LEU 164 2HB LEU 164 5.653 3.011 12.709 1191 HB3 LEU 164 1HB LEU 164 4.956 2.179 14.090 1192 HG LEU 164 HG LEU 164 7.517 1.362 12.664 1193 HD11 LEU 164 1HD1 LEU 164 7.828 3.456 13.875 1194 HD12 LEU 164 2HD1 LEU 164 8.700 2.149 14.671 1195 HD13 LEU 164 3HD1 LEU 164 7.178 2.732 15.349 1196 HD21 LEU 164 3HD2 LEU 164 6.260 0.199 15.183 1197 HD22 LEU 164 1HD2 LEU 164 7.848 -0.229 14.534 1198 HD23 LEU 164 2HD2 LEU 164 6.393 -0.602 13.615 1199 HA PRO 165 HA PRO 165 1.049 2.361 10.414 1200 HB2 PRO 165 2HB PRO 165 -0.616 0.044 11.282 1201 HB3 PRO 165 1HB PRO 165 -0.279 0.621 9.636 1202 HG2 PRO 165 2HG PRO 165 0.740 -1.701 10.542 1203 HG3 PRO 165 1HG PRO 165 1.639 -0.654 9.416 1204 HD2 PRO 165 2HD PRO 165 1.931 -0.872 12.418 1205 HD3 PRO 165 1HD PRO 165 3.193 -0.871 11.162 1206 HA PRO 166 HA PRO 166 -0.383 4.233 14.392 1207 HB2 PRO 166 2HB PRO 166 -2.519 5.535 12.961 1208 HB3 PRO 166 1HB PRO 166 -0.968 6.242 13.445 1209 HG2 PRO 166 2HG PRO 166 -1.766 5.071 10.825 1210 HG3 PRO 166 1HG PRO 166 -0.675 6.431 11.172 1211 HD2 PRO 166 2HD PRO 166 0.322 4.073 10.429 1212 HD3 PRO 166 1HD PRO 166 1.127 5.022 11.702 1213 H GLU 167 H GLU 167 -2.123 3.871 15.739 1214 HA GLU 167 HA GLU 167 -3.445 1.375 15.536 1215 HB2 GLU 167 2HB GLU 167 -3.939 3.683 17.463 1216 HB3 GLU 167 1HB GLU 167 -4.455 2.016 17.706 1217 HG2 GLU 167 2HG GLU 167 -2.176 1.261 17.914 1218 HG3 GLU 167 1HG GLU 167 -1.550 2.831 17.419 1219 H SER 168 H SER 168 -4.373 4.546 14.534 1220 HA SER 168 HA SER 168 -7.196 4.230 14.380 1221 HB2 SER 168 2HB SER 168 -5.358 6.146 12.877 1222 HB3 SER 168 1HB SER 168 -7.115 6.283 12.975 1223 HG SER 168 HG SER 168 -6.670 6.276 15.378 1224 H ASN 169 H ASN 169 -4.626 3.030 12.276 1225 HA ASN 169 HA ASN 169 -6.558 2.745 10.041 1226 HB2 ASN 169 2HB ASN 169 -4.828 2.843 8.444 1227 HB3 ASN 169 1HB ASN 169 -4.348 4.044 9.622 1228 HD21 ASN 169 1HD2 ASN 169 -3.645 0.876 8.326 1229 HD22 ASN 169 2HD2 ASN 169 -2.035 0.782 8.947 1230 H TRP 170 H TRP 170 -5.526 1.026 12.561 1231 HA TRP 170 HA TRP 170 -4.971 -1.544 11.382 1232 HB2 TRP 170 2HB TRP 170 -5.845 -0.757 14.195 1233 HB3 TRP 170 1HB TRP 170 -5.504 -2.416 13.716 1234 HD1 TRP 170 HD1 TRP 170 -2.860 -0.750 11.953 1235 HE1 TRP 170 HE1 TRP 170 -0.704 -0.592 13.345 1236 HE3 TRP 170 HE3 TRP 170 -4.797 -1.748 16.589 1237 HZ2 TRP 170 HZ2 TRP 170 0.084 -0.857 16.048 1238 HZ3 TRP 170 HZ3 TRP 170 -3.275 -1.787 18.523 1239 HH2 TRP 170 HH2 TRP 170 -0.883 -1.352 18.260 1240 H LEU 171 H LEU 171 -6.504 -2.565 10.166 1241 HA LEU 171 HA LEU 171 -9.295 -1.762 10.321 1242 HB2 LEU 171 2HB LEU 171 -7.900 -3.694 8.416 1243 HB3 LEU 171 1HB LEU 171 -9.560 -3.137 8.271 1244 HG LEU 171 HG LEU 171 -7.062 -1.422 7.958 1245 HD11 LEU 171 1HD1 LEU 171 -9.098 -2.312 5.881 1246 HD12 LEU 171 2HD1 LEU 171 -7.441 -2.905 6.034 1247 HD13 LEU 171 3HD1 LEU 171 -7.735 -1.225 5.592 1248 HD21 LEU 171 3HD2 LEU 171 -9.982 -0.590 7.743 1249 HD22 LEU 171 1HD2 LEU 171 -8.599 0.416 7.302 1250 HD23 LEU 171 2HD2 LEU 171 -8.832 -0.072 8.977 1251 H GLU 172 H GLU 172 -10.636 -2.811 11.661 1252 HA GLU 172 HA GLU 172 -10.062 -5.480 12.682 1253 HB2 GLU 172 2HB GLU 172 -10.925 -3.598 14.134 1254 HB3 GLU 172 1HB GLU 172 -12.439 -3.639 13.239 1255 HG2 GLU 172 2HG GLU 172 -12.692 -4.782 15.365 1256 HG3 GLU 172 1HG GLU 172 -12.850 -5.932 14.039 1257 H THR 173 H THR 173 -10.238 -5.839 10.138 1258 HA THR 173 HA THR 173 -12.505 -7.560 9.712 1259 HB THR 173 HB THR 173 -13.419 -5.402 8.861 1260 HG1 THR 173 HG1 THR 173 -14.202 -7.107 7.760 1261 HG21 THR 173 3HG2 THR 173 -11.322 -4.271 8.179 1262 HG22 THR 173 1HG2 THR 173 -12.491 -4.318 6.858 1263 HG23 THR 173 2HG2 THR 173 -11.123 -5.432 6.863 1264 H ALA 174 H ALA 174 -12.125 -8.902 7.753 1265 HA ALA 174 HA ALA 174 -9.261 -9.374 7.278 1266 HB1 ALA 174 3HB ALA 174 -10.652 -11.294 7.970 1267 HB2 ALA 174 1HB ALA 174 -10.009 -11.536 6.343 1268 HB3 ALA 174 2HB ALA 174 -11.694 -11.060 6.565 1269 H VAL 175 H VAL 175 -8.332 -8.708 5.426 1270 HA VAL 175 HA VAL 175 -9.915 -7.707 3.181 1271 HB VAL 175 HB VAL 175 -6.877 -7.816 3.572 1272 HG11 VAL 175 1HG1 VAL 175 -6.717 -6.356 1.564 1273 HG12 VAL 175 2HG1 VAL 175 -8.458 -6.512 1.315 1274 HG13 VAL 175 3HG1 VAL 175 -7.415 -7.930 1.175 1275 HG21 VAL 175 3HG2 VAL 175 -7.051 -5.351 3.869 1276 HG22 VAL 175 1HG2 VAL 175 -7.975 -6.219 5.095 1277 HG23 VAL 175 2HG2 VAL 175 -8.808 -5.457 3.738 1278 H THR 176 H THR 176 -10.919 -9.719 2.697 1279 HA THR 176 HA THR 176 -9.280 -11.647 1.229 1280 HB THR 176 HB THR 176 -11.568 -12.812 0.983 1281 HG1 THR 176 HG1 THR 176 -12.955 -11.949 2.913 1282 HG21 THR 176 3HG2 THR 176 -9.946 -13.580 2.663 1283 HG22 THR 176 1HG2 THR 176 -11.586 -13.671 3.309 1284 HG23 THR 176 2HG2 THR 176 -10.516 -12.356 3.800 1285 H ALA 177 H ALA 177 -8.738 -10.868 -0.724 1286 HA ALA 177 HA ALA 177 -10.854 -10.105 -2.619 1287 HB1 ALA 177 3HB ALA 177 -8.284 -8.523 -2.217 1288 HB2 ALA 177 1HB ALA 177 -9.904 -7.996 -1.754 1289 HB3 ALA 177 2HB ALA 177 -9.506 -8.223 -3.457 1290 H GLY 178 H GLY 178 -10.683 -11.377 -4.341 1291 HA2 GLY 178 2HA GLY 178 -9.983 -13.133 -5.669 1292 HA3 GLY 178 1HA GLY 178 -8.590 -12.093 -5.915 1293 H GLU 179 H GLU 179 -7.307 -14.044 -6.203 1294 HA GLU 179 HA GLU 179 -6.497 -15.702 -4.038 1295 HB2 GLU 179 2HB GLU 179 -5.856 -16.309 -6.304 1296 HB3 GLU 179 1HB GLU 179 -5.102 -14.747 -6.586 1297 HG2 GLU 179 2HG GLU 179 -3.429 -16.506 -6.353 1298 HG3 GLU 179 1HG GLU 179 -3.268 -15.326 -5.058 1299 H ARG 180 H ARG 180 -4.811 -15.339 -2.485 1300 HA ARG 180 HA ARG 180 -4.345 -12.453 -1.912 1301 HB2 ARG 180 2HB ARG 180 -4.779 -14.785 0.010 1302 HB3 ARG 180 1HB ARG 180 -4.417 -13.131 0.495 1303 HG2 ARG 180 2HG ARG 180 -6.586 -12.386 -0.431 1304 HG3 ARG 180 1HG ARG 180 -6.941 -14.045 -0.928 1305 HD2 ARG 180 2HD ARG 180 -8.040 -13.375 1.229 1306 HD3 ARG 180 1HD ARG 180 -7.003 -14.797 1.380 1307 HE ARG 180 HE ARG 180 -6.452 -12.085 2.407 1308 HH11 ARG 180 1HH1 ARG 180 -5.534 -15.484 2.335 1309 HH12 ARG 180 2HH1 ARG 180 -4.392 -15.318 3.629 1310 HH21 ARG 180 1HH2 ARG 180 -4.831 -11.878 3.996 1311 HH22 ARG 180 2HH2 ARG 180 -3.994 -13.287 4.564 1312 H THR 181 H THR 181 -1.970 -11.976 -1.921 1313 HA THR 181 HA THR 181 0.092 -13.427 -1.314 1314 HB THR 181 HB THR 181 0.327 -11.036 -1.348 1315 HG1 THR 181 HG1 THR 181 2.064 -11.830 -0.326 1316 HG21 THR 181 3HG2 THR 181 -0.290 -9.553 0.520 1317 HG22 THR 181 1HG2 THR 181 -1.034 -10.906 1.366 1318 HG23 THR 181 2HG2 THR 181 -1.719 -10.338 -0.160 1319 H ASP 182 H ASP 182 0.492 -15.070 -0.094 1320 HA ASP 182 HA ASP 182 -0.110 -15.482 2.649 1321 HB2 ASP 182 2HB ASP 182 -2.417 -15.782 1.443 1322 HB3 ASP 182 1HB ASP 182 -1.746 -17.272 0.794 1323 H LEU 183 H LEU 183 0.810 -17.501 3.346 1324 HA LEU 183 HA LEU 183 3.169 -18.107 1.847 1325 HB2 LEU 183 2HB LEU 183 3.906 -19.433 3.715 1326 HB3 LEU 183 1HB LEU 183 3.262 -17.913 4.291 1327 HG LEU 183 HG LEU 183 1.653 -20.493 4.407 1328 HD11 LEU 183 1HD1 LEU 183 2.358 -20.754 6.749 1329 HD12 LEU 183 2HD1 LEU 183 3.459 -19.384 6.582 1330 HD13 LEU 183 3HD1 LEU 183 3.736 -20.858 5.653 1331 HD21 LEU 183 3HD2 LEU 183 0.401 -19.342 6.216 1332 HD22 LEU 183 1HD2 LEU 183 0.282 -18.477 4.686 1333 HD23 LEU 183 2HD2 LEU 183 1.361 -17.884 5.952 1334 H GLU 184 H GLU 184 0.117 -19.830 2.430 1335 HA GLU 184 HA GLU 184 0.946 -21.896 0.472 1336 HB2 GLU 184 2HB GLU 184 -0.390 -22.474 3.151 1337 HB3 GLU 184 1HB GLU 184 -0.182 -23.666 1.874 1338 HG2 GLU 184 2HG GLU 184 2.277 -23.460 2.097 1339 HG3 GLU 184 1HG GLU 184 2.059 -22.268 3.375 1340 H HIS 185 H HIS 185 -0.595 -22.354 -1.025 1341 HA HIS 185 HA HIS 185 -3.407 -22.121 -0.551 1342 HB2 HIS 185 2HB HIS 185 -3.796 -20.428 -2.467 1343 HB3 HIS 185 1HB HIS 185 -3.220 -19.780 -0.940 1344 HD1 HIS 185 HD1 HIS 185 -2.246 -20.196 -4.511 1345 HD2 HIS 185 HD2 HIS 185 -0.582 -18.732 -0.999 1346 HE1 HIS 185 HE1 HIS 185 -0.214 -18.908 -5.215 1347 HE2 HIS 185 HE2 HIS 185 0.658 -17.872 -3.101 Start of MODEL 12 1 H1 MET 1 1H MET 1 -16.629 7.269 -16.203 2 H2 MET 1 2H MET 1 -16.866 8.878 -16.664 3 H3 MET 1 3H MET 1 -15.301 8.297 -16.397 4 HA MET 1 HA MET 1 -17.128 7.366 -18.523 5 HB2 MET 1 2HB MET 1 -14.627 9.112 -18.692 6 HB3 MET 1 1HB MET 1 -15.521 8.493 -20.077 7 HG2 MET 1 2HG MET 1 -17.473 9.817 -19.446 8 HG3 MET 1 1HG MET 1 -16.650 10.381 -17.996 9 HE1 MET 1 3HE MET 1 -15.656 11.723 -22.313 10 HE2 MET 1 1HE MET 1 -17.008 10.675 -21.878 11 HE3 MET 1 2HE MET 1 -15.351 10.067 -21.797 12 H ASP 2 H ASP 2 -15.923 6.008 -20.133 13 HA ASP 2 HA ASP 2 -14.999 3.677 -18.977 14 HB2 ASP 2 2HB ASP 2 -14.445 4.677 -21.816 15 HB3 ASP 2 1HB ASP 2 -14.141 3.026 -21.273 16 H GLU 3 H GLU 3 -13.065 6.154 -20.587 17 HA GLU 3 HA GLU 3 -10.518 5.343 -20.450 18 HB2 GLU 3 2HB GLU 3 -11.512 8.155 -19.828 19 HB3 GLU 3 1HB GLU 3 -9.875 7.754 -20.345 20 HG2 GLU 3 2HG GLU 3 -10.617 7.096 -22.518 21 HG3 GLU 3 1HG GLU 3 -12.309 7.104 -22.019 22 H ASP 4 H ASP 4 -11.935 7.296 -17.785 23 HA ASP 4 HA ASP 4 -9.594 6.937 -16.135 24 HB2 ASP 4 2HB ASP 4 -10.717 8.389 -14.511 25 HB3 ASP 4 1HB ASP 4 -10.868 9.070 -16.124 26 H THR 5 H THR 5 -12.435 5.107 -16.576 27 HA THR 5 HA THR 5 -12.582 3.917 -13.928 28 HB THR 5 HB THR 5 -13.940 3.071 -16.538 29 HG1 THR 5 HG1 THR 5 -15.215 4.677 -16.088 30 HG21 THR 5 3HG2 THR 5 -14.588 2.253 -13.670 31 HG22 THR 5 1HG2 THR 5 -13.903 1.189 -14.902 32 HG23 THR 5 2HG2 THR 5 -15.534 1.831 -15.099 33 H GLU 6 H GLU 6 -11.778 2.627 -17.201 34 HA GLU 6 HA GLU 6 -10.659 0.191 -16.224 35 HB2 GLU 6 2HB GLU 6 -9.972 -0.237 -18.540 36 HB3 GLU 6 1HB GLU 6 -11.625 0.369 -18.493 37 HG2 GLU 6 2HG GLU 6 -10.808 2.610 -19.155 38 HG3 GLU 6 1HG GLU 6 -9.166 1.975 -19.220 39 H ASP 7 H ASP 7 -9.310 3.360 -16.865 40 HA ASP 7 HA ASP 7 -6.615 3.036 -16.910 41 HB2 ASP 7 2HB ASP 7 -7.764 5.235 -16.928 42 HB3 ASP 7 1HB ASP 7 -8.040 5.116 -15.191 43 H TRP 8 H TRP 8 -8.658 2.465 -14.141 44 HA TRP 8 HA TRP 8 -7.022 2.250 -11.967 45 HB2 TRP 8 2HB TRP 8 -9.398 1.893 -11.780 46 HB3 TRP 8 1HB TRP 8 -9.355 0.514 -12.869 47 HD1 TRP 8 HD1 TRP 8 -8.171 1.457 -9.276 48 HE1 TRP 8 HE1 TRP 8 -8.191 -0.683 -7.861 49 HE3 TRP 8 HE3 TRP 8 -9.378 -1.933 -12.921 50 HZ2 TRP 8 HZ2 TRP 8 -8.699 -3.426 -8.212 51 HZ3 TRP 8 HZ3 TRP 8 -9.633 -4.297 -12.286 52 HH2 TRP 8 HH2 TRP 8 -9.302 -5.026 -9.981 53 H GLU 9 H GLU 9 -7.559 -0.381 -14.376 54 HA GLU 9 HA GLU 9 -5.415 -2.007 -13.263 55 HB2 GLU 9 2HB GLU 9 -5.979 -3.657 -14.992 56 HB3 GLU 9 1HB GLU 9 -7.438 -3.118 -14.166 57 HG2 GLU 9 2HG GLU 9 -8.046 -1.711 -16.051 58 HG3 GLU 9 1HG GLU 9 -6.518 -2.069 -16.853 59 H THR 10 H THR 10 -5.747 0.359 -15.794 60 HA THR 10 HA THR 10 -3.628 -0.454 -17.513 61 HB THR 10 HB THR 10 -4.821 2.332 -17.133 62 HG1 THR 10 HG1 THR 10 -5.708 0.031 -18.475 63 HG21 THR 10 3HG2 THR 10 -4.141 2.718 -19.489 64 HG22 THR 10 1HG2 THR 10 -3.341 1.145 -19.514 65 HG23 THR 10 2HG2 THR 10 -2.747 2.422 -18.447 66 H GLN 11 H GLN 11 -3.769 2.166 -15.029 67 HA GLN 11 HA GLN 11 -1.011 2.642 -14.951 68 HB2 GLN 11 2HB GLN 11 -1.376 3.816 -12.850 69 HB3 GLN 11 1HB GLN 11 -2.635 4.234 -14.005 70 HG2 GLN 11 2HG GLN 11 -4.249 2.872 -12.830 71 HG3 GLN 11 1HG GLN 11 -3.002 2.226 -11.763 72 HE21 GLN 11 1HE2 GLN 11 -4.905 5.082 -12.556 73 HE22 GLN 11 2HE2 GLN 11 -4.634 5.896 -11.051 74 H LEU 12 H LEU 12 -3.052 0.265 -13.266 75 HA LEU 12 HA LEU 12 -1.370 -0.502 -11.173 76 HB2 LEU 12 2HB LEU 12 -3.663 -1.218 -11.201 77 HB3 LEU 12 1HB LEU 12 -3.451 -2.054 -12.730 78 HG LEU 12 HG LEU 12 -1.937 -3.704 -11.562 79 HD11 LEU 12 1HD1 LEU 12 -2.857 -2.357 -9.008 80 HD12 LEU 12 2HD1 LEU 12 -1.218 -2.359 -9.665 81 HD13 LEU 12 3HD1 LEU 12 -1.946 -3.868 -9.123 82 HD21 LEU 12 3HD2 LEU 12 -4.772 -3.539 -10.499 83 HD22 LEU 12 1HD2 LEU 12 -3.748 -4.979 -10.505 84 HD23 LEU 12 2HD2 LEU 12 -4.265 -4.261 -12.028 85 H GLN 13 H GLN 13 -1.577 -1.854 -14.482 86 HA GLN 13 HA GLN 13 0.269 -3.965 -14.061 87 HB2 GLN 13 2HB GLN 13 0.281 -4.224 -16.549 88 HB3 GLN 13 1HB GLN 13 -1.326 -4.181 -15.853 89 HG2 GLN 13 2HG GLN 13 -1.528 -2.936 -17.814 90 HG3 GLN 13 1HG GLN 13 -1.400 -1.713 -16.559 91 HE21 GLN 13 1HE2 GLN 13 0.250 -3.259 -19.245 92 HE22 GLN 13 2HE2 GLN 13 1.456 -2.038 -19.460 93 H ALA 14 H ALA 14 0.823 -0.630 -14.390 94 HA ALA 14 HA ALA 14 3.658 -0.936 -15.142 95 HB1 ALA 14 3HB ALA 14 2.352 0.806 -16.287 96 HB2 ALA 14 1HB ALA 14 3.643 1.527 -15.321 97 HB3 ALA 14 2HB ALA 14 1.974 1.563 -14.739 98 H ASN 15 H ASN 15 1.587 0.323 -12.551 99 HA ASN 15 HA ASN 15 3.446 1.140 -10.647 100 HB2 ASN 15 2HB ASN 15 0.615 0.042 -10.301 101 HB3 ASN 15 1HB ASN 15 1.554 0.701 -8.964 102 HD21 ASN 15 1HD2 ASN 15 -0.070 2.292 -8.647 103 HD22 ASN 15 2HD2 ASN 15 -0.185 3.674 -9.678 104 H ARG 16 H ARG 16 2.315 -2.104 -11.407 105 HA ARG 16 HA ARG 16 3.977 -3.234 -9.244 106 HB2 ARG 16 2HB ARG 16 2.760 -5.295 -9.462 107 HB3 ARG 16 1HB ARG 16 1.600 -3.979 -9.346 108 HG2 ARG 16 2HG ARG 16 1.278 -4.092 -11.817 109 HG3 ARG 16 1HG ARG 16 2.380 -5.468 -11.873 110 HD2 ARG 16 2HD ARG 16 0.859 -6.726 -10.376 111 HD3 ARG 16 1HD ARG 16 -0.252 -5.349 -10.362 112 HE ARG 16 HE ARG 16 0.285 -6.207 -13.022 113 HH11 ARG 16 1HH1 ARG 16 -1.580 -7.113 -10.179 114 HH12 ARG 16 2HH1 ARG 16 -2.775 -7.972 -11.099 115 HH21 ARG 16 1HH2 ARG 16 -1.267 -7.346 -14.205 116 HH22 ARG 16 2HH2 ARG 16 -2.597 -8.103 -13.385 117 H ASP 17 H ASP 17 3.938 -2.756 -12.665 118 HA ASP 17 HA ASP 17 5.732 -4.805 -13.481 119 HB2 ASP 17 2HB ASP 17 4.519 -3.495 -15.139 120 HB3 ASP 17 1HB ASP 17 5.300 -2.011 -14.615 121 H GLU 18 H GLU 18 6.240 -1.509 -12.309 122 HA GLU 18 HA GLU 18 9.077 -1.519 -12.351 123 HB2 GLU 18 2HB GLU 18 8.956 0.377 -10.780 124 HB3 GLU 18 1HB GLU 18 7.858 0.590 -12.135 125 HG2 GLU 18 2HG GLU 18 5.955 0.367 -10.823 126 HG3 GLU 18 1HG GLU 18 6.773 -0.593 -9.598 127 H LYS 19 H LYS 19 6.687 -2.677 -10.045 128 HA LYS 19 HA LYS 19 8.526 -3.372 -7.951 129 HB2 LYS 19 2HB LYS 19 5.594 -3.646 -8.433 130 HB3 LYS 19 1HB LYS 19 6.281 -4.878 -7.400 131 HG2 LYS 19 2HG LYS 19 5.377 -3.107 -6.038 132 HG3 LYS 19 1HG LYS 19 7.136 -3.107 -5.875 133 HD2 LYS 19 2HD LYS 19 7.275 -1.213 -7.464 134 HD3 LYS 19 1HD LYS 19 5.520 -1.230 -7.635 135 HE2 LYS 19 2HE LYS 19 5.309 -0.703 -5.207 136 HE3 LYS 19 1HE LYS 19 7.071 -0.599 -5.102 137 HZ1 LYS 19 3HZ LYS 19 6.071 1.584 -5.368 138 HZ2 LYS 19 1HZ LYS 19 5.331 1.099 -6.809 139 HZ3 LYS 19 2HZ LYS 19 7.013 1.205 -6.722 140 H ASP 20 H ASP 20 7.381 -4.949 -10.833 141 HA ASP 20 HA ASP 20 8.015 -7.656 -10.100 142 HB2 ASP 20 2HB ASP 20 6.304 -7.246 -11.792 143 HB3 ASP 20 1HB ASP 20 7.446 -6.385 -12.814 144 H ARG 21 H ARG 21 9.593 -5.175 -12.128 145 HA ARG 21 HA ARG 21 11.989 -6.709 -12.605 146 HB2 ARG 21 2HB ARG 21 12.932 -4.612 -13.530 147 HB3 ARG 21 1HB ARG 21 11.351 -4.967 -14.210 148 HG2 ARG 21 2HG ARG 21 10.308 -3.186 -13.083 149 HG3 ARG 21 1HG ARG 21 11.575 -3.076 -11.863 150 HD2 ARG 21 2HD ARG 21 11.585 -1.163 -13.463 151 HD3 ARG 21 1HD ARG 21 13.100 -2.065 -13.453 152 HE ARG 21 HE ARG 21 12.704 -2.783 -15.600 153 HH11 ARG 21 1HH1 ARG 21 9.831 -1.093 -14.449 154 HH12 ARG 21 2HH1 ARG 21 9.125 -0.990 -16.031 155 HH21 ARG 21 1HH2 ARG 21 11.798 -2.574 -17.644 156 HH22 ARG 21 2HH2 ARG 21 10.246 -1.829 -17.844 157 H PHE 22 H PHE 22 10.848 -4.587 -10.130 158 HA PHE 22 HA PHE 22 13.078 -3.487 -8.928 159 HB2 PHE 22 2HB PHE 22 10.403 -3.507 -8.354 160 HB3 PHE 22 1HB PHE 22 10.939 -4.599 -7.095 161 HD1 PHE 22 HD1 PHE 22 11.554 -1.220 -8.548 162 HD2 PHE 22 HD2 PHE 22 11.757 -3.699 -5.078 163 HE1 PHE 22 HE1 PHE 22 12.095 0.741 -7.176 164 HE2 PHE 22 HE2 PHE 22 12.299 -1.742 -3.724 165 HZ PHE 22 HZ PHE 22 12.471 0.482 -4.755 166 H PHE 23 H PHE 23 11.500 -6.552 -8.032 167 HA PHE 23 HA PHE 23 13.445 -7.386 -6.136 168 HB2 PHE 23 2HB PHE 23 11.162 -8.822 -7.538 169 HB3 PHE 23 1HB PHE 23 12.238 -9.675 -6.436 170 HD1 PHE 23 HD2 PHE 23 11.334 -6.166 -5.705 171 HD2 PHE 23 HD1 PHE 23 10.337 -10.268 -4.997 172 HE1 PHE 23 HE2 PHE 23 9.963 -5.511 -3.783 173 HE2 PHE 23 HE1 PHE 23 8.964 -9.589 -3.068 174 HZ PHE 23 HZ PHE 23 8.785 -7.206 -2.458 175 H SER 24 H SER 24 13.639 -7.406 -9.511 176 HA SER 24 HA SER 24 15.461 -9.685 -9.690 177 HB2 SER 24 2HB SER 24 13.720 -9.342 -11.446 178 HB3 SER 24 1HB SER 24 14.435 -7.782 -11.853 179 HG SER 24 HG SER 24 16.265 -8.826 -12.572 180 H GLU 25 H GLU 25 15.509 -6.072 -10.174 181 HA GLU 25 HA GLU 25 18.395 -6.227 -10.825 182 HB2 GLU 25 2HB GLU 25 16.369 -4.093 -11.629 183 HB3 GLU 25 1HB GLU 25 18.045 -4.185 -12.147 184 HG2 GLU 25 2HG GLU 25 15.886 -6.197 -12.839 185 HG3 GLU 25 1HG GLU 25 16.447 -4.900 -13.895 186 H HIS 26 H HIS 26 15.937 -4.331 -9.025 187 HA HIS 26 HA HIS 26 17.907 -2.422 -8.016 188 HB2 HIS 26 2HB HIS 26 15.675 -1.563 -8.602 189 HB3 HIS 26 1HB HIS 26 14.899 -2.695 -7.500 190 HD2 HIS 26 HD2 HIS 26 16.257 0.882 -7.492 191 HE1 HIS 26 HE1 HIS 26 15.621 -0.243 -3.465 192 HE2 HIS 26 HE2 HIS 26 16.331 1.641 -5.009 193 H ARG 27 H ARG 27 15.552 -4.658 -6.541 194 HA ARG 27 HA ARG 27 17.182 -4.930 -4.105 195 HB2 ARG 27 2HB ARG 27 14.211 -5.365 -4.631 196 HB3 ARG 27 1HB ARG 27 14.996 -5.841 -3.134 197 HG2 ARG 27 2HG ARG 27 14.762 -3.019 -4.186 198 HG3 ARG 27 1HG ARG 27 13.757 -3.734 -2.929 199 HD2 ARG 27 2HD ARG 27 15.337 -2.478 -1.747 200 HD3 ARG 27 1HD ARG 27 15.953 -4.126 -1.641 201 HE ARG 27 HE ARG 27 17.090 -2.667 -3.838 202 HH11 ARG 27 1HH1 ARG 27 17.327 -3.131 -0.350 203 HH12 ARG 27 2HH1 ARG 27 18.990 -2.645 -0.274 204 HH21 ARG 27 1HH2 ARG 27 19.269 -2.029 -3.714 205 HH22 ARG 27 2HH2 ARG 27 20.098 -2.018 -2.192 206 H GLN 28 H GLN 28 17.586 -7.015 -3.313 207 HA GLN 28 HA GLN 28 17.234 -9.350 -5.032 208 HB2 GLN 28 2HB GLN 28 18.133 -9.193 -2.107 209 HB3 GLN 28 1HB GLN 28 18.318 -10.581 -3.179 210 HG2 GLN 28 2HG GLN 28 19.671 -7.890 -3.513 211 HG3 GLN 28 1HG GLN 28 20.430 -9.350 -2.880 212 HE21 GLN 28 1HE2 GLN 28 19.199 -7.776 -5.764 213 HE22 GLN 28 2HE2 GLN 28 19.940 -8.845 -6.900 214 H SER 29 H SER 29 15.469 -10.715 -4.912 215 HA SER 29 HA SER 29 13.078 -9.946 -3.744 216 HB2 SER 29 2HB SER 29 12.293 -12.312 -4.268 217 HB3 SER 29 1HB SER 29 13.093 -11.512 -5.620 218 HG SER 29 HG SER 29 14.447 -13.260 -3.834 219 HA PRO 30 HA PRO 30 13.940 -11.034 0.593 220 HB2 PRO 30 2HB PRO 30 11.153 -10.126 1.145 221 HB3 PRO 30 1HB PRO 30 12.691 -9.441 1.707 222 HG2 PRO 30 2HG PRO 30 11.187 -8.156 -0.100 223 HG3 PRO 30 1HG PRO 30 12.964 -8.109 -0.157 224 HD2 PRO 30 2HD PRO 30 11.079 -9.816 -1.779 225 HD3 PRO 30 1HD PRO 30 12.478 -8.857 -2.318 226 H ILE 31 H ILE 31 11.340 -12.287 -1.338 227 HA ILE 31 HA ILE 31 10.321 -14.258 0.411 228 HB ILE 31 HB ILE 31 10.589 -14.754 -2.590 229 HG12 ILE 31 2HG1 ILE 31 9.814 -12.406 -2.399 230 HG13 ILE 31 1HG1 ILE 31 8.552 -13.436 -3.057 231 HG21 ILE 31 1HG2 ILE 31 8.398 -15.464 -0.603 232 HG22 ILE 31 2HG2 ILE 31 9.615 -16.559 -1.258 233 HG23 ILE 31 3HG2 ILE 31 8.393 -15.871 -2.325 234 HD11 ILE 31 3HD1 ILE 31 7.451 -13.438 -0.858 235 HD12 ILE 31 1HD1 ILE 31 7.647 -11.814 -1.521 236 HD13 ILE 31 2HD1 ILE 31 8.720 -12.380 -0.242 237 HA PRO 32 HA PRO 32 14.319 -16.460 0.853 238 HB2 PRO 32 2HB PRO 32 13.144 -18.785 2.029 239 HB3 PRO 32 1HB PRO 32 13.803 -17.385 2.892 240 HG2 PRO 32 2HG PRO 32 10.972 -18.021 2.231 241 HG3 PRO 32 1HG PRO 32 11.645 -17.179 3.639 242 HD2 PRO 32 2HD PRO 32 10.385 -15.829 1.681 243 HD3 PRO 32 1HD PRO 32 11.781 -15.141 2.541 244 HA PRO 33 HA PRO 33 14.772 -18.644 -3.004 245 HB2 PRO 33 2HB PRO 33 16.553 -20.684 -1.943 246 HB3 PRO 33 1HB PRO 33 16.969 -19.225 -2.852 247 HG2 PRO 33 2HG PRO 33 17.016 -19.683 0.069 248 HG3 PRO 33 1HG PRO 33 17.946 -18.531 -0.911 249 HD2 PRO 33 2HD PRO 33 15.955 -17.709 0.699 250 HD3 PRO 33 1HD PRO 33 16.275 -16.921 -0.862 251 H GLU 34 H GLU 34 14.217 -20.799 -0.204 252 HA GLU 34 HA GLU 34 13.339 -23.021 -1.810 253 HB2 GLU 34 2HB GLU 34 12.814 -24.111 0.334 254 HB3 GLU 34 1HB GLU 34 14.404 -23.362 0.390 255 HG2 GLU 34 2HG GLU 34 13.312 -21.407 1.601 256 HG3 GLU 34 1HG GLU 34 11.855 -22.390 1.709 257 H GLU 35 H GLU 35 11.690 -20.513 0.104 258 HA GLU 35 HA GLU 35 9.038 -21.375 -0.159 259 HB2 GLU 35 2HB GLU 35 9.799 -19.766 1.526 260 HB3 GLU 35 1HB GLU 35 10.181 -18.585 0.279 261 HG2 GLU 35 2HG GLU 35 7.848 -18.283 -0.241 262 HG3 GLU 35 1HG GLU 35 7.384 -19.629 0.797 263 H ARG 36 H ARG 36 10.919 -19.043 -2.157 264 HA ARG 36 HA ARG 36 8.735 -18.267 -3.794 265 HB2 ARG 36 2HB ARG 36 10.398 -17.035 -5.096 266 HB3 ARG 36 1HB ARG 36 10.696 -16.818 -3.375 267 HG2 ARG 36 2HG ARG 36 12.494 -18.556 -3.529 268 HG3 ARG 36 1HG ARG 36 12.241 -18.598 -5.275 269 HD2 ARG 36 2HD ARG 36 13.133 -16.195 -3.649 270 HD3 ARG 36 1HD ARG 36 14.152 -17.171 -4.708 271 HE ARG 36 HE ARG 36 11.991 -15.348 -5.558 272 HH11 ARG 36 1HH1 ARG 36 14.861 -17.204 -6.402 273 HH12 ARG 36 2HH1 ARG 36 14.995 -16.489 -7.976 274 HH21 ARG 36 1HH2 ARG 36 12.193 -14.419 -7.592 275 HH22 ARG 36 2HH2 ARG 36 13.478 -14.908 -8.646 276 H ASP 37 H ASP 37 10.452 -21.168 -3.804 277 HA ASP 37 HA ASP 37 10.278 -21.821 -6.576 278 HB2 ASP 37 2HB ASP 37 11.721 -23.090 -5.003 279 HB3 ASP 37 1HB ASP 37 10.294 -23.680 -4.148 280 H ASP 38 H ASP 38 8.139 -22.440 -3.780 281 HA ASP 38 HA ASP 38 6.053 -23.611 -5.463 282 HB2 ASP 38 2HB ASP 38 6.147 -23.084 -2.464 283 HB3 ASP 38 1HB ASP 38 4.807 -23.881 -3.293 284 H PHE 39 H PHE 39 6.649 -20.627 -3.725 285 HA PHE 39 HA PHE 39 4.029 -19.534 -4.544 286 HB2 PHE 39 2HB PHE 39 5.988 -18.468 -2.452 287 HB3 PHE 39 1HB PHE 39 4.397 -17.797 -2.820 288 HD1 PHE 39 HD2 PHE 39 2.388 -19.593 -2.674 289 HD2 PHE 39 HD1 PHE 39 6.120 -19.937 -0.611 290 HE1 PHE 39 HE2 PHE 39 1.349 -21.106 -1.026 291 HE2 PHE 39 HE1 PHE 39 5.073 -21.456 1.019 292 HZ PHE 39 HZ PHE 39 2.687 -22.029 0.814 293 H ASP 40 H ASP 40 3.942 -17.722 -5.809 294 HA ASP 40 HA ASP 40 6.078 -17.302 -7.653 295 HB2 ASP 40 2HB ASP 40 3.561 -15.631 -7.288 296 HB3 ASP 40 1HB ASP 40 4.567 -15.703 -8.729 297 H GLY 41 H GLY 41 6.970 -15.138 -8.158 298 HA2 GLY 41 2HA GLY 41 8.057 -13.373 -6.381 299 HA3 GLY 41 1HA GLY 41 7.464 -12.908 -7.967 300 H LEU 42 H LEU 42 6.640 -10.891 -7.447 301 HA LEU 42 HA LEU 42 4.962 -10.435 -5.120 302 HB2 LEU 42 2HB LEU 42 5.806 -8.680 -7.427 303 HB3 LEU 42 1HB LEU 42 4.451 -8.180 -6.419 304 HG LEU 42 HG LEU 42 7.260 -8.766 -5.400 305 HD11 LEU 42 1HD1 LEU 42 5.878 -6.102 -5.753 306 HD12 LEU 42 2HD1 LEU 42 7.217 -6.729 -6.716 307 HD13 LEU 42 3HD1 LEU 42 7.459 -6.371 -5.010 308 HD21 LEU 42 3HD2 LEU 42 6.491 -7.842 -3.245 309 HD22 LEU 42 1HD2 LEU 42 5.575 -9.281 -3.691 310 HD23 LEU 42 2HD2 LEU 42 4.854 -7.682 -3.887 311 H SER 43 H SER 43 3.607 -12.174 -5.503 312 HA SER 43 HA SER 43 1.211 -11.625 -7.145 313 HB2 SER 43 2HB SER 43 0.685 -14.068 -6.733 314 HB3 SER 43 1HB SER 43 2.178 -13.837 -7.640 315 HG SER 43 HG SER 43 3.329 -14.165 -5.672 316 H TYR 44 H TYR 44 -0.814 -11.730 -5.961 317 HA TYR 44 HA TYR 44 -0.771 -11.511 -3.080 318 HB2 TYR 44 2HB TYR 44 -1.216 -9.038 -3.037 319 HB3 TYR 44 1HB TYR 44 0.402 -9.438 -3.588 320 HD1 TYR 44 HD2 TYR 44 1.060 -9.009 -5.984 321 HD2 TYR 44 HD1 TYR 44 -2.834 -7.969 -4.556 322 HE1 TYR 44 HE2 TYR 44 0.695 -7.598 -7.974 323 HE2 TYR 44 HE1 TYR 44 -3.183 -6.564 -6.533 324 HH TYR 44 HH TYR 44 -1.890 -5.379 -8.198 325 H PHE 45 H PHE 45 -2.900 -9.933 -2.615 326 HA PHE 45 HA PHE 45 -5.226 -11.385 -3.120 327 HB2 PHE 45 2HB PHE 45 -5.010 -8.371 -2.604 328 HB3 PHE 45 1HB PHE 45 -6.455 -9.342 -2.378 329 HD1 PHE 45 HD1 PHE 45 -6.579 -10.967 -0.482 330 HD2 PHE 45 HD2 PHE 45 -3.273 -8.292 -0.915 331 HE1 PHE 45 HE1 PHE 45 -5.947 -11.365 1.858 332 HE2 PHE 45 HE2 PHE 45 -2.653 -8.699 1.429 333 HZ PHE 45 HZ PHE 45 -3.979 -10.239 2.816 334 H ASP 46 H ASP 46 -6.487 -11.583 -4.960 335 HA ASP 46 HA ASP 46 -5.436 -10.550 -7.417 336 HB2 ASP 46 2HB ASP 46 -7.726 -12.402 -6.728 337 HB3 ASP 46 1HB ASP 46 -7.641 -11.712 -8.351 338 HA PRO 47 HA PRO 47 -7.526 -6.582 -7.330 339 HB2 PRO 47 2HB PRO 47 -7.328 -6.847 -10.340 340 HB3 PRO 47 1HB PRO 47 -6.822 -5.505 -9.288 341 HG2 PRO 47 2HG PRO 47 -4.992 -7.137 -10.289 342 HG3 PRO 47 1HG PRO 47 -4.871 -6.588 -8.599 343 HD2 PRO 47 2HD PRO 47 -5.810 -9.246 -9.657 344 HD3 PRO 47 1HD PRO 47 -4.792 -8.889 -8.241 345 H ASP 48 H ASP 48 -9.610 -6.757 -6.691 346 HA ASP 48 HA ASP 48 -11.673 -7.676 -8.611 347 HB2 ASP 48 2HB ASP 48 -11.811 -7.581 -5.560 348 HB3 ASP 48 1HB ASP 48 -13.182 -7.942 -6.607 349 HA PRO 49 HA PRO 49 -13.040 -3.236 -8.492 350 HB2 PRO 49 2HB PRO 49 -15.032 -4.460 -10.399 351 HB3 PRO 49 1HB PRO 49 -14.073 -2.976 -10.575 352 HG2 PRO 49 2HG PRO 49 -13.455 -5.144 -11.979 353 HG3 PRO 49 1HG PRO 49 -12.174 -4.111 -11.298 354 HD2 PRO 49 2HD PRO 49 -13.206 -6.758 -10.287 355 HD3 PRO 49 1HD PRO 49 -11.533 -6.159 -10.376 356 H ASP 50 H ASP 50 -14.672 -6.298 -8.061 357 HA ASP 50 HA ASP 50 -17.035 -5.570 -6.763 358 HB2 ASP 50 2HB ASP 50 -16.600 -7.861 -7.481 359 HB3 ASP 50 1HB ASP 50 -15.243 -8.002 -6.365 360 H TYR 51 H TYR 51 -13.757 -5.963 -5.440 361 HA TYR 51 HA TYR 51 -14.649 -5.547 -2.682 362 HB2 TYR 51 2HB TYR 51 -12.659 -7.117 -3.683 363 HB3 TYR 51 1HB TYR 51 -11.705 -5.685 -3.334 364 HD1 TYR 51 HD2 TYR 51 -12.327 -4.670 -0.795 365 HD2 TYR 51 HD1 TYR 51 -12.649 -8.760 -2.011 366 HE1 TYR 51 HE2 TYR 51 -12.186 -5.386 1.553 367 HE2 TYR 51 HE1 TYR 51 -12.515 -9.458 0.337 368 HH TYR 51 HH TYR 51 -12.825 -7.282 2.927 369 H ARG 52 H ARG 52 -13.662 -3.658 -5.303 370 HA ARG 52 HA ARG 52 -12.177 -1.563 -4.269 371 HB2 ARG 52 2HB ARG 52 -12.613 -1.879 -6.685 372 HB3 ARG 52 1HB ARG 52 -14.309 -1.461 -6.450 373 HG2 ARG 52 2HG ARG 52 -13.688 0.821 -5.808 374 HG3 ARG 52 1HG ARG 52 -11.974 0.406 -5.933 375 HD2 ARG 52 2HD ARG 52 -12.583 1.587 -7.930 376 HD3 ARG 52 1HD ARG 52 -12.347 -0.105 -8.363 377 HE ARG 52 HE ARG 52 -14.925 -0.181 -8.063 378 HH11 ARG 52 1HH1 ARG 52 -13.105 2.444 -9.547 379 HH12 ARG 52 2HH1 ARG 52 -14.421 2.931 -10.570 380 HH21 ARG 52 1HH2 ARG 52 -16.643 0.487 -9.366 381 HH22 ARG 52 2HH2 ARG 52 -16.442 1.816 -10.466 382 H VAL 53 H VAL 53 -12.605 0.006 -2.835 383 HA VAL 53 HA VAL 53 -15.390 0.959 -2.432 384 HB VAL 53 HB VAL 53 -14.896 1.456 -0.091 385 HG11 VAL 53 1HG1 VAL 53 -14.144 -1.422 -0.720 386 HG12 VAL 53 2HG1 VAL 53 -15.779 -0.784 -0.538 387 HG13 VAL 53 3HG1 VAL 53 -14.691 -0.823 0.850 388 HG21 VAL 53 3HG2 VAL 53 -12.780 0.810 1.016 389 HG22 VAL 53 1HG2 VAL 53 -12.504 1.998 -0.260 390 HG23 VAL 53 2HG2 VAL 53 -12.116 0.299 -0.538 391 H GLU 54 H GLU 54 -15.260 3.243 -1.370 392 HA GLU 54 HA GLU 54 -13.230 4.922 -2.735 393 HB2 GLU 54 2HB GLU 54 -14.936 6.672 -2.922 394 HB3 GLU 54 1HB GLU 54 -15.526 5.197 -3.682 395 HG2 GLU 54 2HG GLU 54 -16.953 4.731 -1.751 396 HG3 GLU 54 1HG GLU 54 -16.296 6.123 -0.894 397 H ALA 55 H ALA 55 -12.530 6.816 -1.522 398 HA ALA 55 HA ALA 55 -13.248 6.980 1.318 399 HB1 ALA 55 3HB ALA 55 -11.281 5.471 1.230 400 HB2 ALA 55 1HB ALA 55 -10.905 6.995 2.041 401 HB3 ALA 55 2HB ALA 55 -10.370 6.721 0.381 402 H THR 56 H THR 56 -13.002 9.018 2.180 403 HA THR 56 HA THR 56 -12.535 11.258 0.368 404 HB THR 56 HB THR 56 -13.329 11.235 3.319 405 HG1 THR 56 HG1 THR 56 -14.728 10.529 1.171 406 HG21 THR 56 3HG2 THR 56 -13.478 13.487 1.269 407 HG22 THR 56 1HG2 THR 56 -12.346 13.406 2.616 408 HG23 THR 56 2HG2 THR 56 -14.077 13.563 2.927 409 H VAL 57 H VAL 57 -10.604 12.225 0.211 410 HA VAL 57 HA VAL 57 -8.320 11.629 1.852 411 HB VAL 57 HB VAL 57 -8.633 13.919 -0.171 412 HG11 VAL 57 1HG1 VAL 57 -6.143 12.470 0.814 413 HG12 VAL 57 2HG1 VAL 57 -6.639 14.100 1.271 414 HG13 VAL 57 3HG1 VAL 57 -6.180 13.759 -0.395 415 HG21 VAL 57 3HG2 VAL 57 -9.257 11.785 -1.235 416 HG22 VAL 57 1HG2 VAL 57 -7.728 11.071 -0.721 417 HG23 VAL 57 2HG2 VAL 57 -7.735 12.400 -1.885 418 H THR 58 H THR 58 -7.613 12.726 3.613 419 HA THR 58 HA THR 58 -8.636 15.449 4.214 420 HB THR 58 HB THR 58 -7.981 13.279 6.272 421 HG1 THR 58 HG1 THR 58 -10.355 13.982 4.971 422 HG21 THR 58 3HG2 THR 58 -7.616 15.557 7.145 423 HG22 THR 58 1HG2 THR 58 -9.041 14.834 7.893 424 HG23 THR 58 2HG2 THR 58 -9.231 16.036 6.615 425 H VAL 59 H VAL 59 -6.889 16.689 3.720 426 HA VAL 59 HA VAL 59 -4.168 15.616 3.954 427 HB VAL 59 HB VAL 59 -5.203 18.171 2.611 428 HG11 VAL 59 1HG1 VAL 59 -2.330 17.149 2.717 429 HG12 VAL 59 2HG1 VAL 59 -2.940 18.590 3.532 430 HG13 VAL 59 3HG1 VAL 59 -2.900 18.530 1.770 431 HG21 VAL 59 3HG2 VAL 59 -4.538 17.037 0.517 432 HG22 VAL 59 1HG2 VAL 59 -5.719 16.075 1.410 433 HG23 VAL 59 2HG2 VAL 59 -4.011 15.626 1.440 434 H HIS 60 H HIS 60 -2.818 16.221 5.543 435 HA HIS 60 HA HIS 60 -3.862 17.903 7.708 436 HB2 HIS 60 2HB HIS 60 -1.544 15.932 7.529 437 HB3 HIS 60 1HB HIS 60 -1.864 16.908 8.966 438 HD1 HIS 60 HD1 HIS 60 -3.808 14.489 6.739 439 HD2 HIS 60 HD2 HIS 60 -3.564 15.678 10.715 440 HE1 HIS 60 HE1 HIS 60 -5.495 13.106 7.960 441 HE2 HIS 60 HE2 HIS 60 -5.465 13.974 10.313 442 H GLU 61 H GLU 61 -3.198 19.865 8.087 443 HA GLU 61 HA GLU 61 -1.637 21.443 6.406 444 HB2 GLU 61 2HB GLU 61 -1.851 23.179 8.164 445 HB3 GLU 61 1HB GLU 61 -3.374 22.335 7.914 446 HG2 GLU 61 2HG GLU 61 -2.901 20.945 9.926 447 HG3 GLU 61 1HG GLU 61 -1.429 21.877 10.190 448 H THR 62 H THR 62 -0.731 19.624 9.262 449 HA THR 62 HA THR 62 2.123 20.281 8.854 450 HB THR 62 HB THR 62 2.417 19.881 11.344 451 HG1 THR 62 HG1 THR 62 0.576 18.782 11.915 452 HG21 THR 62 3HG2 THR 62 1.556 22.077 12.084 453 HG22 THR 62 1HG2 THR 62 0.528 22.166 10.650 454 HG23 THR 62 2HG2 THR 62 2.285 22.201 10.483 455 HA PRO 63 HA PRO 63 1.660 15.739 8.098 456 HB2 PRO 63 2HB PRO 63 3.960 15.514 6.574 457 HB3 PRO 63 1HB PRO 63 2.399 16.024 5.903 458 HG2 PRO 63 2HG PRO 63 4.730 17.715 6.745 459 HG3 PRO 63 1HG PRO 63 3.711 17.847 5.292 460 HD2 PRO 63 2HD PRO 63 3.329 19.455 7.438 461 HD3 PRO 63 1HD PRO 63 1.971 18.894 6.438 462 H GLU 64 H GLU 64 2.253 14.452 9.739 463 HA GLU 64 HA GLU 64 4.481 15.107 11.479 464 HB2 GLU 64 2HB GLU 64 3.598 13.313 12.934 465 HB3 GLU 64 1HB GLU 64 2.314 14.411 12.443 466 HG2 GLU 64 2HG GLU 64 1.620 12.772 10.705 467 HG3 GLU 64 1HG GLU 64 2.849 11.660 11.292 468 H SER 65 H SER 65 6.104 13.538 12.108 469 HA SER 65 HA SER 65 7.216 12.075 9.852 470 HB2 SER 65 2HB SER 65 9.181 11.828 11.399 471 HB3 SER 65 1HB SER 65 8.691 13.511 11.201 472 HG SER 65 HG SER 65 7.771 13.492 13.200 473 H VAL 66 H VAL 66 6.842 9.946 9.578 474 HA VAL 66 HA VAL 66 6.124 8.215 11.883 475 HB VAL 66 HB VAL 66 4.872 7.984 9.089 476 HG11 VAL 66 1HG1 VAL 66 4.993 5.833 10.249 477 HG12 VAL 66 2HG1 VAL 66 3.316 6.370 10.153 478 HG13 VAL 66 3HG1 VAL 66 4.203 6.518 11.673 479 HG21 VAL 66 3HG2 VAL 66 2.756 8.815 10.112 480 HG22 VAL 66 1HG2 VAL 66 4.036 10.030 10.130 481 HG23 VAL 66 2HG2 VAL 66 3.626 9.159 11.609 482 H ASP 67 H ASP 67 7.346 6.393 12.003 483 HA ASP 67 HA ASP 67 9.494 5.963 10.087 484 HB2 ASP 67 2HB ASP 67 8.755 4.599 12.716 485 HB3 ASP 67 1HB ASP 67 10.111 4.082 11.720 486 H LEU 68 H LEU 68 8.890 4.950 8.237 487 HA LEU 68 HA LEU 68 7.491 2.339 8.455 488 HB2 LEU 68 2HB LEU 68 7.260 4.242 6.093 489 HB3 LEU 68 1HB LEU 68 6.476 2.679 6.249 490 HG LEU 68 HG LEU 68 5.879 5.132 7.938 491 HD11 LEU 68 1HD1 LEU 68 5.120 5.412 5.650 492 HD12 LEU 68 2HD1 LEU 68 3.753 5.218 6.741 493 HD13 LEU 68 3HD1 LEU 68 4.260 3.871 5.716 494 HD21 LEU 68 3HD2 LEU 68 3.969 3.874 8.831 495 HD22 LEU 68 1HD2 LEU 68 5.488 3.072 9.225 496 HD23 LEU 68 2HD2 LEU 68 4.467 2.439 7.931 497 H GLU 69 H GLU 69 8.110 0.832 6.656 498 HA GLU 69 HA GLU 69 10.941 0.672 6.407 499 HB2 GLU 69 2HB GLU 69 10.571 -1.418 5.244 500 HB3 GLU 69 1HB GLU 69 9.376 -1.323 6.530 501 HG2 GLU 69 2HG GLU 69 7.696 -0.547 4.817 502 HG3 GLU 69 1HG GLU 69 8.901 -0.841 3.571 503 H THR 70 H THR 70 12.262 1.281 4.720 504 HA THR 70 HA THR 70 11.034 1.988 2.122 505 HB THR 70 HB THR 70 12.683 3.637 3.046 506 HG1 THR 70 HG1 THR 70 12.340 3.279 0.744 507 HG21 THR 70 3HG2 THR 70 14.272 2.112 4.177 508 HG22 THR 70 1HG2 THR 70 15.099 3.138 3.005 509 HG23 THR 70 2HG2 THR 70 14.760 1.451 2.613 510 H SER 71 H SER 71 12.227 1.100 0.212 511 HA SER 71 HA SER 71 12.304 -1.724 0.276 512 HB2 SER 71 2HB SER 71 13.114 -1.488 -2.078 513 HB3 SER 71 1HB SER 71 11.689 -0.504 -1.748 514 HG SER 71 HG SER 71 14.393 0.359 -1.949 515 H ASP 72 H ASP 72 14.893 0.741 -0.024 516 HA ASP 72 HA ASP 72 17.084 -0.963 0.037 517 HB2 ASP 72 2HB ASP 72 16.850 1.982 0.793 518 HB3 ASP 72 1HB ASP 72 18.368 1.141 0.482 519 H ASP 73 H ASP 73 15.735 -2.098 2.126 520 HA ASP 73 HA ASP 73 16.481 -3.360 3.836 521 HB2 ASP 73 2HB ASP 73 19.074 -1.796 3.758 522 HB3 ASP 73 1HB ASP 73 18.824 -3.380 4.479 523 H ARG 74 H ARG 74 15.717 -0.223 4.311 524 HA ARG 74 HA ARG 74 16.614 -0.090 7.141 525 HB2 ARG 74 2HB ARG 74 18.008 1.225 5.364 526 HB3 ARG 74 1HB ARG 74 16.614 2.282 5.206 527 HG2 ARG 74 2HG ARG 74 16.844 2.936 7.569 528 HG3 ARG 74 1HG ARG 74 18.191 1.822 7.762 529 HD2 ARG 74 2HD ARG 74 19.575 3.150 6.318 530 HD3 ARG 74 1HD ARG 74 18.212 4.158 5.822 531 HE ARG 74 HE ARG 74 19.689 4.269 8.349 532 HH11 ARG 74 1HH1 ARG 74 16.941 5.477 6.505 533 HH12 ARG 74 2HH1 ARG 74 16.729 6.872 7.509 534 HH21 ARG 74 1HH2 ARG 74 19.410 6.118 9.644 535 HH22 ARG 74 2HH2 ARG 74 18.129 7.237 9.287 536 H THR 75 H THR 75 15.460 2.191 7.911 537 HA THR 75 HA THR 75 12.582 2.134 7.345 538 HB THR 75 HB THR 75 13.843 2.361 10.141 539 HG1 THR 75 HG1 THR 75 12.513 0.311 8.746 540 HG21 THR 75 3HG2 THR 75 10.923 2.500 9.306 541 HG22 THR 75 1HG2 THR 75 11.877 3.834 9.951 542 HG23 THR 75 2HG2 THR 75 11.508 2.441 10.971 543 H VAL 76 H VAL 76 11.743 4.270 7.446 544 HA VAL 76 HA VAL 76 13.652 6.491 7.513 545 HB VAL 76 HB VAL 76 13.010 7.263 5.192 546 HG11 VAL 76 1HG1 VAL 76 14.510 4.627 5.281 547 HG12 VAL 76 2HG1 VAL 76 15.196 6.223 5.598 548 HG13 VAL 76 3HG1 VAL 76 14.590 5.830 3.989 549 HG21 VAL 76 3HG2 VAL 76 12.133 5.631 3.570 550 HG22 VAL 76 1HG2 VAL 76 10.979 5.951 4.866 551 HG23 VAL 76 2HG2 VAL 76 11.913 4.455 4.870 552 H ARG 77 H ARG 77 12.664 8.528 7.134 553 HA ARG 77 HA ARG 77 10.214 8.877 8.591 554 HB2 ARG 77 2HB ARG 77 12.307 10.346 8.721 555 HB3 ARG 77 1HB ARG 77 11.925 10.950 7.123 556 HG2 ARG 77 2HG ARG 77 10.111 11.291 9.537 557 HG3 ARG 77 1HG ARG 77 11.321 12.472 9.040 558 HD2 ARG 77 2HD ARG 77 8.787 11.664 7.608 559 HD3 ARG 77 1HD ARG 77 9.270 13.268 8.164 560 HE ARG 77 HE ARG 77 10.147 11.878 5.751 561 HH11 ARG 77 1HH1 ARG 77 10.439 14.792 7.739 562 HH12 ARG 77 2HH1 ARG 77 11.249 15.683 6.485 563 HH21 ARG 77 1HH2 ARG 77 11.317 13.021 4.229 564 HH22 ARG 77 2HH2 ARG 77 11.743 14.682 4.510 565 H TYR 78 H TYR 78 8.366 8.424 7.545 566 HA TYR 78 HA TYR 78 7.790 9.571 4.892 567 HB2 TYR 78 2HB TYR 78 6.438 7.478 6.629 568 HB3 TYR 78 1HB TYR 78 5.539 8.298 5.366 569 HD1 TYR 78 HD2 TYR 78 8.755 6.382 5.799 570 HD2 TYR 78 HD1 TYR 78 5.458 7.305 3.255 571 HE1 TYR 78 HE2 TYR 78 9.545 4.726 4.173 572 HE2 TYR 78 HE1 TYR 78 6.242 5.641 1.621 573 HH TYR 78 HH TYR 78 8.616 3.320 2.368 574 H LEU 79 H LEU 79 6.479 11.286 4.718 575 HA LEU 79 HA LEU 79 5.524 12.689 7.107 576 HB2 LEU 79 2HB LEU 79 5.680 13.449 4.165 577 HB3 LEU 79 1HB LEU 79 4.969 14.496 5.386 578 HG LEU 79 HG LEU 79 7.848 13.527 5.471 579 HD11 LEU 79 1HD1 LEU 79 8.511 15.757 4.710 580 HD12 LEU 79 2HD1 LEU 79 6.815 16.201 4.484 581 HD13 LEU 79 3HD1 LEU 79 7.537 14.928 3.496 582 HD21 LEU 79 3HD2 LEU 79 6.409 15.670 7.072 583 HD22 LEU 79 1HD2 LEU 79 8.137 15.307 7.154 584 HD23 LEU 79 2HD2 LEU 79 6.962 14.099 7.669 585 H HIS 80 H HIS 80 3.476 12.460 7.797 586 HA HIS 80 HA HIS 80 1.505 11.006 6.296 587 HB2 HIS 80 2HB HIS 80 1.609 10.875 8.765 588 HB3 HIS 80 1HB HIS 80 1.267 12.597 8.887 589 HD2 HIS 80 HD2 HIS 80 -0.770 9.946 6.776 590 HE1 HIS 80 HE1 HIS 80 -3.271 11.740 9.673 591 HE2 HIS 80 HE2 HIS 80 -3.106 9.959 7.882 592 H VAL 81 H VAL 81 1.002 12.045 4.469 593 HA VAL 81 HA VAL 81 0.513 14.905 4.365 594 HB VAL 81 HB VAL 81 0.277 14.596 1.926 595 HG11 VAL 81 1HG1 VAL 81 2.703 13.181 3.100 596 HG12 VAL 81 2HG1 VAL 81 2.524 14.915 2.819 597 HG13 VAL 81 3HG1 VAL 81 2.591 13.803 1.449 598 HG21 VAL 81 3HG2 VAL 81 0.651 11.616 2.446 599 HG22 VAL 81 1HG2 VAL 81 0.591 12.391 0.859 600 HG23 VAL 81 2HG2 VAL 81 -0.836 12.390 1.893 601 H ALA 82 H ALA 82 -1.378 11.922 4.347 602 HA ALA 82 HA ALA 82 -3.863 13.439 4.574 603 HB1 ALA 82 3HB ALA 82 -3.546 13.348 2.135 604 HB2 ALA 82 1HB ALA 82 -4.948 12.393 2.626 605 HB3 ALA 82 2HB ALA 82 -3.431 11.589 2.206 606 H THR 83 H THR 83 -5.664 12.201 5.215 607 HA THR 83 HA THR 83 -5.244 9.335 5.863 608 HB THR 83 HB THR 83 -7.128 11.318 7.251 609 HG1 THR 83 HG1 THR 83 -5.088 9.984 8.623 610 HG21 THR 83 3HG2 THR 83 -6.589 8.381 7.897 611 HG22 THR 83 1HG2 THR 83 -8.084 9.021 7.202 612 HG23 THR 83 2HG2 THR 83 -7.604 9.477 8.836 613 H LEU 84 H LEU 84 -6.548 8.001 4.774 614 HA LEU 84 HA LEU 84 -8.648 9.095 3.009 615 HB2 LEU 84 2HB LEU 84 -7.445 6.298 2.865 616 HB3 LEU 84 1HB LEU 84 -8.337 7.158 1.620 617 HG LEU 84 HG LEU 84 -5.491 7.697 2.546 618 HD11 LEU 84 1HD1 LEU 84 -5.698 5.789 1.044 619 HD12 LEU 84 2HD1 LEU 84 -4.842 7.112 0.259 620 HD13 LEU 84 3HD1 LEU 84 -6.530 6.789 -0.151 621 HD21 LEU 84 3HD2 LEU 84 -6.507 9.874 2.125 622 HD22 LEU 84 1HD2 LEU 84 -7.081 9.339 0.542 623 HD23 LEU 84 2HD2 LEU 84 -5.351 9.493 0.853 624 H SER 85 H SER 85 -10.477 9.135 4.167 625 HA SER 85 HA SER 85 -11.109 7.130 6.207 626 HB2 SER 85 2HB SER 85 -12.399 9.805 5.498 627 HB3 SER 85 1HB SER 85 -12.854 8.791 6.875 628 HG SER 85 HG SER 85 -10.506 8.964 7.415 629 H PHE 86 H PHE 86 -12.601 5.534 5.863 630 HA PHE 86 HA PHE 86 -14.728 5.777 3.893 631 HB2 PHE 86 2HB PHE 86 -14.058 3.696 2.671 632 HB3 PHE 86 1HB PHE 86 -12.935 5.017 2.433 633 HD1 PHE 86 HD1 PHE 86 -10.686 4.966 3.586 634 HD2 PHE 86 HD2 PHE 86 -13.318 1.595 3.634 635 HE1 PHE 86 HE1 PHE 86 -8.806 3.501 4.197 636 HE2 PHE 86 HE2 PHE 86 -11.430 0.144 4.253 637 HZ PHE 86 HZ PHE 86 -9.176 1.093 4.532 638 H ASP 87 H ASP 87 -15.714 3.366 3.745 639 HA ASP 87 HA ASP 87 -15.789 2.092 6.430 640 HB2 ASP 87 2HB ASP 87 -18.090 2.557 4.480 641 HB3 ASP 87 1HB ASP 87 -18.187 1.398 5.801 642 H LEU 88 H LEU 88 -15.925 -0.141 6.424 643 HA LEU 88 HA LEU 88 -15.791 -1.686 3.961 644 HB2 LEU 88 2HB LEU 88 -13.432 -0.939 4.255 645 HB3 LEU 88 1HB LEU 88 -13.425 -1.596 5.880 646 HG LEU 88 HG LEU 88 -13.750 -3.895 4.907 647 HD11 LEU 88 1HD1 LEU 88 -14.803 -3.292 2.793 648 HD12 LEU 88 2HD1 LEU 88 -13.365 -4.270 2.511 649 HD13 LEU 88 3HD1 LEU 88 -13.312 -2.525 2.239 650 HD21 LEU 88 3HD2 LEU 88 -11.260 -2.429 3.956 651 HD22 LEU 88 1HD2 LEU 88 -11.425 -4.177 4.157 652 HD23 LEU 88 2HD2 LEU 88 -11.512 -3.118 5.562 653 H ASP 89 H ASP 89 -16.687 -3.618 4.293 654 HA ASP 89 HA ASP 89 -17.461 -5.532 5.158 655 HB2 ASP 89 2HB ASP 89 -15.325 -5.970 6.155 656 HB3 ASP 89 1HB ASP 89 -15.628 -4.841 7.473 657 H GLY 90 H GLY 90 -17.334 -3.652 8.195 658 HA2 GLY 90 2HA GLY 90 -20.233 -3.278 8.248 659 HA3 GLY 90 1HA GLY 90 -19.586 -4.396 9.445 660 H GLU 91 H GLU 91 -17.322 -1.989 8.758 661 HA GLU 91 HA GLU 91 -18.222 -0.109 10.820 662 HB2 GLU 91 2HB GLU 91 -16.050 -0.323 12.052 663 HB3 GLU 91 1HB GLU 91 -17.029 -1.782 12.127 664 HG2 GLU 91 2HG GLU 91 -15.621 -2.862 10.438 665 HG3 GLU 91 1HG GLU 91 -14.669 -1.391 10.255 666 H SER 92 H SER 92 -16.774 1.745 11.018 667 HA SER 92 HA SER 92 -15.887 2.777 8.480 668 HB2 SER 92 2HB SER 92 -16.974 4.212 10.213 669 HB3 SER 92 1HB SER 92 -15.587 3.978 11.276 670 HG SER 92 HG SER 92 -15.825 5.461 8.918 671 H ARG 93 H ARG 93 -13.792 2.921 7.735 672 HA ARG 93 HA ARG 93 -11.556 1.971 9.419 673 HB2 ARG 93 2HB ARG 93 -12.232 1.125 6.570 674 HB3 ARG 93 1HB ARG 93 -10.702 0.765 7.350 675 HG2 ARG 93 2HG ARG 93 -13.366 -0.202 8.411 676 HG3 ARG 93 1HG ARG 93 -12.409 -1.110 7.244 677 HD2 ARG 93 2HD ARG 93 -11.925 -2.038 9.367 678 HD3 ARG 93 1HD ARG 93 -10.516 -1.071 8.934 679 HE ARG 93 HE ARG 93 -12.626 -0.197 10.820 680 HH11 ARG 93 1HH1 ARG 93 -9.202 -0.362 9.967 681 HH12 ARG 93 2HH1 ARG 93 -8.698 0.501 11.381 682 HH21 ARG 93 1HH2 ARG 93 -11.924 0.940 12.650 683 HH22 ARG 93 2HH2 ARG 93 -10.225 1.236 12.890 684 H ASP 94 H ASP 94 -9.623 3.002 9.018 685 HA ASP 94 HA ASP 94 -9.500 5.124 6.935 686 HB2 ASP 94 2HB ASP 94 -8.241 5.210 9.721 687 HB3 ASP 94 1HB ASP 94 -8.046 6.441 8.473 688 H LEU 95 H LEU 95 -7.814 4.967 5.579 689 HA LEU 95 HA LEU 95 -5.345 3.586 6.465 690 HB2 LEU 95 2HB LEU 95 -6.536 3.737 3.665 691 HB3 LEU 95 1HB LEU 95 -4.857 3.299 3.961 692 HG LEU 95 HG LEU 95 -7.334 1.757 4.791 693 HD11 LEU 95 1HD1 LEU 95 -4.999 0.997 3.012 694 HD12 LEU 95 2HD1 LEU 95 -6.625 1.428 2.474 695 HD13 LEU 95 3HD1 LEU 95 -6.374 -0.034 3.424 696 HD21 LEU 95 3HD2 LEU 95 -5.781 1.695 6.674 697 HD22 LEU 95 1HD2 LEU 95 -4.462 1.203 5.607 698 HD23 LEU 95 2HD2 LEU 95 -5.835 0.127 5.878 699 H HIS 96 H HIS 96 -3.657 4.896 6.665 700 HA HIS 96 HA HIS 96 -3.988 7.719 5.943 701 HB2 HIS 96 2HB HIS 96 -1.914 6.315 7.699 702 HB3 HIS 96 1HB HIS 96 -2.063 8.059 7.485 703 HD2 HIS 96 HD2 HIS 96 -4.294 5.133 8.956 704 HE1 HIS 96 HE1 HIS 96 -5.213 8.773 10.880 705 HE2 HIS 96 HE2 HIS 96 -5.861 6.349 10.611 706 H ALA 97 H ALA 97 -2.779 8.670 4.424 707 HA ALA 97 HA ALA 97 -1.030 7.028 2.711 708 HB1 ALA 97 3HB ALA 97 -2.455 9.673 2.152 709 HB2 ALA 97 1HB ALA 97 -2.991 8.077 1.618 710 HB3 ALA 97 2HB ALA 97 -1.493 8.759 0.988 711 H PHE 98 H PHE 98 1.102 7.415 2.763 712 HA PHE 98 HA PHE 98 2.141 9.984 3.797 713 HB2 PHE 98 2HB PHE 98 3.611 7.348 4.237 714 HB3 PHE 98 1HB PHE 98 3.840 8.885 5.051 715 HD1 PHE 98 HD2 PHE 98 1.694 5.872 4.858 716 HD2 PHE 98 HD1 PHE 98 2.644 9.390 7.075 717 HE1 PHE 98 HE2 PHE 98 0.403 5.015 6.773 718 HE2 PHE 98 HE1 PHE 98 1.359 8.526 8.983 719 HZ PHE 98 HZ PHE 98 0.235 6.344 8.836 720 H ARG 99 H ARG 99 4.262 10.460 3.091 721 HA ARG 99 HA ARG 99 5.287 9.219 0.635 722 HB2 ARG 99 2HB ARG 99 4.655 12.216 0.796 723 HB3 ARG 99 1HB ARG 99 5.273 11.341 -0.604 724 HG2 ARG 99 2HG ARG 99 3.166 10.191 -0.892 725 HG3 ARG 99 1HG ARG 99 2.560 10.819 0.634 726 HD2 ARG 99 2HD ARG 99 1.481 12.153 -0.888 727 HD3 ARG 99 1HD ARG 99 2.878 13.148 -0.483 728 HE ARG 99 HE ARG 99 3.507 11.554 -2.725 729 HH11 ARG 99 1HH1 ARG 99 1.490 14.321 -1.891 730 HH12 ARG 99 2HH1 ARG 99 1.501 14.954 -3.505 731 HH21 ARG 99 1HH2 ARG 99 3.466 12.352 -4.817 732 HH22 ARG 99 2HH2 ARG 99 2.622 13.837 -5.176 733 H GLN 100 H GLN 100 7.511 9.258 0.726 734 HA GLN 100 HA GLN 100 8.775 9.395 3.128 735 HB2 GLN 100 2HB GLN 100 9.881 9.508 0.315 736 HB3 GLN 100 1HB GLN 100 10.965 9.517 1.703 737 HG2 GLN 100 2HG GLN 100 10.054 7.362 2.445 738 HG3 GLN 100 1HG GLN 100 8.948 7.350 1.072 739 HE21 GLN 100 1HE2 GLN 100 12.325 7.138 2.033 740 HE22 GLN 100 2HE2 GLN 100 12.884 6.394 0.577 741 H ALA 101 H ALA 101 9.857 11.766 0.641 742 HA ALA 101 HA ALA 101 10.119 13.792 2.800 743 HB1 ALA 101 3HB ALA 101 12.302 12.929 2.012 744 HB2 ALA 101 1HB ALA 101 12.105 14.652 1.683 745 HB3 ALA 101 2HB ALA 101 11.928 13.473 0.378 746 H ALA 102 H ALA 102 10.458 14.068 -0.742 747 HA ALA 102 HA ALA 102 8.227 16.008 -0.822 748 HB1 ALA 102 3HB ALA 102 10.949 16.184 -2.173 749 HB2 ALA 102 1HB ALA 102 10.432 17.121 -0.769 750 HB3 ALA 102 2HB ALA 102 9.644 17.362 -2.329 751 H ASP 103 H ASP 103 7.806 13.259 -1.515 752 HA ASP 103 HA ASP 103 8.224 12.606 -4.214 753 HB2 ASP 103 2HB ASP 103 7.495 10.879 -2.650 754 HB3 ASP 103 1HB ASP 103 5.992 11.736 -2.328 755 H GLU 104 H GLU 104 7.408 13.430 -6.010 756 HA GLU 104 HA GLU 104 4.767 14.783 -6.027 757 HB2 GLU 104 2HB GLU 104 5.653 16.116 -7.944 758 HB3 GLU 104 1HB GLU 104 6.593 16.356 -6.474 759 HG2 GLU 104 2HG GLU 104 8.319 14.802 -7.331 760 HG3 GLU 104 1HG GLU 104 7.380 14.584 -8.807 761 H SER 105 H SER 105 5.958 11.861 -6.703 762 HA SER 105 HA SER 105 5.010 11.485 -9.437 763 HB2 SER 105 2HB SER 105 6.155 9.528 -7.391 764 HB3 SER 105 1HB SER 105 5.760 9.110 -9.064 765 HG SER 105 HG SER 105 7.220 10.996 -9.549 766 H ARG 106 H ARG 106 3.226 12.005 -6.819 767 HA ARG 106 HA ARG 106 1.071 11.628 -6.221 768 HB2 ARG 106 2HB ARG 106 0.880 9.855 -8.699 769 HB3 ARG 106 1HB ARG 106 -0.485 10.386 -7.726 770 HG2 ARG 106 2HG ARG 106 1.344 12.228 -9.287 771 HG3 ARG 106 1HG ARG 106 -0.224 11.651 -9.838 772 HD2 ARG 106 2HD ARG 106 -1.281 12.788 -7.869 773 HD3 ARG 106 1HD ARG 106 0.312 13.441 -7.448 774 HE ARG 106 HE ARG 106 -0.785 13.977 -10.130 775 HH11 ARG 106 1HH1 ARG 106 0.067 15.246 -6.971 776 HH12 ARG 106 2HH1 ARG 106 -0.027 16.900 -7.478 777 HH21 ARG 106 1HH2 ARG 106 -0.944 16.143 -10.772 778 HH22 ARG 106 2HH2 ARG 106 -0.600 17.410 -9.635 779 H THR 107 H THR 107 3.384 9.693 -5.537 780 HA THR 107 HA THR 107 2.139 7.092 -5.379 781 HB THR 107 HB THR 107 4.842 8.004 -4.287 782 HG1 THR 107 HG1 THR 107 3.983 7.153 -6.846 783 HG21 THR 107 3HG2 THR 107 4.082 5.838 -3.331 784 HG22 THR 107 1HG2 THR 107 5.459 5.617 -4.414 785 HG23 THR 107 2HG2 THR 107 3.831 5.212 -4.963 786 H LEU 108 H LEU 108 0.439 7.306 -4.000 787 HA LEU 108 HA LEU 108 0.726 8.151 -1.224 788 HB2 LEU 108 2HB LEU 108 -1.580 6.727 -2.622 789 HB3 LEU 108 1HB LEU 108 -1.630 7.409 -1.003 790 HG LEU 108 HG LEU 108 -1.377 8.974 -3.597 791 HD11 LEU 108 1HD1 LEU 108 -3.702 8.769 -1.652 792 HD12 LEU 108 2HD1 LEU 108 -3.604 7.979 -3.228 793 HD13 LEU 108 3HD1 LEU 108 -3.645 9.734 -3.131 794 HD21 LEU 108 3HD2 LEU 108 -1.546 10.013 -0.740 795 HD22 LEU 108 1HD2 LEU 108 -1.610 11.004 -2.201 796 HD23 LEU 108 2HD2 LEU 108 -0.142 10.115 -1.805 797 H PHE 109 H PHE 109 1.621 6.850 0.190 798 HA PHE 109 HA PHE 109 1.705 3.924 -0.254 799 HB2 PHE 109 2HB PHE 109 3.872 5.242 -0.030 800 HB3 PHE 109 1HB PHE 109 3.392 5.679 1.604 801 HD1 PHE 109 HD1 PHE 109 4.052 2.708 -0.582 802 HD2 PHE 109 HD2 PHE 109 4.007 4.260 3.412 803 HE1 PHE 109 HE1 PHE 109 5.170 0.669 0.246 804 HE2 PHE 109 HE2 PHE 109 5.111 2.210 4.224 805 HZ PHE 109 HZ PHE 109 5.697 0.417 2.640 806 H VAL 110 H VAL 110 -0.151 3.152 0.715 807 HA VAL 110 HA VAL 110 -0.725 3.979 3.504 808 HB VAL 110 HB VAL 110 -3.061 3.189 3.244 809 HG11 VAL 110 1HG1 VAL 110 -2.287 5.218 1.121 810 HG12 VAL 110 2HG1 VAL 110 -2.586 5.551 2.826 811 HG13 VAL 110 3HG1 VAL 110 -3.906 5.001 1.796 812 HG21 VAL 110 3HG2 VAL 110 -2.421 2.732 0.309 813 HG22 VAL 110 1HG2 VAL 110 -4.038 2.683 1.025 814 HG23 VAL 110 2HG2 VAL 110 -2.825 1.492 1.494 815 HA PRO 111 HA PRO 111 0.684 -0.338 4.222 816 HB2 PRO 111 2HB PRO 111 1.835 0.167 6.654 817 HB3 PRO 111 1HB PRO 111 2.698 0.482 5.133 818 HG2 PRO 111 2HG PRO 111 1.262 2.416 6.913 819 HG3 PRO 111 1HG PRO 111 2.840 2.584 6.106 820 HD2 PRO 111 2HD PRO 111 0.539 3.689 5.110 821 HD3 PRO 111 1HD PRO 111 1.892 3.181 4.079 822 H PHE 112 H PHE 112 -0.697 -1.712 5.232 823 HA PHE 112 HA PHE 112 -2.282 -0.813 7.522 824 HB2 PHE 112 2HB PHE 112 -4.313 -1.860 6.723 825 HB3 PHE 112 1HB PHE 112 -3.767 -0.685 5.548 826 HD1 PHE 112 HD1 PHE 112 -2.860 -1.434 3.350 827 HD2 PHE 112 HD2 PHE 112 -4.496 -4.223 6.154 828 HE1 PHE 112 HE1 PHE 112 -3.100 -3.106 1.563 829 HE2 PHE 112 HE2 PHE 112 -4.721 -5.891 4.355 830 HZ PHE 112 HZ PHE 112 -4.025 -5.330 2.060 831 H ARG 113 H ARG 113 -3.254 -2.679 8.681 832 HA ARG 113 HA ARG 113 -2.097 -5.308 8.133 833 HB2 ARG 113 2HB ARG 113 -0.600 -4.191 9.842 834 HB3 ARG 113 1HB ARG 113 -1.986 -4.064 10.926 835 HG2 ARG 113 2HG ARG 113 -2.175 -6.481 11.053 836 HG3 ARG 113 1HG ARG 113 -0.924 -6.681 9.828 837 HD2 ARG 113 2HD ARG 113 0.748 -5.735 11.364 838 HD3 ARG 113 1HD ARG 113 -0.499 -5.495 12.591 839 HE ARG 113 HE ARG 113 0.835 -7.958 11.910 840 HH11 ARG 113 1HH1 ARG 113 -2.102 -6.651 13.364 841 HH12 ARG 113 2HH1 ARG 113 -2.438 -8.110 14.237 842 HH21 ARG 113 1HH2 ARG 113 0.304 -9.860 13.022 843 HH22 ARG 113 2HH2 ARG 113 -1.087 -9.903 14.041 844 H ASP 114 H ASP 114 -3.729 -6.755 8.144 845 HA ASP 114 HA ASP 114 -6.287 -6.020 9.444 846 HB2 ASP 114 2HB ASP 114 -7.494 -6.764 7.517 847 HB3 ASP 114 1HB ASP 114 -6.212 -5.738 6.878 848 H LYS 115 H LYS 115 -7.647 -8.407 9.011 849 HA LYS 115 HA LYS 115 -6.401 -9.957 11.114 850 HB2 LYS 115 2HB LYS 115 -9.066 -10.391 9.721 851 HB3 LYS 115 1HB LYS 115 -8.523 -11.244 11.158 852 HG2 LYS 115 2HG LYS 115 -9.244 -8.315 10.901 853 HG3 LYS 115 1HG LYS 115 -10.098 -9.552 11.808 854 HD2 LYS 115 2HD LYS 115 -9.008 -8.639 13.601 855 HD3 LYS 115 1HD LYS 115 -7.656 -9.634 13.069 856 HE2 LYS 115 2HE LYS 115 -6.731 -7.705 11.833 857 HE3 LYS 115 1HE LYS 115 -8.109 -6.721 12.334 858 HZ1 LYS 115 3HZ LYS 115 -7.423 -7.052 14.647 859 HZ2 LYS 115 1HZ LYS 115 -6.225 -6.282 13.738 860 HZ3 LYS 115 2HZ LYS 115 -6.062 -7.918 14.129 861 H THR 116 H THR 116 -6.430 -10.234 7.651 862 HA THR 116 HA THR 116 -5.906 -13.091 7.600 863 HB THR 116 HB THR 116 -5.320 -12.847 5.249 864 HG1 THR 116 HG1 THR 116 -5.721 -10.143 4.977 865 HG21 THR 116 3HG2 THR 116 -7.698 -11.056 5.864 866 HG22 THR 116 1HG2 THR 116 -7.737 -12.821 5.771 867 HG23 THR 116 2HG2 THR 116 -7.382 -11.869 4.329 868 H THR 117 H THR 117 -4.029 -10.162 8.024 869 HA THR 117 HA THR 117 -1.439 -11.191 7.463 870 HB THR 117 HB THR 117 -2.244 -8.936 9.360 871 HG1 THR 117 HG1 THR 117 -2.816 -8.729 7.053 872 HG21 THR 117 3HG2 THR 117 0.058 -9.700 9.840 873 HG22 THR 117 1HG2 THR 117 0.083 -8.116 9.065 874 HG23 THR 117 2HG2 THR 117 0.475 -9.560 8.132 875 H GLY 118 H GLY 118 -0.167 -12.536 8.629 876 HA2 GLY 118 2HA GLY 118 0.671 -13.787 10.389 877 HA3 GLY 118 1HA GLY 118 -0.517 -13.076 11.468 878 H GLN 119 H GLN 119 -2.602 -13.958 9.276 879 HA GLN 119 HA GLN 119 -2.892 -16.755 10.213 880 HB2 GLN 119 2HB GLN 119 -5.072 -14.776 9.376 881 HB3 GLN 119 1HB GLN 119 -5.355 -16.447 9.844 882 HG2 GLN 119 2HG GLN 119 -4.250 -14.268 11.644 883 HG3 GLN 119 1HG GLN 119 -5.894 -14.893 11.672 884 HE21 GLN 119 1HE2 GLN 119 -2.583 -15.523 12.549 885 HE22 GLN 119 2HE2 GLN 119 -2.891 -16.911 13.529 886 H GLN 120 H GLN 120 -4.514 -15.073 7.518 887 HA GLN 120 HA GLN 120 -3.978 -17.248 5.656 888 HB2 GLN 120 2HB GLN 120 -5.340 -14.584 5.095 889 HB3 GLN 120 1HB GLN 120 -5.430 -16.042 4.121 890 HG2 GLN 120 2HG GLN 120 -6.681 -17.161 5.950 891 HG3 GLN 120 1HG GLN 120 -6.608 -15.663 6.884 892 HE21 GLN 120 1HE2 GLN 120 -8.839 -15.399 6.949 893 HE22 GLN 120 2HE2 GLN 120 -9.782 -14.995 5.561 894 H SER 121 H SER 121 -2.185 -14.743 6.660 895 HA SER 121 HA SER 121 -0.528 -14.567 4.256 896 HB2 SER 121 2HB SER 121 -1.616 -12.091 5.690 897 HB3 SER 121 1HB SER 121 -0.386 -12.066 4.425 898 HG SER 121 HG SER 121 -3.069 -12.122 4.189 899 H TYR 122 H TYR 122 1.638 -13.663 4.848 900 HA TYR 122 HA TYR 122 2.524 -14.552 7.419 901 HB2 TYR 122 2HB TYR 122 3.927 -13.093 5.151 902 HB3 TYR 122 1HB TYR 122 4.745 -13.490 6.660 903 HD1 TYR 122 HD1 TYR 122 4.804 -15.989 7.380 904 HD2 TYR 122 HD2 TYR 122 3.823 -14.742 3.413 905 HE1 TYR 122 HE1 TYR 122 5.353 -18.231 6.530 906 HE2 TYR 122 HE2 TYR 122 4.371 -16.981 2.574 907 HH TYR 122 HH TYR 122 5.803 -18.885 3.266 908 H ASP 123 H ASP 123 3.728 -13.220 8.928 909 HA ASP 123 HA ASP 123 2.016 -11.002 9.739 910 HB2 ASP 123 2HB ASP 123 2.551 -12.783 11.377 911 HB3 ASP 123 1HB ASP 123 4.257 -12.370 11.281 912 H GLY 124 H GLY 124 2.774 -8.982 10.380 913 HA2 GLY 124 2HA GLY 124 4.874 -7.538 10.585 914 HA3 GLY 124 1HA GLY 124 5.145 -7.994 8.901 915 H GLY 125 H GLY 125 2.555 -8.037 7.995 916 HA2 GLY 125 2HA GLY 125 0.618 -6.341 8.196 917 HA3 GLY 125 1HA GLY 125 1.884 -5.161 7.853 918 H ARG 126 H ARG 126 0.512 -4.678 6.026 919 HA ARG 126 HA ARG 126 1.639 -5.882 3.646 920 HB2 ARG 126 2HB ARG 126 -0.590 -7.141 4.147 921 HB3 ARG 126 1HB ARG 126 -1.405 -5.625 3.788 922 HG2 ARG 126 2HG ARG 126 -1.467 -6.345 1.634 923 HG3 ARG 126 1HG ARG 126 0.244 -5.938 1.561 924 HD2 ARG 126 2HD ARG 126 -1.051 -8.636 1.951 925 HD3 ARG 126 1HD ARG 126 0.113 -8.136 0.723 926 HE ARG 126 HE ARG 126 1.323 -7.968 3.269 927 HH11 ARG 126 1HH1 ARG 126 0.244 -10.428 0.981 928 HH12 ARG 126 2HH1 ARG 126 1.370 -11.612 1.551 929 HH21 ARG 126 1HH2 ARG 126 2.716 -9.574 4.059 930 HH22 ARG 126 2HH2 ARG 126 2.770 -11.133 3.292 931 H TYR 127 H TYR 127 2.068 -4.164 2.220 932 HA TYR 127 HA TYR 127 0.835 -1.560 2.901 933 HB2 TYR 127 2HB TYR 127 2.683 -0.476 1.789 934 HB3 TYR 127 1HB TYR 127 3.324 -1.644 2.930 935 HD1 TYR 127 HD2 TYR 127 4.410 -3.765 2.060 936 HD2 TYR 127 HD1 TYR 127 3.185 -0.638 -0.591 937 HE1 TYR 127 HE2 TYR 127 5.898 -4.648 0.311 938 HE2 TYR 127 HE1 TYR 127 4.679 -1.533 -2.332 939 HH TYR 127 HH TYR 127 6.208 -4.608 -2.044 940 H MET 128 H MET 128 0.075 -0.220 1.218 941 HA MET 128 HA MET 128 -0.780 -1.577 -1.259 942 HB2 MET 128 2HB MET 128 -2.531 -1.540 0.798 943 HB3 MET 128 1HB MET 128 -2.764 0.125 0.296 944 HG2 MET 128 2HG MET 128 -3.055 -2.164 -1.646 945 HG3 MET 128 1HG MET 128 -4.388 -1.597 -0.649 946 HE1 MET 128 3HE MET 128 -5.917 0.260 -1.247 947 HE2 MET 128 1HE MET 128 -5.449 1.694 -2.162 948 HE3 MET 128 2HE MET 128 -4.671 1.342 -0.620 949 H GLU 129 H GLU 129 -0.759 -0.142 -3.030 950 HA GLU 129 HA GLU 129 0.157 2.621 -2.445 951 HB2 GLU 129 2HB GLU 129 2.002 1.055 -3.082 952 HB3 GLU 129 1HB GLU 129 1.195 0.759 -4.620 953 HG2 GLU 129 2HG GLU 129 1.466 3.139 -5.208 954 HG3 GLU 129 1HG GLU 129 2.272 3.433 -3.672 955 H LEU 130 H LEU 130 -0.985 4.161 -3.404 956 HA LEU 130 HA LEU 130 -2.627 3.604 -5.816 957 HB2 LEU 130 2HB LEU 130 -3.359 5.920 -4.008 958 HB3 LEU 130 1HB LEU 130 -4.377 4.929 -5.029 959 HG LEU 130 HG LEU 130 -4.049 3.067 -3.228 960 HD11 LEU 130 1HD1 LEU 130 -3.230 5.469 -1.562 961 HD12 LEU 130 2HD1 LEU 130 -2.197 4.101 -1.991 962 HD13 LEU 130 3HD1 LEU 130 -3.597 3.852 -0.951 963 HD21 LEU 130 3HD2 LEU 130 -6.161 4.255 -3.598 964 HD22 LEU 130 1HD2 LEU 130 -5.639 5.550 -2.523 965 HD23 LEU 130 2HD2 LEU 130 -5.907 3.922 -1.890 966 H GLU 131 H GLU 131 -2.471 5.162 -7.474 967 HA GLU 131 HA GLU 131 -1.031 7.678 -6.897 968 HB2 GLU 131 2HB GLU 131 -0.697 5.999 -9.429 969 HB3 GLU 131 1HB GLU 131 -0.050 7.621 -9.190 970 HG2 GLU 131 2HG GLU 131 1.267 6.732 -7.236 971 HG3 GLU 131 1HG GLU 131 0.740 5.112 -7.688 972 HA PRO 132 HA PRO 132 -5.134 8.995 -8.530 973 HB2 PRO 132 2HB PRO 132 -4.952 11.583 -7.583 974 HB3 PRO 132 1HB PRO 132 -5.458 10.218 -6.560 975 HG2 PRO 132 2HG PRO 132 -2.751 11.496 -6.786 976 HG3 PRO 132 1HG PRO 132 -3.656 11.022 -5.328 977 HD2 PRO 132 2HD PRO 132 -1.687 9.463 -6.314 978 HD3 PRO 132 1HD PRO 132 -3.139 8.762 -5.566 979 H ASP 133 H ASP 133 -5.734 10.532 -10.130 980 HA ASP 133 HA ASP 133 -3.718 10.985 -12.156 981 HB2 ASP 133 2HB ASP 133 -5.959 10.140 -12.755 982 HB3 ASP 133 1HB ASP 133 -6.701 11.618 -12.145 983 H ARG 134 H ARG 134 -4.829 12.780 -9.564 984 HA ARG 134 HA ARG 134 -3.758 15.309 -10.570 985 HB2 ARG 134 2HB ARG 134 -5.766 16.567 -9.753 986 HB3 ARG 134 1HB ARG 134 -6.120 15.524 -11.122 987 HG2 ARG 134 2HG ARG 134 -7.733 14.438 -9.975 988 HG3 ARG 134 1HG ARG 134 -6.623 14.056 -8.666 989 HD2 ARG 134 2HD ARG 134 -7.097 16.207 -7.611 990 HD3 ARG 134 1HD ARG 134 -8.173 16.655 -8.940 991 HE ARG 134 HE ARG 134 -8.715 14.827 -6.735 992 HH11 ARG 134 1HH1 ARG 134 -9.811 15.944 -9.903 993 HH12 ARG 134 2HH1 ARG 134 -11.423 15.353 -9.659 994 HH21 ARG 134 1HH2 ARG 134 -10.799 14.078 -6.460 995 HH22 ARG 134 2HH2 ARG 134 -11.987 14.296 -7.710 996 H ASP 135 H ASP 135 -3.751 16.946 -8.695 997 HA ASP 135 HA ASP 135 -2.571 15.714 -6.369 998 HB2 ASP 135 2HB ASP 135 -1.836 17.935 -7.437 999 HB3 ASP 135 1HB ASP 135 -3.264 18.668 -6.715 1000 H LEU 136 H LEU 136 -3.516 15.394 -4.385 1001 HA LEU 136 HA LEU 136 -6.423 15.724 -4.177 1002 HB2 LEU 136 2HB LEU 136 -4.487 14.255 -2.348 1003 HB3 LEU 136 1HB LEU 136 -6.242 14.173 -2.277 1004 HG LEU 136 HG LEU 136 -4.487 13.110 -4.527 1005 HD11 LEU 136 1HD1 LEU 136 -5.239 10.890 -3.800 1006 HD12 LEU 136 2HD1 LEU 136 -6.130 11.619 -2.464 1007 HD13 LEU 136 3HD1 LEU 136 -4.371 11.730 -2.516 1008 HD21 LEU 136 3HD2 LEU 136 -7.511 13.016 -4.271 1009 HD22 LEU 136 1HD2 LEU 136 -6.560 12.156 -5.487 1010 HD23 LEU 136 2HD2 LEU 136 -6.585 13.918 -5.472 1011 H SER 137 H SER 137 -7.373 17.183 -2.925 1012 HA SER 137 HA SER 137 -5.849 18.754 -0.926 1013 HB2 SER 137 2HB SER 137 -8.512 19.338 -2.314 1014 HB3 SER 137 1HB SER 137 -7.712 20.402 -1.155 1015 HG SER 137 HG SER 137 -7.200 19.995 -3.815 1016 H ASP 138 H ASP 138 -7.273 19.392 1.048 1017 HA ASP 138 HA ASP 138 -8.452 17.046 2.228 1018 HB2 ASP 138 2HB ASP 138 -8.916 18.484 4.203 1019 HB3 ASP 138 1HB ASP 138 -7.244 18.599 3.680 1020 H GLY 139 H GLY 139 -10.407 16.345 1.855 1021 HA2 GLY 139 2HA GLY 139 -12.813 16.582 1.799 1022 HA3 GLY 139 1HA GLY 139 -12.620 18.163 1.048 1023 H ASP 140 H ASP 140 -10.340 16.191 -0.344 1024 HA ASP 140 HA ASP 140 -11.855 15.808 -2.800 1025 HB2 ASP 140 2HB ASP 140 -9.313 16.461 -2.494 1026 HB3 ASP 140 1HB ASP 140 -9.050 14.737 -2.299 1027 H GLU 141 H GLU 141 -11.545 13.450 -3.882 1028 HA GLU 141 HA GLU 141 -11.947 11.323 -1.834 1029 HB2 GLU 141 2HB GLU 141 -13.158 11.603 -4.627 1030 HB3 GLU 141 1HB GLU 141 -13.382 10.208 -3.571 1031 HG2 GLU 141 2HG GLU 141 -14.608 11.508 -1.963 1032 HG3 GLU 141 1HG GLU 141 -14.175 13.015 -2.772 1033 H ILE 142 H ILE 142 -11.490 9.084 -2.827 1034 HA ILE 142 HA ILE 142 -9.424 8.802 -4.812 1035 HB ILE 142 HB ILE 142 -8.040 9.681 -2.973 1036 HG12 ILE 142 2HG1 ILE 142 -6.378 7.791 -2.712 1037 HG13 ILE 142 1HG1 ILE 142 -7.556 6.697 -3.427 1038 HG21 ILE 142 1HG2 ILE 142 -9.426 9.120 -1.063 1039 HG22 ILE 142 2HG2 ILE 142 -7.795 8.502 -0.814 1040 HG23 ILE 142 3HG2 ILE 142 -9.092 7.401 -1.275 1041 HD11 ILE 142 3HD1 ILE 142 -5.856 7.376 -5.031 1042 HD12 ILE 142 1HD1 ILE 142 -6.278 9.072 -4.797 1043 HD13 ILE 142 2HD1 ILE 142 -7.441 7.965 -5.531 1044 H THR 143 H THR 143 -9.123 6.600 -5.385 1045 HA THR 143 HA THR 143 -11.246 4.763 -4.531 1046 HB THR 143 HB THR 143 -9.238 4.611 -6.832 1047 HG1 THR 143 HG1 THR 143 -10.804 6.300 -7.015 1048 HG21 THR 143 3HG2 THR 143 -10.009 2.372 -6.188 1049 HG22 THR 143 1HG2 THR 143 -10.722 2.845 -7.732 1050 HG23 THR 143 2HG2 THR 143 -11.689 2.915 -6.255 1051 H LEU 144 H LEU 144 -10.849 2.989 -3.217 1052 HA LEU 144 HA LEU 144 -8.057 2.401 -2.413 1053 HB2 LEU 144 2HB LEU 144 -10.595 2.716 -0.809 1054 HB3 LEU 144 1HB LEU 144 -9.448 1.513 -0.265 1055 HG LEU 144 HG LEU 144 -9.282 3.729 0.919 1056 HD11 LEU 144 1HD1 LEU 144 -6.751 2.916 -0.543 1057 HD12 LEU 144 2HD1 LEU 144 -7.380 2.169 0.926 1058 HD13 LEU 144 3HD1 LEU 144 -6.841 3.846 0.957 1059 HD21 LEU 144 3HD2 LEU 144 -8.189 4.767 -1.717 1060 HD22 LEU 144 1HD2 LEU 144 -8.226 5.639 -0.181 1061 HD23 LEU 144 2HD2 LEU 144 -9.732 5.218 -0.990 1062 H ASP 145 H ASP 145 -7.581 0.586 -3.572 1063 HA ASP 145 HA ASP 145 -9.331 -1.784 -3.208 1064 HB2 ASP 145 2HB ASP 145 -7.363 -1.111 -5.419 1065 HB3 ASP 145 1HB ASP 145 -7.943 -2.751 -5.156 1066 H PHE 146 H PHE 146 -8.627 -2.715 -1.456 1067 HA PHE 146 HA PHE 146 -5.930 -3.055 -0.558 1068 HB2 PHE 146 2HB PHE 146 -8.159 -4.955 0.264 1069 HB3 PHE 146 1HB PHE 146 -6.867 -4.264 1.252 1070 HD1 PHE 146 HD2 PHE 146 -6.938 -1.638 1.552 1071 HD2 PHE 146 HD1 PHE 146 -10.310 -4.016 0.421 1072 HE1 PHE 146 HE2 PHE 146 -8.449 0.194 2.178 1073 HE2 PHE 146 HE1 PHE 146 -11.813 -2.174 1.045 1074 HZ PHE 146 HZ PHE 146 -10.887 -0.073 1.920 1075 H ASN 147 H ASN 147 -7.708 -4.490 -2.996 1076 HA ASN 147 HA ASN 147 -6.255 -6.983 -3.217 1077 HB2 ASN 147 2HB ASN 147 -8.274 -5.681 -5.089 1078 HB3 ASN 147 1HB ASN 147 -7.644 -7.320 -5.237 1079 HD21 ASN 147 1HD2 ASN 147 -9.600 -8.331 -5.031 1080 HD22 ASN 147 2HD2 ASN 147 -10.537 -8.322 -3.580 1081 H LEU 148 H LEU 148 -5.326 -3.875 -3.804 1082 HA LEU 148 HA LEU 148 -3.452 -4.706 -5.955 1083 HB2 LEU 148 2HB LEU 148 -4.069 -1.856 -5.063 1084 HB3 LEU 148 1HB LEU 148 -3.074 -2.335 -6.429 1085 HG LEU 148 HG LEU 148 -6.089 -2.487 -6.175 1086 HD11 LEU 148 1HD1 LEU 148 -6.136 -1.049 -8.146 1087 HD12 LEU 148 2HD1 LEU 148 -4.369 -1.045 -8.205 1088 HD13 LEU 148 3HD1 LEU 148 -5.210 -0.304 -6.842 1089 HD21 LEU 148 3HD2 LEU 148 -6.179 -3.516 -8.418 1090 HD22 LEU 148 1HD2 LEU 148 -5.459 -4.572 -7.206 1091 HD23 LEU 148 2HD2 LEU 148 -4.430 -3.737 -8.367 1092 H ALA 149 H ALA 149 -3.435 -5.237 -2.985 1093 HA ALA 149 HA ALA 149 -1.279 -3.580 -1.910 1094 HB1 ALA 149 3HB ALA 149 -3.203 -4.131 -0.462 1095 HB2 ALA 149 1HB ALA 149 -1.699 -4.763 0.208 1096 HB3 ALA 149 2HB ALA 149 -2.831 -5.850 -0.606 1097 H TYR 150 H TYR 150 0.756 -4.280 -1.467 1098 HA TYR 150 HA TYR 150 1.633 -6.775 -2.818 1099 HB2 TYR 150 2HB TYR 150 3.399 -4.369 -2.229 1100 HB3 TYR 150 1HB TYR 150 3.698 -5.679 -3.369 1101 HD1 TYR 150 HD1 TYR 150 1.884 -5.862 -5.350 1102 HD2 TYR 150 HD2 TYR 150 2.616 -2.314 -3.073 1103 HE1 TYR 150 HE1 TYR 150 0.909 -4.497 -7.146 1104 HE2 TYR 150 HE2 TYR 150 1.652 -0.952 -4.876 1105 HH TYR 150 HH TYR 150 1.187 -1.061 -7.230 1106 H SER 151 H SER 151 3.350 -7.969 -1.871 1107 HA SER 151 HA SER 151 3.207 -8.294 0.941 1108 HB2 SER 151 2HB SER 151 5.105 -9.525 -1.103 1109 HB3 SER 151 1HB SER 151 4.864 -10.099 0.548 1110 HG SER 151 HG SER 151 3.611 -11.152 -1.211 1111 HA PRO 152 HA PRO 152 6.349 -5.203 2.089 1112 HB2 PRO 152 2HB PRO 152 6.327 -6.701 4.702 1113 HB3 PRO 152 1HB PRO 152 6.056 -4.973 4.388 1114 HG2 PRO 152 2HG PRO 152 4.021 -6.534 5.017 1115 HG3 PRO 152 1HG PRO 152 3.835 -5.293 3.751 1116 HD2 PRO 152 2HD PRO 152 4.295 -8.263 3.422 1117 HD3 PRO 152 1HD PRO 152 3.139 -7.203 2.580 1118 H PHE 153 H PHE 153 8.527 -5.171 1.918 1119 HA PHE 153 HA PHE 153 10.219 -7.309 1.476 1120 HB2 PHE 153 2HB PHE 153 10.881 -4.564 2.652 1121 HB3 PHE 153 1HB PHE 153 12.062 -5.677 1.975 1122 HD1 PHE 153 HD1 PHE 153 9.168 -3.482 1.128 1123 HD2 PHE 153 HD2 PHE 153 12.429 -5.801 -0.388 1124 HE1 PHE 153 HE1 PHE 153 8.853 -2.479 -1.102 1125 HE2 PHE 153 HE2 PHE 153 12.100 -4.804 -2.602 1126 HZ PHE 153 HZ PHE 153 10.322 -3.137 -2.967 1127 H CYS 154 H CYS 154 9.451 -5.592 4.464 1128 HA CYS 154 HA CYS 154 11.504 -6.675 6.080 1129 HB2 CYS 154 2HB CYS 154 10.340 -5.535 7.906 1130 HB3 CYS 154 1HB CYS 154 10.389 -4.494 6.488 1131 HG CYS 154 HG CYS 154 7.798 -4.602 5.871 1132 H ALA 155 H ALA 155 7.976 -7.377 5.876 1133 HA ALA 155 HA ALA 155 7.702 -9.246 7.871 1134 HB1 ALA 155 3HB ALA 155 6.314 -9.259 5.169 1135 HB2 ALA 155 1HB ALA 155 5.827 -8.316 6.577 1136 HB3 ALA 155 2HB ALA 155 5.739 -10.079 6.624 1137 H TYR 156 H TYR 156 8.664 -9.848 4.519 1138 HA TYR 156 HA TYR 156 9.061 -12.696 4.924 1139 HB2 TYR 156 2HB TYR 156 9.430 -10.918 2.484 1140 HB3 TYR 156 1HB TYR 156 9.687 -12.664 2.468 1141 HD1 TYR 156 HD1 TYR 156 7.051 -10.138 3.397 1142 HD2 TYR 156 HD2 TYR 156 7.834 -14.064 1.899 1143 HE1 TYR 156 HE1 TYR 156 4.649 -10.478 3.035 1144 HE2 TYR 156 HE2 TYR 156 5.425 -14.392 1.528 1145 HH TYR 156 HH TYR 156 3.327 -13.578 2.217 1146 H SER 157 H SER 157 11.111 -9.966 5.267 1147 HA SER 157 HA SER 157 13.371 -11.707 5.856 1148 HB2 SER 157 2HB SER 157 13.529 -9.593 3.678 1149 HB3 SER 157 1HB SER 157 14.963 -10.227 4.492 1150 HG SER 157 HG SER 157 13.106 -11.981 3.315 1151 H ASP 158 H ASP 158 14.381 -11.012 7.610 1152 HA ASP 158 HA ASP 158 13.426 -8.683 9.039 1153 HB2 ASP 158 2HB ASP 158 15.586 -10.714 9.786 1154 HB3 ASP 158 1HB ASP 158 14.934 -9.486 10.869 1155 H THR 159 H THR 159 16.131 -9.398 6.988 1156 HA THR 159 HA THR 159 18.000 -7.477 7.855 1157 HB THR 159 HB THR 159 18.632 -9.326 6.342 1158 HG1 THR 159 HG1 THR 159 19.573 -6.967 6.303 1159 HG21 THR 159 3HG2 THR 159 17.105 -7.846 4.159 1160 HG22 THR 159 1HG2 THR 159 16.605 -9.367 4.899 1161 HG23 THR 159 2HG2 THR 159 18.081 -9.300 3.936 1162 H PHE 160 H PHE 160 15.057 -7.136 6.020 1163 HA PHE 160 HA PHE 160 15.570 -4.290 5.467 1164 HB2 PHE 160 2HB PHE 160 13.050 -5.963 4.998 1165 HB3 PHE 160 1HB PHE 160 13.299 -4.307 4.460 1166 HD1 PHE 160 HD2 PHE 160 14.208 -7.834 3.877 1167 HD2 PHE 160 HD1 PHE 160 14.663 -3.832 2.465 1168 HE1 PHE 160 HE2 PHE 160 15.100 -8.685 1.751 1169 HE2 PHE 160 HE1 PHE 160 15.555 -4.696 0.336 1170 HZ PHE 160 HZ PHE 160 15.778 -7.118 -0.023 1171 H SER 161 H SER 161 15.057 -2.808 7.001 1172 HA SER 161 HA SER 161 14.124 -3.661 9.584 1173 HB2 SER 161 2HB SER 161 14.694 -0.834 8.604 1174 HB3 SER 161 1HB SER 161 14.618 -1.373 10.285 1175 HG SER 161 HG SER 161 16.421 -2.562 8.462 1176 H CYS 162 H CYS 162 12.062 -3.511 10.425 1177 HA CYS 162 HA CYS 162 9.945 -3.306 8.508 1178 HB2 CYS 162 2HB CYS 162 8.561 -4.140 10.447 1179 HB3 CYS 162 1HB CYS 162 9.984 -5.128 10.131 1180 HG CYS 162 HG CYS 162 9.707 -2.800 12.609 1181 HA PRO 163 HA PRO 163 8.182 0.705 9.647 1182 HB2 PRO 163 2HB PRO 163 5.413 -0.318 9.426 1183 HB3 PRO 163 1HB PRO 163 6.277 0.791 8.348 1184 HG2 PRO 163 2HG PRO 163 5.587 -1.746 7.634 1185 HG3 PRO 163 1HG PRO 163 6.985 -0.881 6.954 1186 HD2 PRO 163 2HD PRO 163 6.923 -2.985 9.105 1187 HD3 PRO 163 1HD PRO 163 8.092 -2.751 7.782 1188 H LEU 164 H LEU 164 6.901 1.748 11.309 1189 HA LEU 164 HA LEU 164 6.016 0.080 13.589 1190 HB2 LEU 164 2HB LEU 164 6.869 3.020 13.514 1191 HB3 LEU 164 1HB LEU 164 6.041 2.292 14.878 1192 HG LEU 164 HG LEU 164 7.999 0.707 15.151 1193 HD11 LEU 164 1HD1 LEU 164 9.378 2.495 13.130 1194 HD12 LEU 164 2HD1 LEU 164 8.957 0.798 12.907 1195 HD13 LEU 164 3HD1 LEU 164 10.158 1.251 14.113 1196 HD21 LEU 164 3HD2 LEU 164 9.461 2.362 16.249 1197 HD22 LEU 164 1HD2 LEU 164 7.757 2.673 16.582 1198 HD23 LEU 164 2HD2 LEU 164 8.621 3.668 15.408 1199 HA PRO 165 HA PRO 165 2.307 1.355 11.100 1200 HB2 PRO 165 2HB PRO 165 1.015 -0.904 12.615 1201 HB3 PRO 165 1HB PRO 165 1.078 -0.608 10.863 1202 HG2 PRO 165 2HG PRO 165 2.536 -2.553 11.949 1203 HG3 PRO 165 1HG PRO 165 3.201 -1.553 10.631 1204 HD2 PRO 165 2HD PRO 165 3.702 -1.336 13.602 1205 HD3 PRO 165 1HD PRO 165 4.865 -1.266 12.259 1206 HA PRO 166 HA PRO 166 0.604 3.781 14.604 1207 HB2 PRO 166 2HB PRO 166 -1.031 5.388 13.058 1208 HB3 PRO 166 1HB PRO 166 0.705 5.693 13.255 1209 HG2 PRO 166 2HG PRO 166 -0.735 4.368 10.993 1210 HG3 PRO 166 1HG PRO 166 0.606 5.533 10.943 1211 HD2 PRO 166 2HD PRO 166 0.998 2.866 10.597 1212 HD3 PRO 166 1HD PRO 166 2.215 3.910 11.361 1213 H GLU 167 H GLU 167 -1.324 3.510 15.748 1214 HA GLU 167 HA GLU 167 -2.631 1.098 15.513 1215 HB2 GLU 167 2HB GLU 167 -3.619 3.569 16.984 1216 HB3 GLU 167 1HB GLU 167 -4.253 1.943 17.215 1217 HG2 GLU 167 2HG GLU 167 -1.923 1.232 17.897 1218 HG3 GLU 167 1HG GLU 167 -1.479 2.939 17.879 1219 H SER 168 H SER 168 -3.588 4.056 13.971 1220 HA SER 168 HA SER 168 -6.326 3.229 13.443 1221 HB2 SER 168 2HB SER 168 -5.760 5.580 14.041 1222 HB3 SER 168 1HB SER 168 -4.856 5.734 12.534 1223 HG SER 168 HG SER 168 -7.597 5.033 12.704 1224 H ASN 169 H ASN 169 -3.471 2.381 11.930 1225 HA ASN 169 HA ASN 169 -4.685 2.246 9.233 1226 HB2 ASN 169 2HB ASN 169 -2.554 1.926 8.288 1227 HB3 ASN 169 1HB ASN 169 -2.228 3.066 9.580 1228 HD21 ASN 169 1HD2 ASN 169 -0.323 1.366 8.262 1229 HD22 ASN 169 2HD2 ASN 169 0.363 0.333 9.467 1230 H TRP 170 H TRP 170 -4.534 0.480 12.036 1231 HA TRP 170 HA TRP 170 -4.314 -2.201 10.952 1232 HB2 TRP 170 2HB TRP 170 -5.328 -1.273 13.679 1233 HB3 TRP 170 1HB TRP 170 -5.000 -2.941 13.231 1234 HD1 TRP 170 HD1 TRP 170 -2.055 -1.864 11.821 1235 HE1 TRP 170 HE1 TRP 170 -0.119 -1.578 13.490 1236 HE3 TRP 170 HE3 TRP 170 -4.733 -1.651 16.179 1237 HZ2 TRP 170 HZ2 TRP 170 0.242 -1.317 16.270 1238 HZ3 TRP 170 HZ3 TRP 170 -3.514 -1.396 18.306 1239 HH2 TRP 170 HH2 TRP 170 -1.073 -1.233 18.350 1240 H LEU 171 H LEU 171 -5.937 -2.824 9.590 1241 HA LEU 171 HA LEU 171 -8.667 -1.870 9.856 1242 HB2 LEU 171 2HB LEU 171 -7.516 -4.022 8.023 1243 HB3 LEU 171 1HB LEU 171 -9.130 -3.334 7.905 1244 HG LEU 171 HG LEU 171 -6.507 -1.881 7.382 1245 HD11 LEU 171 1HD1 LEU 171 -7.272 -1.735 5.052 1246 HD12 LEU 171 2HD1 LEU 171 -8.717 -2.669 5.454 1247 HD13 LEU 171 3HD1 LEU 171 -7.120 -3.413 5.573 1248 HD21 LEU 171 3HD2 LEU 171 -7.874 0.058 6.699 1249 HD22 LEU 171 1HD2 LEU 171 -8.080 -0.322 8.407 1250 HD23 LEU 171 2HD2 LEU 171 -9.331 -0.772 7.248 1251 H GLU 172 H GLU 172 -9.996 -2.742 11.385 1252 HA GLU 172 HA GLU 172 -9.335 -5.273 12.663 1253 HB2 GLU 172 2HB GLU 172 -10.026 -3.127 13.890 1254 HB3 GLU 172 1HB GLU 172 -11.655 -3.381 13.279 1255 HG2 GLU 172 2HG GLU 172 -11.689 -4.220 15.482 1256 HG3 GLU 172 1HG GLU 172 -11.586 -5.656 14.466 1257 H THR 173 H THR 173 -9.889 -5.889 10.194 1258 HA THR 173 HA THR 173 -12.131 -7.669 10.288 1259 HB THR 173 HB THR 173 -13.318 -5.637 9.516 1260 HG1 THR 173 HG1 THR 173 -14.304 -7.232 8.554 1261 HG21 THR 173 3HG2 THR 173 -11.446 -4.413 8.444 1262 HG22 THR 173 1HG2 THR 173 -12.819 -4.578 7.347 1263 HG23 THR 173 2HG2 THR 173 -11.404 -5.612 7.147 1264 H ALA 174 H ALA 174 -12.103 -9.068 8.299 1265 HA ALA 174 HA ALA 174 -9.326 -9.619 7.504 1266 HB1 ALA 174 3HB ALA 174 -11.828 -11.346 7.262 1267 HB2 ALA 174 1HB ALA 174 -10.595 -11.473 8.520 1268 HB3 ALA 174 2HB ALA 174 -10.186 -11.847 6.846 1269 H VAL 175 H VAL 175 -8.630 -9.214 5.499 1270 HA VAL 175 HA VAL 175 -10.518 -8.402 3.379 1271 HB VAL 175 HB VAL 175 -7.481 -8.000 3.510 1272 HG11 VAL 175 1HG1 VAL 175 -7.751 -6.597 1.485 1273 HG12 VAL 175 2HG1 VAL 175 -9.467 -7.001 1.429 1274 HG13 VAL 175 3HG1 VAL 175 -8.257 -8.261 1.187 1275 HG21 VAL 175 3HG2 VAL 175 -7.997 -5.587 3.822 1276 HG22 VAL 175 1HG2 VAL 175 -8.655 -6.568 5.135 1277 HG23 VAL 175 2HG2 VAL 175 -9.722 -5.963 3.868 1278 H THR 176 H THR 176 -11.213 -10.492 2.848 1279 HA THR 176 HA THR 176 -9.293 -12.549 2.118 1280 HB THR 176 HB THR 176 -11.412 -13.910 1.751 1281 HG1 THR 176 HG1 THR 176 -12.924 -12.338 1.308 1282 HG21 THR 176 3HG2 THR 176 -12.006 -14.073 4.140 1283 HG22 THR 176 1HG2 THR 176 -11.184 -12.543 4.460 1284 HG23 THR 176 2HG2 THR 176 -10.257 -13.954 3.941 1285 H ALA 177 H ALA 177 -8.381 -12.317 0.161 1286 HA ALA 177 HA ALA 177 -9.990 -12.321 -2.245 1287 HB1 ALA 177 3HB ALA 177 -8.974 -10.296 -3.244 1288 HB2 ALA 177 1HB ALA 177 -8.129 -9.964 -1.728 1289 HB3 ALA 177 2HB ALA 177 -9.889 -9.889 -1.792 1290 H GLY 178 H GLY 178 -8.790 -12.927 -4.086 1291 HA2 GLY 178 2HA GLY 178 -7.288 -14.236 -5.202 1292 HA3 GLY 178 1HA GLY 178 -6.107 -13.161 -4.484 1293 H GLU 179 H GLU 179 -4.541 -14.717 -4.378 1294 HA GLU 179 HA GLU 179 -4.902 -17.198 -2.927 1295 HB2 GLU 179 2HB GLU 179 -2.380 -15.909 -4.062 1296 HB3 GLU 179 1HB GLU 179 -2.461 -17.525 -3.371 1297 HG2 GLU 179 2HG GLU 179 -3.838 -16.554 -5.887 1298 HG3 GLU 179 1HG GLU 179 -2.471 -17.661 -5.791 1299 H ARG 180 H ARG 180 -3.838 -17.768 -1.019 1300 HA ARG 180 HA ARG 180 -2.904 -15.602 0.747 1301 HB2 ARG 180 2HB ARG 180 -4.406 -16.184 2.499 1302 HB3 ARG 180 1HB ARG 180 -5.414 -16.123 1.068 1303 HG2 ARG 180 2HG ARG 180 -4.371 -18.687 2.333 1304 HG3 ARG 180 1HG ARG 180 -5.960 -17.994 2.645 1305 HD2 ARG 180 2HD ARG 180 -6.621 -18.347 0.323 1306 HD3 ARG 180 1HD ARG 180 -4.994 -18.899 -0.090 1307 HE ARG 180 HE ARG 180 -5.591 -20.677 1.766 1308 HH11 ARG 180 1HH1 ARG 180 -7.640 -19.545 -0.863 1309 HH12 ARG 180 2HH1 ARG 180 -8.514 -21.040 -0.974 1310 HH21 ARG 180 1HH2 ARG 180 -6.730 -22.625 1.577 1311 HH22 ARG 180 2HH2 ARG 180 -7.998 -22.775 0.402 1312 H THR 181 H THR 181 -0.957 -16.229 1.721 1313 HA THR 181 HA THR 181 -0.309 -19.071 1.979 1314 HB THR 181 HB THR 181 1.953 -18.180 2.666 1315 HG1 THR 181 HG1 THR 181 1.277 -16.167 3.533 1316 HG21 THR 181 3HG2 THR 181 1.505 -18.646 0.272 1317 HG22 THR 181 1HG2 THR 181 2.599 -17.274 0.461 1318 HG23 THR 181 2HG2 THR 181 0.902 -17.002 0.063 1319 H ASP 182 H ASP 182 -1.406 -19.949 3.770 1320 HA ASP 182 HA ASP 182 -1.093 -18.754 6.409 1321 HB2 ASP 182 2HB ASP 182 -2.433 -20.613 7.217 1322 HB3 ASP 182 1HB ASP 182 -3.182 -20.001 5.751 1323 H LEU 183 H LEU 183 -0.574 -20.937 8.027 1324 HA LEU 183 HA LEU 183 2.249 -21.022 7.986 1325 HB2 LEU 183 2HB LEU 183 2.160 -22.371 9.973 1326 HB3 LEU 183 1HB LEU 183 0.929 -21.136 10.087 1327 HG LEU 183 HG LEU 183 0.317 -24.026 9.350 1328 HD11 LEU 183 1HD1 LEU 183 1.302 -23.992 11.589 1329 HD12 LEU 183 2HD1 LEU 183 -0.416 -24.361 11.671 1330 HD13 LEU 183 3HD1 LEU 183 0.157 -22.747 12.104 1331 HD21 LEU 183 3HD2 LEU 183 -1.992 -23.476 9.994 1332 HD22 LEU 183 1HD2 LEU 183 -1.440 -22.471 8.656 1333 HD23 LEU 183 2HD2 LEU 183 -1.524 -21.798 10.287 1334 H GLU 184 H GLU 184 -0.167 -23.443 7.043 1335 HA GLU 184 HA GLU 184 1.854 -25.453 6.353 1336 HB2 GLU 184 2HB GLU 184 -1.188 -25.489 6.173 1337 HB3 GLU 184 1HB GLU 184 -0.163 -26.847 5.710 1338 HG2 GLU 184 2HG GLU 184 -0.492 -25.647 8.465 1339 HG3 GLU 184 1HG GLU 184 -1.054 -27.224 7.917 1340 H HIS 185 H HIS 185 1.933 -26.422 4.210 1341 HA HIS 185 HA HIS 185 0.918 -25.094 1.900 1342 HB2 HIS 185 2HB HIS 185 3.217 -24.293 1.064 1343 HB3 HIS 185 1HB HIS 185 2.476 -23.336 2.336 1344 HD1 HIS 185 HD1 HIS 185 3.513 -23.713 4.804 1345 HD2 HIS 185 HD2 HIS 185 5.780 -25.147 1.634 1346 HE1 HIS 185 HE1 HIS 185 5.814 -24.067 5.732 1347 HE2 HIS 185 HE2 HIS 185 7.201 -24.761 3.754 Start of MODEL 13 1 H1 MET 1 1H MET 1 -20.697 0.919 -17.694 2 H2 MET 1 2H MET 1 -21.515 2.383 -17.481 3 H3 MET 1 3H MET 1 -20.262 1.945 -16.431 4 HA MET 1 HA MET 1 -19.969 2.491 -19.321 5 HB2 MET 1 2HB MET 1 -18.945 4.183 -16.996 6 HB3 MET 1 1HB MET 1 -18.899 4.584 -18.708 7 HG2 MET 1 2HG MET 1 -21.399 4.380 -17.011 8 HG3 MET 1 1HG MET 1 -20.607 5.873 -17.521 9 HE1 MET 1 3HE MET 1 -23.120 6.603 -18.421 10 HE2 MET 1 1HE MET 1 -23.727 5.015 -17.943 11 HE3 MET 1 2HE MET 1 -24.014 5.615 -19.575 12 H ASP 2 H ASP 2 -18.727 0.639 -19.709 13 HA ASP 2 HA ASP 2 -16.874 -0.425 -17.832 14 HB2 ASP 2 2HB ASP 2 -17.323 -1.076 -20.774 15 HB3 ASP 2 1HB ASP 2 -16.146 -1.932 -19.783 16 H GLU 3 H GLU 3 -16.419 1.694 -20.646 17 HA GLU 3 HA GLU 3 -13.661 1.591 -20.990 18 HB2 GLU 3 2HB GLU 3 -15.509 3.986 -21.342 19 HB3 GLU 3 1HB GLU 3 -13.831 3.954 -21.884 20 HG2 GLU 3 2HG GLU 3 -14.334 2.107 -23.418 21 HG3 GLU 3 1HG GLU 3 -16.010 2.081 -22.862 22 H ASP 4 H ASP 4 -15.496 3.607 -18.707 23 HA ASP 4 HA ASP 4 -13.329 4.986 -17.500 24 HB2 ASP 4 2HB ASP 4 -15.592 5.825 -17.174 25 HB3 ASP 4 1HB ASP 4 -16.121 4.302 -16.475 26 H THR 5 H THR 5 -15.065 2.025 -16.664 27 HA THR 5 HA THR 5 -13.818 1.555 -14.175 28 HB THR 5 HB THR 5 -15.292 -0.436 -15.961 29 HG1 THR 5 HG1 THR 5 -16.158 1.808 -14.584 30 HG21 THR 5 3HG2 THR 5 -14.981 -0.303 -12.937 31 HG22 THR 5 1HG2 THR 5 -14.263 -1.518 -14.006 32 HG23 THR 5 2HG2 THR 5 -16.014 -1.443 -13.800 33 H GLU 6 H GLU 6 -12.957 0.619 -17.474 34 HA GLU 6 HA GLU 6 -10.964 -1.343 -16.575 35 HB2 GLU 6 2HB GLU 6 -10.800 -2.073 -18.862 36 HB3 GLU 6 1HB GLU 6 -12.512 -1.895 -18.488 37 HG2 GLU 6 2HG GLU 6 -12.460 0.347 -19.627 38 HG3 GLU 6 1HG GLU 6 -10.798 0.005 -20.118 39 H ASP 7 H ASP 7 -11.155 1.979 -17.455 40 HA ASP 7 HA ASP 7 -8.538 2.467 -18.426 41 HB2 ASP 7 2HB ASP 7 -10.435 4.147 -18.468 42 HB3 ASP 7 1HB ASP 7 -10.235 4.361 -16.737 43 H TRP 8 H TRP 8 -9.897 2.393 -15.133 44 HA TRP 8 HA TRP 8 -7.907 2.468 -13.359 45 HB2 TRP 8 2HB TRP 8 -10.112 1.669 -12.712 46 HB3 TRP 8 1HB TRP 8 -9.959 0.248 -13.728 47 HD1 TRP 8 HD1 TRP 8 -8.403 1.654 -10.440 48 HE1 TRP 8 HE1 TRP 8 -7.875 -0.331 -8.901 49 HE3 TRP 8 HE3 TRP 8 -9.586 -2.208 -13.603 50 HZ2 TRP 8 HZ2 TRP 8 -7.965 -3.153 -8.983 51 HZ3 TRP 8 HZ3 TRP 8 -9.328 -4.524 -12.793 52 HH2 TRP 8 HH2 TRP 8 -8.528 -4.982 -10.525 53 H GLU 9 H GLU 9 -8.504 -0.510 -15.251 54 HA GLU 9 HA GLU 9 -6.176 -1.906 -14.481 55 HB2 GLU 9 2HB GLU 9 -8.237 -3.019 -15.309 56 HB3 GLU 9 1HB GLU 9 -7.975 -2.337 -16.912 57 HG2 GLU 9 2HG GLU 9 -5.838 -3.633 -17.080 58 HG3 GLU 9 1HG GLU 9 -6.182 -4.350 -15.505 59 H THR 10 H THR 10 -6.735 0.405 -17.043 60 HA THR 10 HA THR 10 -4.777 -0.484 -18.906 61 HB THR 10 HB THR 10 -6.091 2.269 -18.668 62 HG1 THR 10 HG1 THR 10 -7.234 -0.046 -19.104 63 HG21 THR 10 3HG2 THR 10 -4.136 2.259 -20.208 64 HG22 THR 10 1HG2 THR 10 -5.651 2.442 -21.100 65 HG23 THR 10 2HG2 THR 10 -4.824 0.883 -21.074 66 H GLN 11 H GLN 11 -4.795 2.473 -16.812 67 HA GLN 11 HA GLN 11 -1.997 2.913 -16.966 68 HB2 GLN 11 2HB GLN 11 -2.363 4.472 -15.041 69 HB3 GLN 11 1HB GLN 11 -3.468 4.734 -16.385 70 HG2 GLN 11 2HG GLN 11 -5.211 3.427 -15.105 71 HG3 GLN 11 1HG GLN 11 -4.109 3.412 -13.730 72 HE21 GLN 11 1HE2 GLN 11 -6.159 5.412 -15.749 73 HE22 GLN 11 2HE2 GLN 11 -6.206 6.772 -14.683 74 H LEU 12 H LEU 12 -3.973 0.951 -14.832 75 HA LEU 12 HA LEU 12 -2.303 0.684 -12.594 76 HB2 LEU 12 2HB LEU 12 -4.737 0.003 -12.779 77 HB3 LEU 12 1HB LEU 12 -4.217 -1.424 -13.654 78 HG LEU 12 HG LEU 12 -2.888 -2.092 -11.591 79 HD11 LEU 12 1HD1 LEU 12 -3.433 -1.033 -9.452 80 HD12 LEU 12 2HD1 LEU 12 -4.419 0.174 -10.279 81 HD13 LEU 12 3HD1 LEU 12 -2.677 0.107 -10.559 82 HD21 LEU 12 3HD2 LEU 12 -5.037 -3.133 -12.101 83 HD22 LEU 12 1HD2 LEU 12 -5.898 -1.838 -11.264 84 HD23 LEU 12 2HD2 LEU 12 -4.852 -2.937 -10.361 85 H GLN 13 H GLN 13 -2.591 -1.386 -15.486 86 HA GLN 13 HA GLN 13 -1.043 -3.544 -14.612 87 HB2 GLN 13 2HB GLN 13 -0.963 -4.240 -16.986 88 HB3 GLN 13 1HB GLN 13 -2.576 -3.725 -16.501 89 HG2 GLN 13 2HG GLN 13 -2.129 -1.501 -17.572 90 HG3 GLN 13 1HG GLN 13 -0.599 -2.139 -18.171 91 HE21 GLN 13 1HE2 GLN 13 -4.079 -2.347 -18.411 92 HE22 GLN 13 2HE2 GLN 13 -4.119 -3.173 -19.927 93 H ALA 14 H ALA 14 -0.036 -0.537 -16.141 94 HA ALA 14 HA ALA 14 2.691 -1.248 -16.637 95 HB1 ALA 14 3HB ALA 14 1.399 1.487 -16.344 96 HB2 ALA 14 1HB ALA 14 1.574 0.578 -17.845 97 HB3 ALA 14 2HB ALA 14 3.007 1.173 -17.005 98 H ASN 15 H ASN 15 0.987 0.452 -14.015 99 HA ASN 15 HA ASN 15 3.194 1.132 -12.386 100 HB2 ASN 15 2HB ASN 15 0.309 0.616 -11.511 101 HB3 ASN 15 1HB ASN 15 1.526 1.477 -10.570 102 HD21 ASN 15 1HD2 ASN 15 -1.038 2.492 -11.348 103 HD22 ASN 15 2HD2 ASN 15 -0.760 3.870 -12.349 104 H ARG 16 H ARG 16 1.217 -1.797 -12.612 105 HA ARG 16 HA ARG 16 2.254 -3.110 -10.275 106 HB2 ARG 16 2HB ARG 16 1.096 -4.567 -12.698 107 HB3 ARG 16 1HB ARG 16 1.143 -5.119 -11.030 108 HG2 ARG 16 2HG ARG 16 -0.623 -3.003 -12.234 109 HG3 ARG 16 1HG ARG 16 -1.108 -4.565 -11.584 110 HD2 ARG 16 2HD ARG 16 0.004 -2.228 -9.992 111 HD3 ARG 16 1HD ARG 16 -1.682 -2.749 -10.036 112 HE ARG 16 HE ARG 16 -0.355 -4.979 -9.234 113 HH11 ARG 16 1HH1 ARG 16 -0.458 -1.678 -7.997 114 HH12 ARG 16 2HH1 ARG 16 -0.177 -2.160 -6.359 115 HH21 ARG 16 1HH2 ARG 16 0.008 -5.578 -7.097 116 HH22 ARG 16 2HH2 ARG 16 0.085 -4.380 -5.850 117 H ASP 17 H ASP 17 2.892 -3.174 -13.742 118 HA ASP 17 HA ASP 17 4.489 -5.404 -13.952 119 HB2 ASP 17 2HB ASP 17 3.586 -4.359 -15.944 120 HB3 ASP 17 1HB ASP 17 4.433 -2.852 -15.621 121 H GLU 18 H GLU 18 5.555 -1.999 -13.669 122 HA GLU 18 HA GLU 18 8.326 -2.563 -13.508 123 HB2 GLU 18 2HB GLU 18 8.632 -0.229 -12.852 124 HB3 GLU 18 1HB GLU 18 7.516 -0.366 -14.206 125 HG2 GLU 18 2HG GLU 18 5.609 -0.003 -12.732 126 HG3 GLU 18 1HG GLU 18 6.673 0.025 -11.322 127 H LYS 19 H LYS 19 5.862 -2.256 -10.973 128 HA LYS 19 HA LYS 19 7.759 -2.248 -8.799 129 HB2 LYS 19 2HB LYS 19 5.466 -1.153 -8.722 130 HB3 LYS 19 1HB LYS 19 4.758 -2.763 -8.644 131 HG2 LYS 19 2HG LYS 19 4.963 -1.586 -6.418 132 HG3 LYS 19 1HG LYS 19 5.727 -3.179 -6.476 133 HD2 LYS 19 2HD LYS 19 7.934 -2.218 -6.616 134 HD3 LYS 19 1HD LYS 19 7.288 -0.611 -6.941 135 HE2 LYS 19 2HE LYS 19 6.861 -2.063 -4.308 136 HE3 LYS 19 1HE LYS 19 8.203 -0.954 -4.605 137 HZ1 LYS 19 3HZ LYS 19 6.387 0.208 -3.547 138 HZ2 LYS 19 1HZ LYS 19 5.316 -0.269 -4.767 139 HZ3 LYS 19 2HZ LYS 19 6.583 0.783 -5.121 140 H ASP 20 H ASP 20 6.145 -4.648 -10.670 141 HA ASP 20 HA ASP 20 6.433 -6.888 -8.886 142 HB2 ASP 20 2HB ASP 20 4.662 -7.000 -10.515 143 HB3 ASP 20 1HB ASP 20 5.755 -6.641 -11.843 144 H ARG 21 H ARG 21 8.059 -5.848 -11.901 145 HA ARG 21 HA ARG 21 10.089 -7.846 -11.896 146 HB2 ARG 21 2HB ARG 21 11.205 -6.526 -13.661 147 HB3 ARG 21 1HB ARG 21 9.482 -6.672 -13.965 148 HG2 ARG 21 2HG ARG 21 9.807 -4.463 -14.509 149 HG3 ARG 21 1HG ARG 21 9.360 -4.301 -12.817 150 HD2 ARG 21 2HD ARG 21 11.968 -4.326 -12.396 151 HD3 ARG 21 1HD ARG 21 12.068 -3.947 -14.119 152 HE ARG 21 HE ARG 21 10.316 -2.270 -12.507 153 HH11 ARG 21 1HH1 ARG 21 13.497 -2.543 -14.012 154 HH12 ARG 21 2HH1 ARG 21 13.805 -0.841 -13.910 155 HH21 ARG 21 1HH2 ARG 21 10.773 -0.083 -12.326 156 HH22 ARG 21 2HH2 ARG 21 12.259 0.549 -12.957 157 H PHE 22 H PHE 22 9.722 -4.894 -10.175 158 HA PHE 22 HA PHE 22 12.340 -4.110 -9.544 159 HB2 PHE 22 2HB PHE 22 10.209 -2.831 -9.101 160 HB3 PHE 22 1HB PHE 22 9.838 -3.945 -7.796 161 HD1 PHE 22 HD1 PHE 22 11.967 -1.141 -8.871 162 HD2 PHE 22 HD2 PHE 22 11.049 -3.799 -5.637 163 HE1 PHE 22 HE1 PHE 22 13.215 0.299 -7.318 164 HE2 PHE 22 HE2 PHE 22 12.308 -2.352 -4.101 165 HZ PHE 22 HZ PHE 22 13.388 -0.304 -4.939 166 H PHE 23 H PHE 23 10.189 -6.487 -7.983 167 HA PHE 23 HA PHE 23 11.805 -7.075 -5.715 168 HB2 PHE 23 2HB PHE 23 9.391 -8.419 -6.984 169 HB3 PHE 23 1HB PHE 23 10.209 -9.170 -5.617 170 HD1 PHE 23 HD2 PHE 23 9.505 -5.503 -6.144 171 HD2 PHE 23 HD1 PHE 23 8.572 -9.041 -3.910 172 HE1 PHE 23 HE2 PHE 23 8.176 -4.168 -4.565 173 HE2 PHE 23 HE1 PHE 23 7.244 -7.689 -2.338 174 HZ PHE 23 HZ PHE 23 7.054 -5.255 -2.659 175 H SER 24 H SER 24 12.243 -7.991 -8.947 176 HA SER 24 HA SER 24 13.851 -10.389 -8.256 177 HB2 SER 24 2HB SER 24 12.321 -9.797 -10.821 178 HB3 SER 24 1HB SER 24 13.299 -11.237 -10.520 179 HG SER 24 HG SER 24 10.885 -10.448 -9.267 180 H GLU 25 H GLU 25 13.803 -7.382 -10.133 181 HA GLU 25 HA GLU 25 16.284 -8.070 -11.550 182 HB2 GLU 25 2HB GLU 25 14.243 -5.852 -12.061 183 HB3 GLU 25 1HB GLU 25 15.690 -6.126 -13.024 184 HG2 GLU 25 2HG GLU 25 13.375 -8.067 -12.746 185 HG3 GLU 25 1HG GLU 25 13.652 -6.988 -14.113 186 H HIS 26 H HIS 26 14.798 -5.599 -9.469 187 HA HIS 26 HA HIS 26 17.222 -3.944 -9.480 188 HB2 HIS 26 2HB HIS 26 15.035 -2.800 -9.695 189 HB3 HIS 26 1HB HIS 26 14.506 -3.488 -8.162 190 HD2 HIS 26 HD2 HIS 26 16.711 -0.594 -9.512 191 HE1 HIS 26 HE1 HIS 26 16.705 -0.456 -5.282 192 HE2 HIS 26 HE2 HIS 26 17.602 0.621 -7.391 193 H ARG 27 H ARG 27 15.040 -5.321 -6.998 194 HA ARG 27 HA ARG 27 17.183 -5.164 -4.993 195 HB2 ARG 27 2HB ARG 27 14.161 -5.039 -4.826 196 HB3 ARG 27 1HB ARG 27 15.050 -5.633 -3.427 197 HG2 ARG 27 2HG ARG 27 15.455 -2.925 -4.739 198 HG3 ARG 27 1HG ARG 27 14.537 -3.226 -3.262 199 HD2 ARG 27 2HD ARG 27 16.503 -3.918 -2.074 200 HD3 ARG 27 1HD ARG 27 17.471 -3.948 -3.551 201 HE ARG 27 HE ARG 27 16.569 -1.353 -3.310 202 HH11 ARG 27 1HH1 ARG 27 18.492 -3.527 -1.287 203 HH12 ARG 27 2HH1 ARG 27 19.411 -2.235 -0.584 204 HH21 ARG 27 1HH2 ARG 27 17.831 0.287 -2.416 205 HH22 ARG 27 2HH2 ARG 27 19.034 -0.083 -1.226 206 H GLN 28 H GLN 28 17.895 -6.910 -3.963 207 HA GLN 28 HA GLN 28 17.396 -9.564 -4.769 208 HB2 GLN 28 2HB GLN 28 18.606 -10.217 -2.669 209 HB3 GLN 28 1HB GLN 28 19.469 -9.006 -3.612 210 HG2 GLN 28 2HG GLN 28 18.522 -7.248 -2.058 211 HG3 GLN 28 1HG GLN 28 17.902 -8.562 -1.062 212 HE21 GLN 28 1HE2 GLN 28 20.781 -6.923 -2.169 213 HE22 GLN 28 2HE2 GLN 28 21.852 -7.597 -0.996 214 H SER 29 H SER 29 16.099 -11.114 -3.920 215 HA SER 29 HA SER 29 13.491 -10.463 -3.661 216 HB2 SER 29 2HB SER 29 14.771 -13.002 -2.589 217 HB3 SER 29 1HB SER 29 13.087 -12.823 -3.106 218 HG SER 29 HG SER 29 15.182 -13.433 -4.598 219 HA PRO 30 HA PRO 30 13.009 -9.406 0.801 220 HB2 PRO 30 2HB PRO 30 10.589 -8.180 0.586 221 HB3 PRO 30 1HB PRO 30 12.089 -7.382 0.076 222 HG2 PRO 30 2HG PRO 30 10.021 -8.734 -1.616 223 HG3 PRO 30 1HG PRO 30 10.890 -7.209 -1.899 224 HD2 PRO 30 2HD PRO 30 11.597 -9.609 -3.066 225 HD3 PRO 30 1HD PRO 30 12.746 -8.279 -2.783 226 H ILE 31 H ILE 31 10.675 -11.050 -1.338 227 HA ILE 31 HA ILE 31 9.709 -12.744 0.799 228 HB ILE 31 HB ILE 31 9.489 -13.219 -2.218 229 HG12 ILE 31 2HG1 ILE 31 8.541 -11.014 -1.856 230 HG13 ILE 31 1HG1 ILE 31 7.193 -12.127 -2.034 231 HG21 ILE 31 1HG2 ILE 31 7.776 -14.254 0.080 232 HG22 ILE 31 2HG2 ILE 31 8.958 -15.192 -0.840 233 HG23 ILE 31 3HG2 ILE 31 7.505 -14.579 -1.633 234 HD11 ILE 31 3HD1 ILE 31 6.735 -10.539 -0.306 235 HD12 ILE 31 1HD1 ILE 31 8.232 -10.935 0.533 236 HD13 ILE 31 2HD1 ILE 31 6.930 -12.127 0.435 237 HA PRO 32 HA PRO 32 13.736 -14.748 1.205 238 HB2 PRO 32 2HB PRO 32 11.905 -17.101 1.750 239 HB3 PRO 32 1HB PRO 32 13.386 -16.610 2.603 240 HG2 PRO 32 2HG PRO 32 11.022 -15.994 3.636 241 HG3 PRO 32 1HG PRO 32 12.353 -14.814 3.679 242 HD2 PRO 32 2HD PRO 32 9.889 -14.794 1.996 243 HD3 PRO 32 1HD PRO 32 10.888 -13.435 2.564 244 HA PRO 33 HA PRO 33 14.428 -16.256 -2.992 245 HB2 PRO 33 2HB PRO 33 16.886 -17.586 -2.376 246 HB3 PRO 33 1HB PRO 33 16.697 -15.906 -2.902 247 HG2 PRO 33 2HG PRO 33 16.973 -16.974 -0.120 248 HG3 PRO 33 1HG PRO 33 17.663 -15.499 -0.833 249 HD2 PRO 33 2HD PRO 33 15.562 -15.308 0.775 250 HD3 PRO 33 1HD PRO 33 15.613 -14.323 -0.716 251 H GLU 34 H GLU 34 14.620 -18.460 -0.234 252 HA GLU 34 HA GLU 34 14.397 -20.882 -1.776 253 HB2 GLU 34 2HB GLU 34 14.154 -20.370 1.213 254 HB3 GLU 34 1HB GLU 34 14.149 -21.974 0.479 255 HG2 GLU 34 2HG GLU 34 16.436 -21.544 -0.410 256 HG3 GLU 34 1HG GLU 34 16.430 -19.973 0.387 257 H GLU 35 H GLU 35 12.125 -18.881 0.170 258 HA GLU 35 HA GLU 35 9.860 -20.548 -0.010 259 HB2 GLU 35 2HB GLU 35 10.142 -17.540 0.374 260 HB3 GLU 35 1HB GLU 35 8.569 -18.328 0.373 261 HG2 GLU 35 2HG GLU 35 10.804 -19.038 2.296 262 HG3 GLU 35 1HG GLU 35 9.536 -17.866 2.652 263 H ARG 36 H ARG 36 11.006 -17.869 -2.107 264 HA ARG 36 HA ARG 36 8.645 -17.890 -3.757 265 HB2 ARG 36 2HB ARG 36 9.704 -16.124 -5.046 266 HB3 ARG 36 1HB ARG 36 9.869 -15.774 -3.329 267 HG2 ARG 36 2HG ARG 36 12.198 -16.352 -3.351 268 HG3 ARG 36 1HG ARG 36 12.083 -17.040 -4.972 269 HD2 ARG 36 2HD ARG 36 11.672 -14.104 -4.301 270 HD3 ARG 36 1HD ARG 36 13.165 -14.803 -4.937 271 HE ARG 36 HE ARG 36 11.074 -15.512 -6.649 272 HH11 ARG 36 1HH1 ARG 36 12.879 -12.582 -5.805 273 HH12 ARG 36 2HH1 ARG 36 12.572 -11.839 -7.342 274 HH21 ARG 36 1HH2 ARG 36 10.631 -14.479 -8.595 275 HH22 ARG 36 2HH2 ARG 36 11.305 -12.912 -8.919 276 H ASP 37 H ASP 37 11.238 -20.003 -3.694 277 HA ASP 37 HA ASP 37 11.608 -20.582 -6.441 278 HB2 ASP 37 2HB ASP 37 13.052 -21.563 -4.691 279 HB3 ASP 37 1HB ASP 37 11.690 -22.462 -4.030 280 H ASP 38 H ASP 38 9.236 -21.745 -4.078 281 HA ASP 38 HA ASP 38 7.736 -23.354 -5.945 282 HB2 ASP 38 2HB ASP 38 6.952 -22.380 -3.164 283 HB3 ASP 38 1HB ASP 38 6.168 -23.677 -4.065 284 H PHE 39 H PHE 39 7.583 -20.080 -4.769 285 HA PHE 39 HA PHE 39 4.923 -19.547 -5.865 286 HB2 PHE 39 2HB PHE 39 6.833 -17.791 -4.251 287 HB3 PHE 39 1HB PHE 39 5.281 -17.239 -4.863 288 HD1 PHE 39 HD1 PHE 39 6.786 -19.864 -2.653 289 HD2 PHE 39 HD2 PHE 39 3.339 -17.480 -3.514 290 HE1 PHE 39 HE1 PHE 39 5.726 -20.654 -0.585 291 HE2 PHE 39 HE2 PHE 39 2.281 -18.289 -1.441 292 HZ PHE 39 HZ PHE 39 3.470 -19.871 0.025 293 H ASP 40 H ASP 40 4.547 -17.750 -7.299 294 HA ASP 40 HA ASP 40 6.668 -17.056 -9.185 295 HB2 ASP 40 2HB ASP 40 3.724 -16.286 -9.023 296 HB3 ASP 40 1HB ASP 40 4.824 -15.597 -10.214 297 H GLY 41 H GLY 41 6.662 -14.599 -9.738 298 HA2 GLY 41 2HA GLY 41 8.137 -13.109 -8.041 299 HA3 GLY 41 1HA GLY 41 7.104 -12.416 -9.268 300 H LEU 42 H LEU 42 6.465 -10.523 -8.215 301 HA LEU 42 HA LEU 42 6.096 -10.119 -5.458 302 HB2 LEU 42 2HB LEU 42 6.305 -8.319 -7.303 303 HB3 LEU 42 1HB LEU 42 4.597 -8.550 -7.619 304 HG LEU 42 HG LEU 42 5.811 -7.475 -5.024 305 HD11 LEU 42 1HD1 LEU 42 5.992 -5.895 -6.863 306 HD12 LEU 42 2HD1 LEU 42 4.854 -5.326 -5.646 307 HD13 LEU 42 3HD1 LEU 42 4.256 -6.008 -7.163 308 HD21 LEU 42 3HD2 LEU 42 3.534 -6.905 -4.284 309 HD22 LEU 42 1HD2 LEU 42 3.725 -8.646 -4.488 310 HD23 LEU 42 2HD2 LEU 42 2.863 -7.709 -5.708 311 H SER 43 H SER 43 4.869 -11.593 -4.420 312 HA SER 43 HA SER 43 2.336 -12.571 -5.252 313 HB2 SER 43 2HB SER 43 3.573 -12.609 -2.457 314 HB3 SER 43 1HB SER 43 2.292 -13.669 -3.055 315 HG SER 43 HG SER 43 4.490 -13.732 -4.667 316 H TYR 44 H TYR 44 0.525 -11.429 -5.250 317 HA TYR 44 HA TYR 44 -0.309 -9.954 -2.889 318 HB2 TYR 44 2HB TYR 44 -0.761 -7.863 -3.925 319 HB3 TYR 44 1HB TYR 44 0.866 -8.274 -4.415 320 HD1 TYR 44 HD2 TYR 44 0.919 -9.569 -6.874 321 HD2 TYR 44 HD1 TYR 44 -2.114 -6.890 -5.517 322 HE1 TYR 44 HE2 TYR 44 0.311 -9.046 -9.209 323 HE2 TYR 44 HE1 TYR 44 -2.715 -6.372 -7.831 324 HH TYR 44 HH TYR 44 -1.692 -8.179 -10.461 325 H PHE 45 H PHE 45 -2.673 -8.891 -3.935 326 HA PHE 45 HA PHE 45 -4.224 -11.402 -4.114 327 HB2 PHE 45 2HB PHE 45 -5.253 -8.571 -3.617 328 HB3 PHE 45 1HB PHE 45 -6.161 -10.067 -3.420 329 HD1 PHE 45 HD1 PHE 45 -5.303 -11.764 -1.658 330 HD2 PHE 45 HD2 PHE 45 -4.035 -7.674 -1.761 331 HE1 PHE 45 HE1 PHE 45 -4.537 -11.934 0.677 332 HE2 PHE 45 HE2 PHE 45 -3.280 -7.858 0.575 333 HZ PHE 45 HZ PHE 45 -3.526 -9.982 1.793 334 H ASP 46 H ASP 46 -5.882 -11.656 -5.797 335 HA ASP 46 HA ASP 46 -4.748 -10.897 -8.327 336 HB2 ASP 46 2HB ASP 46 -5.681 -13.147 -7.991 337 HB3 ASP 46 1HB ASP 46 -7.270 -12.469 -7.676 338 HA PRO 47 HA PRO 47 -6.541 -6.853 -8.633 339 HB2 PRO 47 2HB PRO 47 -6.879 -6.761 -11.466 340 HB3 PRO 47 1HB PRO 47 -5.430 -6.308 -10.555 341 HG2 PRO 47 2HG PRO 47 -6.057 -8.909 -11.901 342 HG3 PRO 47 1HG PRO 47 -4.511 -8.032 -11.818 343 HD2 PRO 47 2HD PRO 47 -4.881 -10.149 -10.266 344 HD3 PRO 47 1HD PRO 47 -4.096 -8.700 -9.584 345 H ASP 48 H ASP 48 -8.493 -6.550 -7.829 346 HA ASP 48 HA ASP 48 -10.904 -7.673 -9.118 347 HB2 ASP 48 2HB ASP 48 -10.377 -8.995 -7.138 348 HB3 ASP 48 1HB ASP 48 -10.172 -7.542 -6.166 349 HA PRO 49 HA PRO 49 -12.156 -3.273 -8.673 350 HB2 PRO 49 2HB PRO 49 -14.348 -3.316 -10.265 351 HB3 PRO 49 1HB PRO 49 -12.714 -3.442 -10.952 352 HG2 PRO 49 2HG PRO 49 -14.692 -5.634 -10.414 353 HG3 PRO 49 1HG PRO 49 -13.675 -5.369 -11.849 354 HD2 PRO 49 2HD PRO 49 -13.020 -7.132 -9.815 355 HD3 PRO 49 1HD PRO 49 -11.818 -6.363 -10.874 356 H ASP 50 H ASP 50 -13.839 -6.114 -7.605 357 HA ASP 50 HA ASP 50 -16.242 -4.856 -6.648 358 HB2 ASP 50 2HB ASP 50 -16.080 -7.282 -7.247 359 HB3 ASP 50 1HB ASP 50 -15.052 -7.553 -5.842 360 H TYR 51 H TYR 51 -13.104 -5.572 -5.206 361 HA TYR 51 HA TYR 51 -13.966 -4.823 -2.492 362 HB2 TYR 51 2HB TYR 51 -12.332 -6.797 -3.141 363 HB3 TYR 51 1HB TYR 51 -11.110 -5.540 -3.270 364 HD1 TYR 51 HD2 TYR 51 -13.885 -5.884 -0.754 365 HD2 TYR 51 HD1 TYR 51 -9.661 -5.995 -1.407 366 HE1 TYR 51 HE2 TYR 51 -13.514 -6.085 1.664 367 HE2 TYR 51 HE1 TYR 51 -9.312 -6.201 1.018 368 HH TYR 51 HH TYR 51 -11.776 -6.947 3.207 369 H ARG 52 H ARG 52 -13.392 -3.088 -5.071 370 HA ARG 52 HA ARG 52 -11.453 -1.111 -4.216 371 HB2 ARG 52 2HB ARG 52 -11.727 -1.827 -6.593 372 HB3 ARG 52 1HB ARG 52 -13.375 -1.215 -6.588 373 HG2 ARG 52 2HG ARG 52 -12.497 1.085 -6.247 374 HG3 ARG 52 1HG ARG 52 -10.852 0.451 -6.308 375 HD2 ARG 52 2HD ARG 52 -11.390 1.360 -8.486 376 HD3 ARG 52 1HD ARG 52 -11.334 -0.399 -8.629 377 HE ARG 52 HE ARG 52 -13.956 0.778 -8.133 378 HH11 ARG 52 1HH1 ARG 52 -11.737 -0.454 -10.603 379 HH12 ARG 52 2HH1 ARG 52 -12.998 -0.706 -11.764 380 HH21 ARG 52 1HH2 ARG 52 -15.567 0.411 -9.648 381 HH22 ARG 52 2HH2 ARG 52 -15.178 -0.210 -11.220 382 H VAL 53 H VAL 53 -12.046 0.404 -2.730 383 HA VAL 53 HA VAL 53 -14.846 1.396 -2.640 384 HB VAL 53 HB VAL 53 -14.658 1.718 -0.220 385 HG11 VAL 53 1HG1 VAL 53 -15.506 -0.460 -0.970 386 HG12 VAL 53 2HG1 VAL 53 -14.643 -0.625 0.559 387 HG13 VAL 53 3HG1 VAL 53 -13.872 -1.131 -0.948 388 HG21 VAL 53 3HG2 VAL 53 -12.269 2.199 0.012 389 HG22 VAL 53 1HG2 VAL 53 -11.860 0.528 -0.382 390 HG23 VAL 53 2HG2 VAL 53 -12.725 0.900 1.114 391 H GLU 54 H GLU 54 -15.088 3.606 -2.551 392 HA GLU 54 HA GLU 54 -12.791 5.282 -3.191 393 HB2 GLU 54 2HB GLU 54 -14.524 7.082 -3.461 394 HB3 GLU 54 1HB GLU 54 -14.836 5.659 -4.450 395 HG2 GLU 54 2HG GLU 54 -16.545 4.892 -2.892 396 HG3 GLU 54 1HG GLU 54 -16.194 6.228 -1.798 397 H ALA 55 H ALA 55 -12.212 7.191 -1.988 398 HA ALA 55 HA ALA 55 -13.077 7.417 0.812 399 HB1 ALA 55 3HB ALA 55 -10.158 6.985 0.040 400 HB2 ALA 55 1HB ALA 55 -11.189 5.817 0.871 401 HB3 ALA 55 2HB ALA 55 -10.764 7.333 1.663 402 H THR 56 H THR 56 -12.789 9.469 1.674 403 HA THR 56 HA THR 56 -11.975 11.626 -0.138 404 HB THR 56 HB THR 56 -13.237 11.784 2.639 405 HG1 THR 56 HG1 THR 56 -14.467 10.862 0.723 406 HG21 THR 56 3HG2 THR 56 -12.860 13.942 0.518 407 HG22 THR 56 1HG2 THR 56 -12.024 13.868 2.076 408 HG23 THR 56 2HG2 THR 56 -13.767 14.139 2.017 409 H VAL 57 H VAL 57 -10.052 12.551 0.026 410 HA VAL 57 HA VAL 57 -8.042 11.816 1.901 411 HB VAL 57 HB VAL 57 -7.973 14.109 -0.116 412 HG11 VAL 57 1HG1 VAL 57 -5.527 13.818 -0.065 413 HG12 VAL 57 2HG1 VAL 57 -5.693 12.541 1.141 414 HG13 VAL 57 3HG1 VAL 57 -6.150 14.198 1.544 415 HG21 VAL 57 3HG2 VAL 57 -8.586 12.013 -1.259 416 HG22 VAL 57 1HG2 VAL 57 -7.167 11.217 -0.570 417 HG23 VAL 57 2HG2 VAL 57 -6.967 12.545 -1.716 418 H THR 58 H THR 58 -7.576 12.771 3.753 419 HA THR 58 HA THR 58 -8.532 15.494 4.414 420 HB THR 58 HB THR 58 -7.953 13.166 6.320 421 HG1 THR 58 HG1 THR 58 -10.372 14.167 5.233 422 HG21 THR 58 3HG2 THR 58 -9.162 15.898 6.900 423 HG22 THR 58 1HG2 THR 58 -7.565 15.342 7.411 424 HG23 THR 58 2HG2 THR 58 -9.018 14.572 8.055 425 H VAL 59 H VAL 59 -6.722 16.783 4.032 426 HA VAL 59 HA VAL 59 -4.033 15.666 4.544 427 HB VAL 59 HB VAL 59 -4.843 18.151 2.957 428 HG11 VAL 59 1HG1 VAL 59 -2.668 18.553 4.078 429 HG12 VAL 59 2HG1 VAL 59 -2.463 18.388 2.333 430 HG13 VAL 59 3HG1 VAL 59 -2.038 17.048 3.402 431 HG21 VAL 59 3HG2 VAL 59 -3.977 16.882 1.007 432 HG22 VAL 59 1HG2 VAL 59 -5.320 16.041 1.789 433 HG23 VAL 59 2HG2 VAL 59 -3.662 15.496 2.055 434 H HIS 60 H HIS 60 -2.712 16.488 6.082 435 HA HIS 60 HA HIS 60 -4.024 18.118 8.151 436 HB2 HIS 60 2HB HIS 60 -1.682 16.167 8.335 437 HB3 HIS 60 1HB HIS 60 -2.442 16.985 9.705 438 HD1 HIS 60 HD1 HIS 60 -2.964 14.193 7.279 439 HD2 HIS 60 HD2 HIS 60 -5.016 16.034 10.384 440 HE1 HIS 60 HE1 HIS 60 -4.987 12.779 7.697 441 HE2 HIS 60 HE2 HIS 60 -6.097 13.805 9.695 442 H GLU 61 H GLU 61 -3.302 20.024 8.738 443 HA GLU 61 HA GLU 61 -1.271 21.526 7.564 444 HB2 GLU 61 2HB GLU 61 -1.607 23.078 9.529 445 HB3 GLU 61 1HB GLU 61 -3.102 22.609 8.726 446 HG2 GLU 61 2HG GLU 61 -3.583 20.981 10.494 447 HG3 GLU 61 1HG GLU 61 -2.056 21.364 11.289 448 H THR 62 H THR 62 -1.183 19.345 10.325 449 HA THR 62 HA THR 62 1.685 19.894 10.795 450 HB THR 62 HB THR 62 1.214 18.821 13.076 451 HG1 THR 62 HG1 THR 62 -0.759 17.793 12.584 452 HG21 THR 62 3HG2 THR 62 1.396 21.281 12.868 453 HG22 THR 62 1HG2 THR 62 0.172 20.843 14.068 454 HG23 THR 62 2HG2 THR 62 -0.318 21.380 12.460 455 HA PRO 63 HA PRO 63 1.766 15.572 9.108 456 HB2 PRO 63 2HB PRO 63 4.124 15.805 7.728 457 HB3 PRO 63 1HB PRO 63 2.576 16.358 7.054 458 HG2 PRO 63 2HG PRO 63 4.764 17.972 8.311 459 HG3 PRO 63 1HG PRO 63 3.761 18.348 6.892 460 HD2 PRO 63 2HD PRO 63 3.296 19.385 9.418 461 HD3 PRO 63 1HD PRO 63 2.037 19.202 8.177 462 H GLU 64 H GLU 64 2.399 14.097 10.606 463 HA GLU 64 HA GLU 64 4.633 14.662 12.415 464 HB2 GLU 64 2HB GLU 64 3.802 12.746 13.745 465 HB3 GLU 64 1HB GLU 64 2.548 13.948 13.474 466 HG2 GLU 64 2HG GLU 64 1.431 12.571 11.871 467 HG3 GLU 64 1HG GLU 64 2.784 11.447 11.783 468 H SER 65 H SER 65 6.207 13.014 12.918 469 HA SER 65 HA SER 65 7.302 11.805 10.501 470 HB2 SER 65 2HB SER 65 9.372 11.585 11.929 471 HB3 SER 65 1HB SER 65 8.788 13.241 11.804 472 HG SER 65 HG SER 65 8.403 13.270 13.871 473 H VAL 66 H VAL 66 6.727 9.790 10.077 474 HA VAL 66 HA VAL 66 6.302 7.769 12.199 475 HB VAL 66 HB VAL 66 4.883 7.816 9.493 476 HG11 VAL 66 1HG1 VAL 66 3.330 6.187 10.518 477 HG12 VAL 66 2HG1 VAL 66 4.284 6.217 12.003 478 HG13 VAL 66 3HG1 VAL 66 4.993 5.591 10.513 479 HG21 VAL 66 3HG2 VAL 66 3.813 8.887 12.130 480 HG22 VAL 66 1HG2 VAL 66 2.840 8.628 10.680 481 HG23 VAL 66 2HG2 VAL 66 4.141 9.818 10.667 482 H ASP 67 H ASP 67 7.895 6.257 12.082 483 HA ASP 67 HA ASP 67 9.660 6.127 9.770 484 HB2 ASP 67 2HB ASP 67 9.732 4.732 12.483 485 HB3 ASP 67 1HB ASP 67 10.921 4.432 11.219 486 H LEU 68 H LEU 68 9.175 4.848 8.091 487 HA LEU 68 HA LEU 68 7.673 2.325 8.521 488 HB2 LEU 68 2HB LEU 68 7.276 4.298 6.248 489 HB3 LEU 68 1HB LEU 68 6.460 2.751 6.403 490 HG LEU 68 HG LEU 68 6.142 5.073 8.349 491 HD11 LEU 68 1HD1 LEU 68 5.216 5.644 6.182 492 HD12 LEU 68 2HD1 LEU 68 3.956 5.429 7.390 493 HD13 LEU 68 3HD1 LEU 68 4.245 4.169 6.186 494 HD21 LEU 68 3HD2 LEU 68 5.773 2.900 9.417 495 HD22 LEU 68 1HD2 LEU 68 4.613 2.454 8.161 496 HD23 LEU 68 2HD2 LEU 68 4.260 3.787 9.265 497 H GLU 69 H GLU 69 7.765 0.955 6.400 498 HA GLU 69 HA GLU 69 10.564 0.426 5.926 499 HB2 GLU 69 2HB GLU 69 9.829 -1.667 4.878 500 HB3 GLU 69 1HB GLU 69 9.007 -1.455 6.412 501 HG2 GLU 69 2HG GLU 69 6.989 -0.672 5.178 502 HG3 GLU 69 1HG GLU 69 7.807 -1.024 3.661 503 H THR 70 H THR 70 11.656 1.011 4.189 504 HA THR 70 HA THR 70 10.280 2.021 1.786 505 HB THR 70 HB THR 70 11.795 3.624 2.884 506 HG1 THR 70 HG1 THR 70 11.853 4.113 0.816 507 HG21 THR 70 3HG2 THR 70 14.040 1.660 2.330 508 HG22 THR 70 1HG2 THR 70 13.403 2.061 3.929 509 HG23 THR 70 2HG2 THR 70 14.230 3.290 2.970 510 H SER 71 H SER 71 11.876 1.639 -0.223 511 HA SER 71 HA SER 71 12.145 -1.264 -0.518 512 HB2 SER 71 2HB SER 71 12.181 0.989 -2.570 513 HB3 SER 71 1HB SER 71 12.236 -0.737 -2.941 514 HG SER 71 HG SER 71 10.105 0.849 -2.140 515 H ASP 72 H ASP 72 14.063 0.524 0.973 516 HA ASP 72 HA ASP 72 16.566 0.066 -0.533 517 HB2 ASP 72 2HB ASP 72 15.835 2.524 -0.332 518 HB3 ASP 72 1HB ASP 72 16.048 2.369 1.406 519 H ASP 73 H ASP 73 15.297 -1.793 1.142 520 HA ASP 73 HA ASP 73 15.667 -3.336 2.709 521 HB2 ASP 73 2HB ASP 73 17.927 -4.135 3.053 522 HB3 ASP 73 1HB ASP 73 17.737 -3.636 1.385 523 H ARG 74 H ARG 74 14.843 -0.846 3.849 524 HA ARG 74 HA ARG 74 15.929 -0.925 6.535 525 HB2 ARG 74 2HB ARG 74 17.234 0.721 4.542 526 HB3 ARG 74 1HB ARG 74 16.475 1.792 5.703 527 HG2 ARG 74 2HG ARG 74 17.777 0.983 7.500 528 HG3 ARG 74 1HG ARG 74 18.229 -0.486 6.634 529 HD2 ARG 74 2HD ARG 74 19.125 2.312 5.880 530 HD3 ARG 74 1HD ARG 74 20.089 1.160 6.801 531 HE ARG 74 HE ARG 74 19.664 -0.331 4.697 532 HH11 ARG 74 1HH1 ARG 74 20.338 3.134 4.629 533 HH12 ARG 74 2HH1 ARG 74 21.079 3.068 3.063 534 HH21 ARG 74 1HH2 ARG 74 20.604 -0.380 2.650 535 HH22 ARG 74 2HH2 ARG 74 21.233 1.078 1.946 536 H THR 75 H THR 75 15.381 1.673 7.303 537 HA THR 75 HA THR 75 12.470 1.959 7.043 538 HB THR 75 HB THR 75 13.981 2.062 9.705 539 HG1 THR 75 HG1 THR 75 12.194 0.166 8.595 540 HG21 THR 75 3HG2 THR 75 12.138 3.704 9.651 541 HG22 THR 75 1HG2 THR 75 11.753 2.366 10.745 542 HG23 THR 75 2HG2 THR 75 11.021 2.438 9.142 543 H VAL 76 H VAL 76 11.874 4.130 7.201 544 HA VAL 76 HA VAL 76 13.890 6.226 7.483 545 HB VAL 76 HB VAL 76 13.193 7.349 5.290 546 HG11 VAL 76 1HG1 VAL 76 14.697 4.723 4.969 547 HG12 VAL 76 2HG1 VAL 76 15.401 6.256 5.489 548 HG13 VAL 76 3HG1 VAL 76 14.752 6.094 3.856 549 HG21 VAL 76 3HG2 VAL 76 11.166 6.100 4.838 550 HG22 VAL 76 1HG2 VAL 76 12.087 4.606 4.643 551 HG23 VAL 76 2HG2 VAL 76 12.286 5.928 3.488 552 H ARG 77 H ARG 77 12.998 8.307 7.633 553 HA ARG 77 HA ARG 77 10.557 8.520 9.056 554 HB2 ARG 77 2HB ARG 77 12.631 9.953 9.375 555 HB3 ARG 77 1HB ARG 77 12.298 10.720 7.836 556 HG2 ARG 77 2HG ARG 77 10.387 10.861 10.191 557 HG3 ARG 77 1HG ARG 77 11.684 12.026 9.940 558 HD2 ARG 77 2HD ARG 77 9.257 11.548 8.192 559 HD3 ARG 77 1HD ARG 77 9.676 13.009 9.085 560 HE ARG 77 HE ARG 77 10.860 12.063 6.565 561 HH11 ARG 77 1HH1 ARG 77 10.713 14.601 9.013 562 HH12 ARG 77 2HH1 ARG 77 11.568 15.747 8.034 563 HH21 ARG 77 1HH2 ARG 77 12.068 13.564 5.358 564 HH22 ARG 77 2HH2 ARG 77 12.326 15.163 5.985 565 H TYR 78 H TYR 78 8.591 8.481 8.109 566 HA TYR 78 HA TYR 78 8.118 9.805 5.511 567 HB2 TYR 78 2HB TYR 78 6.524 7.752 7.098 568 HB3 TYR 78 1HB TYR 78 5.778 8.690 5.816 569 HD1 TYR 78 HD2 TYR 78 8.904 6.597 6.262 570 HD2 TYR 78 HD1 TYR 78 5.594 7.606 3.772 571 HE1 TYR 78 HE2 TYR 78 9.621 4.923 4.626 572 HE2 TYR 78 HE1 TYR 78 6.317 5.935 2.128 573 HH TYR 78 HH TYR 78 8.537 3.530 2.801 574 H LEU 79 H LEU 79 6.569 11.448 5.387 575 HA LEU 79 HA LEU 79 5.741 12.722 7.914 576 HB2 LEU 79 2HB LEU 79 5.906 13.798 5.069 577 HB3 LEU 79 1HB LEU 79 5.202 14.704 6.402 578 HG LEU 79 HG LEU 79 8.111 13.800 6.237 579 HD11 LEU 79 1HD1 LEU 79 7.587 15.566 4.617 580 HD12 LEU 79 2HD1 LEU 79 8.663 16.143 5.885 581 HD13 LEU 79 3HD1 LEU 79 6.952 16.583 5.914 582 HD21 LEU 79 3HD2 LEU 79 6.735 15.531 8.326 583 HD22 LEU 79 1HD2 LEU 79 8.469 15.198 8.235 584 HD23 LEU 79 2HD2 LEU 79 7.338 13.889 8.562 585 H HIS 80 H HIS 80 3.648 12.732 8.506 586 HA HIS 80 HA HIS 80 1.710 11.239 6.980 587 HB2 HIS 80 2HB HIS 80 1.753 11.054 9.439 588 HB3 HIS 80 1HB HIS 80 1.456 12.782 9.608 589 HD2 HIS 80 HD2 HIS 80 -0.579 10.213 7.394 590 HE1 HIS 80 HE1 HIS 80 -3.163 12.099 10.139 591 HE2 HIS 80 HE2 HIS 80 -2.962 10.315 8.371 592 H VAL 81 H VAL 81 1.208 12.309 5.152 593 HA VAL 81 HA VAL 81 0.594 15.168 5.176 594 HB VAL 81 HB VAL 81 0.452 14.993 2.717 595 HG11 VAL 81 1HG1 VAL 81 2.632 15.405 3.779 596 HG12 VAL 81 2HG1 VAL 81 2.833 14.474 2.296 597 HG13 VAL 81 3HG1 VAL 81 2.948 13.669 3.864 598 HG21 VAL 81 3HG2 VAL 81 1.025 12.014 3.060 599 HG22 VAL 81 1HG2 VAL 81 0.977 12.886 1.522 600 HG23 VAL 81 2HG2 VAL 81 -0.487 12.718 2.489 601 H ALA 82 H ALA 82 -1.117 12.077 4.909 602 HA ALA 82 HA ALA 82 -3.700 13.489 4.899 603 HB1 ALA 82 3HB ALA 82 -4.523 12.337 2.897 604 HB2 ALA 82 1HB ALA 82 -2.947 11.569 2.660 605 HB3 ALA 82 2HB ALA 82 -3.112 13.321 2.510 606 H THR 83 H THR 83 -5.515 12.145 5.206 607 HA THR 83 HA THR 83 -5.102 9.316 5.921 608 HB THR 83 HB THR 83 -6.927 11.232 7.468 609 HG1 THR 83 HG1 THR 83 -4.872 9.853 8.741 610 HG21 THR 83 3HG2 THR 83 -7.320 9.315 8.986 611 HG22 THR 83 1HG2 THR 83 -6.343 8.279 7.948 612 HG23 THR 83 2HG2 THR 83 -7.871 8.938 7.352 613 H LEU 84 H LEU 84 -6.618 8.041 5.000 614 HA LEU 84 HA LEU 84 -8.423 9.286 3.036 615 HB2 LEU 84 2HB LEU 84 -7.396 6.416 3.003 616 HB3 LEU 84 1HB LEU 84 -8.106 7.323 1.677 617 HG LEU 84 HG LEU 84 -5.338 7.746 2.884 618 HD11 LEU 84 1HD1 LEU 84 -6.091 6.760 0.124 619 HD12 LEU 84 2HD1 LEU 84 -5.473 5.780 1.457 620 HD13 LEU 84 3HD1 LEU 84 -4.454 7.023 0.741 621 HD21 LEU 84 3HD2 LEU 84 -4.935 9.456 1.159 622 HD22 LEU 84 1HD2 LEU 84 -6.232 9.928 2.253 623 HD23 LEU 84 2HD2 LEU 84 -6.618 9.339 0.636 624 H SER 85 H SER 85 -10.360 9.440 3.965 625 HA SER 85 HA SER 85 -11.293 7.589 6.017 626 HB2 SER 85 2HB SER 85 -13.156 9.335 6.201 627 HB3 SER 85 1HB SER 85 -11.533 9.931 6.532 628 HG SER 85 HG SER 85 -11.535 11.053 4.687 629 H PHE 86 H PHE 86 -12.723 5.971 5.620 630 HA PHE 86 HA PHE 86 -14.677 6.037 3.506 631 HB2 PHE 86 2HB PHE 86 -13.851 4.034 2.276 632 HB3 PHE 86 1HB PHE 86 -12.735 5.380 2.160 633 HD1 PHE 86 HD1 PHE 86 -10.519 5.287 3.284 634 HD2 PHE 86 HD2 PHE 86 -13.194 1.944 3.415 635 HE1 PHE 86 HE1 PHE 86 -8.672 3.827 3.996 636 HE2 PHE 86 HE2 PHE 86 -11.332 0.497 4.137 637 HZ PHE 86 HZ PHE 86 -9.079 1.439 4.425 638 H ASP 87 H ASP 87 -15.459 3.511 3.327 639 HA ASP 87 HA ASP 87 -15.788 2.398 6.052 640 HB2 ASP 87 2HB ASP 87 -17.959 2.572 3.896 641 HB3 ASP 87 1HB ASP 87 -18.141 1.795 5.466 642 H LEU 88 H LEU 88 -15.755 0.159 6.141 643 HA LEU 88 HA LEU 88 -15.553 -1.495 3.759 644 HB2 LEU 88 2HB LEU 88 -13.234 -0.511 4.146 645 HB3 LEU 88 1HB LEU 88 -13.204 -1.323 5.702 646 HG LEU 88 HG LEU 88 -13.433 -3.539 4.473 647 HD11 LEU 88 1HD1 LEU 88 -12.982 -1.847 1.999 648 HD12 LEU 88 2HD1 LEU 88 -14.443 -2.753 2.409 649 HD13 LEU 88 3HD1 LEU 88 -12.945 -3.612 2.068 650 HD21 LEU 88 3HD2 LEU 88 -11.258 -2.775 5.288 651 HD22 LEU 88 1HD2 LEU 88 -10.979 -1.893 3.782 652 HD23 LEU 88 2HD2 LEU 88 -11.088 -3.658 3.771 653 H ASP 89 H ASP 89 -16.120 -3.574 4.172 654 HA ASP 89 HA ASP 89 -16.729 -5.514 5.114 655 HB2 ASP 89 2HB ASP 89 -14.607 -5.400 6.404 656 HB3 ASP 89 1HB ASP 89 -15.429 -4.505 7.679 657 H GLY 90 H GLY 90 -17.123 -3.464 7.992 658 HA2 GLY 90 2HA GLY 90 -19.990 -3.132 7.598 659 HA3 GLY 90 1HA GLY 90 -19.551 -4.152 8.967 660 H GLU 91 H GLU 91 -17.120 -1.927 8.545 661 HA GLU 91 HA GLU 91 -18.162 -0.049 10.584 662 HB2 GLU 91 2HB GLU 91 -15.882 -0.118 11.622 663 HB3 GLU 91 1HB GLU 91 -16.634 -1.711 11.619 664 HG2 GLU 91 2HG GLU 91 -15.302 -2.372 9.664 665 HG3 GLU 91 1HG GLU 91 -14.573 -0.769 9.598 666 H SER 92 H SER 92 -16.932 2.028 10.608 667 HA SER 92 HA SER 92 -16.074 2.940 7.985 668 HB2 SER 92 2HB SER 92 -17.398 4.429 9.491 669 HB3 SER 92 1HB SER 92 -16.080 4.412 10.662 670 HG SER 92 HG SER 92 -15.810 5.299 7.971 671 H ARG 93 H ARG 93 -13.978 2.940 7.297 672 HA ARG 93 HA ARG 93 -11.810 2.394 9.236 673 HB2 ARG 93 2HB ARG 93 -12.244 1.257 6.455 674 HB3 ARG 93 1HB ARG 93 -10.668 1.219 7.225 675 HG2 ARG 93 2HG ARG 93 -13.164 -0.091 8.349 676 HG3 ARG 93 1HG ARG 93 -11.921 -0.920 7.408 677 HD2 ARG 93 2HD ARG 93 -11.430 -1.396 9.692 678 HD3 ARG 93 1HD ARG 93 -10.248 -0.182 9.199 679 HE ARG 93 HE ARG 93 -12.707 0.521 10.694 680 HH11 ARG 93 1HH1 ARG 93 -9.182 0.652 10.453 681 HH12 ARG 93 2HH1 ARG 93 -9.023 1.742 11.790 682 HH21 ARG 93 1HH2 ARG 93 -12.458 1.970 12.395 683 HH22 ARG 93 2HH2 ARG 93 -10.873 2.472 12.880 684 H ASP 94 H ASP 94 -9.979 3.509 9.043 685 HA ASP 94 HA ASP 94 -9.616 5.418 6.813 686 HB2 ASP 94 2HB ASP 94 -8.691 7.050 8.404 687 HB3 ASP 94 1HB ASP 94 -10.330 6.616 8.871 688 H LEU 95 H LEU 95 -7.728 5.252 5.793 689 HA LEU 95 HA LEU 95 -5.410 3.927 7.084 690 HB2 LEU 95 2HB LEU 95 -6.157 3.963 4.128 691 HB3 LEU 95 1HB LEU 95 -4.629 3.359 4.751 692 HG LEU 95 HG LEU 95 -7.388 2.157 5.179 693 HD11 LEU 95 1HD1 LEU 95 -6.383 1.681 2.998 694 HD12 LEU 95 2HD1 LEU 95 -6.491 0.229 3.990 695 HD13 LEU 95 3HD1 LEU 95 -4.934 1.041 3.786 696 HD21 LEU 95 3HD2 LEU 95 -6.166 1.962 7.276 697 HD22 LEU 95 1HD2 LEU 95 -4.769 1.276 6.437 698 HD23 LEU 95 2HD2 LEU 95 -6.295 0.389 6.497 699 H HIS 96 H HIS 96 -3.637 5.155 7.256 700 HA HIS 96 HA HIS 96 -3.854 7.953 6.467 701 HB2 HIS 96 2HB HIS 96 -1.831 6.509 8.235 702 HB3 HIS 96 1HB HIS 96 -1.877 8.249 7.973 703 HD2 HIS 96 HD2 HIS 96 -4.397 5.551 9.457 704 HE1 HIS 96 HE1 HIS 96 -4.795 9.226 11.494 705 HE2 HIS 96 HE2 HIS 96 -5.762 6.918 11.170 706 H ALA 97 H ALA 97 -2.665 8.865 4.901 707 HA ALA 97 HA ALA 97 -0.913 7.202 3.222 708 HB1 ALA 97 3HB ALA 97 -2.874 8.230 2.111 709 HB2 ALA 97 1HB ALA 97 -1.372 8.902 1.468 710 HB3 ALA 97 2HB ALA 97 -2.339 9.833 2.616 711 H PHE 98 H PHE 98 1.209 7.560 3.324 712 HA PHE 98 HA PHE 98 2.277 10.103 4.389 713 HB2 PHE 98 2HB PHE 98 3.623 7.384 4.705 714 HB3 PHE 98 1HB PHE 98 4.002 8.885 5.530 715 HD1 PHE 98 HD1 PHE 98 2.657 9.615 7.474 716 HD2 PHE 98 HD2 PHE 98 1.856 5.913 5.521 717 HE1 PHE 98 HE1 PHE 98 1.374 8.852 9.422 718 HE2 PHE 98 HE2 PHE 98 0.580 5.155 7.475 719 HZ PHE 98 HZ PHE 98 0.336 6.628 9.432 720 H ARG 99 H ARG 99 4.545 10.430 3.729 721 HA ARG 99 HA ARG 99 5.765 8.967 1.596 722 HB2 ARG 99 2HB ARG 99 5.870 10.872 -0.027 723 HB3 ARG 99 1HB ARG 99 4.249 10.237 0.198 724 HG2 ARG 99 2HG ARG 99 4.220 12.286 2.024 725 HG3 ARG 99 1HG ARG 99 5.345 12.936 0.830 726 HD2 ARG 99 2HD ARG 99 2.510 11.990 0.305 727 HD3 ARG 99 1HD ARG 99 3.064 13.661 0.378 728 HE ARG 99 HE ARG 99 4.429 12.092 -1.617 729 HH11 ARG 99 1HH1 ARG 99 1.530 14.037 -1.031 730 HH12 ARG 99 2HH1 ARG 99 1.297 14.385 -2.715 731 HH21 ARG 99 1HH2 ARG 99 4.068 12.555 -3.806 732 HH22 ARG 99 2HH2 ARG 99 2.723 13.549 -4.273 733 H GLN 100 H GLN 100 8.032 9.557 1.425 734 HA GLN 100 HA GLN 100 8.997 9.611 3.995 735 HB2 GLN 100 2HB GLN 100 10.594 10.080 1.455 736 HB3 GLN 100 1HB GLN 100 11.287 9.659 3.018 737 HG2 GLN 100 2HG GLN 100 10.029 7.516 2.971 738 HG3 GLN 100 1HG GLN 100 9.398 7.936 1.384 739 HE21 GLN 100 1HE2 GLN 100 12.737 8.531 2.413 740 HE22 GLN 100 2HE2 GLN 100 13.450 7.380 1.345 741 H ALA 101 H ALA 101 10.175 12.182 1.737 742 HA ALA 101 HA ALA 101 9.984 14.116 3.984 743 HB1 ALA 101 3HB ALA 101 11.966 15.253 3.071 744 HB2 ALA 101 1HB ALA 101 12.082 14.045 1.785 745 HB3 ALA 101 2HB ALA 101 12.322 13.572 3.468 746 H ALA 102 H ALA 102 10.594 14.554 0.469 747 HA ALA 102 HA ALA 102 8.358 16.499 0.360 748 HB1 ALA 102 3HB ALA 102 11.133 16.743 -0.872 749 HB2 ALA 102 1HB ALA 102 10.578 17.584 0.577 750 HB3 ALA 102 2HB ALA 102 9.836 17.937 -0.984 751 H ASP 103 H ASP 103 7.927 13.851 -0.452 752 HA ASP 103 HA ASP 103 8.651 13.117 -3.064 753 HB2 ASP 103 2HB ASP 103 7.721 11.519 -1.390 754 HB3 ASP 103 1HB ASP 103 6.164 12.320 -1.491 755 H GLU 104 H GLU 104 8.042 13.856 -4.950 756 HA GLU 104 HA GLU 104 5.328 14.962 -5.422 757 HB2 GLU 104 2HB GLU 104 6.352 16.285 -7.280 758 HB3 GLU 104 1HB GLU 104 6.978 16.738 -5.699 759 HG2 GLU 104 2HG GLU 104 9.032 15.462 -6.109 760 HG3 GLU 104 1HG GLU 104 8.415 14.925 -7.671 761 H SER 105 H SER 105 7.027 12.257 -5.669 762 HA SER 105 HA SER 105 6.582 11.478 -8.428 763 HB2 SER 105 2HB SER 105 8.580 10.721 -7.142 764 HB3 SER 105 1HB SER 105 7.533 9.862 -6.018 765 HG SER 105 HG SER 105 7.135 8.356 -7.504 766 H ARG 106 H ARG 106 4.434 11.936 -6.046 767 HA ARG 106 HA ARG 106 2.256 11.379 -5.706 768 HB2 ARG 106 2HB ARG 106 2.488 9.585 -8.166 769 HB3 ARG 106 1HB ARG 106 0.989 10.150 -7.439 770 HG2 ARG 106 2HG ARG 106 3.053 11.994 -8.691 771 HG3 ARG 106 1HG ARG 106 1.679 11.322 -9.564 772 HD2 ARG 106 2HD ARG 106 0.129 12.475 -8.011 773 HD3 ARG 106 1HD ARG 106 1.508 13.153 -7.139 774 HE ARG 106 HE ARG 106 1.613 14.781 -8.714 775 HH11 ARG 106 1HH1 ARG 106 0.063 12.025 -10.301 776 HH12 ARG 106 2HH1 ARG 106 -0.187 12.888 -11.785 777 HH21 ARG 106 1HH2 ARG 106 1.228 15.870 -10.657 778 HH22 ARG 106 2HH2 ARG 106 0.471 15.049 -11.986 779 H THR 107 H THR 107 4.620 9.606 -4.786 780 HA THR 107 HA THR 107 3.516 6.908 -4.742 781 HB THR 107 HB THR 107 6.133 7.865 -3.494 782 HG1 THR 107 HG1 THR 107 5.418 7.533 -6.122 783 HG21 THR 107 3HG2 THR 107 5.405 5.621 -2.736 784 HG22 THR 107 1HG2 THR 107 6.820 5.498 -3.787 785 HG23 THR 107 2HG2 THR 107 5.215 5.106 -4.417 786 H LEU 108 H LEU 108 1.722 7.174 -3.472 787 HA LEU 108 HA LEU 108 1.894 8.090 -0.708 788 HB2 LEU 108 2HB LEU 108 -0.424 6.842 -2.231 789 HB3 LEU 108 1HB LEU 108 -0.522 7.567 -0.629 790 HG LEU 108 HG LEU 108 0.129 9.063 -3.200 791 HD11 LEU 108 1HD1 LEU 108 -2.418 9.038 -1.558 792 HD12 LEU 108 2HD1 LEU 108 -2.180 8.272 -3.132 793 HD13 LEU 108 3HD1 LEU 108 -2.096 10.024 -2.989 794 HD21 LEU 108 3HD2 LEU 108 -0.313 10.152 -0.391 795 HD22 LEU 108 1HD2 LEU 108 -0.086 11.115 -1.856 796 HD23 LEU 108 2HD2 LEU 108 1.225 10.103 -1.257 797 H PHE 109 H PHE 109 2.267 6.792 0.930 798 HA PHE 109 HA PHE 109 2.259 3.856 0.580 799 HB2 PHE 109 2HB PHE 109 4.461 5.137 1.050 800 HB3 PHE 109 1HB PHE 109 3.820 5.474 2.651 801 HD1 PHE 109 HD1 PHE 109 4.639 2.674 0.318 802 HD2 PHE 109 HD2 PHE 109 4.161 3.878 4.395 803 HE1 PHE 109 HE1 PHE 109 5.594 0.540 1.079 804 HE2 PHE 109 HE2 PHE 109 5.087 1.721 5.152 805 HZ PHE 109 HZ PHE 109 5.812 0.063 3.480 806 H VAL 110 H VAL 110 0.333 3.139 1.405 807 HA VAL 110 HA VAL 110 -0.546 4.161 4.049 808 HB VAL 110 HB VAL 110 -2.842 3.350 3.587 809 HG11 VAL 110 1HG1 VAL 110 -1.826 5.310 1.511 810 HG12 VAL 110 2HG1 VAL 110 -2.294 5.690 3.168 811 HG13 VAL 110 3HG1 VAL 110 -3.509 5.131 2.019 812 HG21 VAL 110 3HG2 VAL 110 -2.448 1.590 1.930 813 HG22 VAL 110 1HG2 VAL 110 -1.906 2.784 0.752 814 HG23 VAL 110 2HG2 VAL 110 -3.592 2.774 1.291 815 HA PRO 111 HA PRO 111 0.665 -0.101 5.231 816 HB2 PRO 111 2HB PRO 111 0.840 1.188 7.925 817 HB3 PRO 111 1HB PRO 111 2.066 0.236 7.062 818 HG2 PRO 111 2HG PRO 111 2.330 2.894 7.396 819 HG3 PRO 111 1HG PRO 111 2.900 2.072 5.923 820 HD2 PRO 111 2HD PRO 111 0.354 3.638 6.339 821 HD3 PRO 111 1HD PRO 111 1.490 3.683 4.969 822 H PHE 112 H PHE 112 -0.823 -1.547 6.010 823 HA PHE 112 HA PHE 112 -2.865 -0.658 7.908 824 HB2 PHE 112 2HB PHE 112 -4.673 -1.838 6.792 825 HB3 PHE 112 1HB PHE 112 -3.978 -0.681 5.670 826 HD1 PHE 112 HD1 PHE 112 -2.605 -1.490 3.725 827 HD2 PHE 112 HD2 PHE 112 -4.630 -4.225 6.338 828 HE1 PHE 112 HE1 PHE 112 -2.371 -3.287 2.058 829 HE2 PHE 112 HE2 PHE 112 -4.390 -6.001 4.655 830 HZ PHE 112 HZ PHE 112 -3.262 -5.534 2.522 831 H ARG 113 H ARG 113 -3.853 -2.551 9.013 832 HA ARG 113 HA ARG 113 -2.381 -5.102 8.810 833 HB2 ARG 113 2HB ARG 113 -1.381 -4.020 10.766 834 HB3 ARG 113 1HB ARG 113 -2.967 -3.608 11.406 835 HG2 ARG 113 2HG ARG 113 -3.468 -5.981 11.782 836 HG3 ARG 113 1HG ARG 113 -1.918 -6.436 11.077 837 HD2 ARG 113 2HD ARG 113 -0.751 -5.271 12.933 838 HD3 ARG 113 1HD ARG 113 -2.319 -4.854 13.641 839 HE ARG 113 HE ARG 113 -2.726 -7.323 13.741 840 HH11 ARG 113 1HH1 ARG 113 0.590 -6.116 13.896 841 HH12 ARG 113 2HH1 ARG 113 1.168 -7.510 14.758 842 HH21 ARG 113 1HH2 ARG 113 -1.946 -9.140 14.816 843 HH22 ARG 113 2HH2 ARG 113 -0.274 -9.215 15.275 844 H ASP 114 H ASP 114 -3.836 -6.769 8.540 845 HA ASP 114 HA ASP 114 -6.672 -6.250 9.180 846 HB2 ASP 114 2HB ASP 114 -7.364 -7.086 7.056 847 HB3 ASP 114 1HB ASP 114 -6.060 -5.964 6.692 848 H LYS 115 H LYS 115 -7.540 -8.904 8.349 849 HA LYS 115 HA LYS 115 -6.603 -10.321 10.724 850 HB2 LYS 115 2HB LYS 115 -8.874 -11.113 8.874 851 HB3 LYS 115 1HB LYS 115 -8.543 -11.770 10.471 852 HG2 LYS 115 2HG LYS 115 -9.610 -9.039 9.749 853 HG3 LYS 115 1HG LYS 115 -10.377 -10.277 10.733 854 HD2 LYS 115 2HD LYS 115 -7.942 -8.630 11.525 855 HD3 LYS 115 1HD LYS 115 -9.595 -8.349 12.063 856 HE2 LYS 115 2HE LYS 115 -9.594 -10.583 13.142 857 HE3 LYS 115 1HE LYS 115 -7.902 -10.780 12.675 858 HZ1 LYS 115 3HZ LYS 115 -7.363 -8.826 13.992 859 HZ2 LYS 115 1HZ LYS 115 -8.117 -10.000 14.949 860 HZ3 LYS 115 2HZ LYS 115 -8.987 -8.645 14.430 861 H THR 116 H THR 116 -5.643 -10.383 7.486 862 HA THR 116 HA THR 116 -4.754 -13.165 7.567 863 HB THR 116 HB THR 116 -3.567 -12.727 5.459 864 HG1 THR 116 HG1 THR 116 -4.511 -10.090 5.258 865 HG21 THR 116 3HG2 THR 116 -5.460 -12.124 3.981 866 HG22 THR 116 1HG2 THR 116 -6.354 -11.503 5.372 867 HG23 THR 116 2HG2 THR 116 -5.980 -13.226 5.258 868 H THR 117 H THR 117 -3.570 -9.923 8.260 869 HA THR 117 HA THR 117 -0.792 -10.486 8.464 870 HB THR 117 HB THR 117 -2.367 -8.204 9.754 871 HG1 THR 117 HG1 THR 117 -2.582 -8.424 7.389 872 HG21 THR 117 3HG2 THR 117 -0.061 -8.365 10.626 873 HG22 THR 117 1HG2 THR 117 -0.255 -6.928 9.619 874 HG23 THR 117 2HG2 THR 117 0.570 -8.353 8.978 875 H GLY 118 H GLY 118 0.296 -11.441 10.101 876 HA2 GLY 118 2HA GLY 118 0.892 -12.122 12.229 877 HA3 GLY 118 1HA GLY 118 -0.596 -11.454 12.873 878 H GLN 119 H GLN 119 -1.796 -13.276 10.461 879 HA GLN 119 HA GLN 119 -2.221 -15.579 12.283 880 HB2 GLN 119 2HB GLN 119 -4.142 -14.413 10.218 881 HB3 GLN 119 1HB GLN 119 -4.475 -15.788 11.260 882 HG2 GLN 119 2HG GLN 119 -4.041 -12.924 12.179 883 HG3 GLN 119 1HG GLN 119 -5.590 -13.757 12.072 884 HE21 GLN 119 1HE2 GLN 119 -2.658 -13.389 13.907 885 HE22 GLN 119 2HE2 GLN 119 -3.145 -14.323 15.273 886 H GLN 120 H GLN 120 -2.839 -15.072 8.772 887 HA GLN 120 HA GLN 120 -1.604 -17.707 8.166 888 HB2 GLN 120 2HB GLN 120 -2.948 -17.629 6.072 889 HB3 GLN 120 1HB GLN 120 -3.949 -17.502 7.514 890 HG2 GLN 120 2HG GLN 120 -4.035 -15.016 7.169 891 HG3 GLN 120 1HG GLN 120 -3.175 -15.242 5.648 892 HE21 GLN 120 1HE2 GLN 120 -6.192 -15.754 7.353 893 HE22 GLN 120 2HE2 GLN 120 -7.152 -16.098 5.959 894 H SER 121 H SER 121 -0.360 -15.015 8.565 895 HA SER 121 HA SER 121 1.821 -15.123 6.839 896 HB2 SER 121 2HB SER 121 1.481 -12.969 5.547 897 HB3 SER 121 1HB SER 121 0.346 -14.233 5.065 898 HG SER 121 HG SER 121 -1.135 -13.231 6.595 899 H TYR 122 H TYR 122 3.406 -13.384 7.436 900 HA TYR 122 HA TYR 122 3.231 -13.034 10.269 901 HB2 TYR 122 2HB TYR 122 5.341 -13.612 8.998 902 HB3 TYR 122 1HB TYR 122 5.406 -11.950 8.422 903 HD1 TYR 122 HD2 TYR 122 5.283 -13.940 11.619 904 HD2 TYR 122 HD1 TYR 122 6.603 -10.338 9.743 905 HE1 TYR 122 HE2 TYR 122 6.436 -13.269 13.691 906 HE2 TYR 122 HE1 TYR 122 7.744 -9.673 11.807 907 HH TYR 122 HH TYR 122 8.321 -11.767 14.376 908 H ASP 123 H ASP 123 3.924 -10.959 11.318 909 HA ASP 123 HA ASP 123 2.178 -8.742 10.429 910 HB2 ASP 123 2HB ASP 123 1.618 -8.302 12.726 911 HB3 ASP 123 1HB ASP 123 1.401 -10.022 12.453 912 H GLY 124 H GLY 124 3.303 -7.061 12.730 913 HA2 GLY 124 2HA GLY 124 5.197 -5.754 13.198 914 HA3 GLY 124 1HA GLY 124 6.036 -6.460 11.821 915 H GLY 125 H GLY 125 4.049 -6.091 9.884 916 HA2 GLY 125 2HA GLY 125 2.612 -3.753 9.760 917 HA3 GLY 125 1HA GLY 125 4.210 -3.353 9.125 918 H ARG 126 H ARG 126 1.497 -3.640 7.844 919 HA ARG 126 HA ARG 126 2.477 -5.090 5.459 920 HB2 ARG 126 2HB ARG 126 0.636 -6.387 6.535 921 HB3 ARG 126 1HB ARG 126 -0.419 -4.983 6.430 922 HG2 ARG 126 2HG ARG 126 -0.833 -5.284 4.167 923 HG3 ARG 126 1HG ARG 126 0.776 -5.930 3.843 924 HD2 ARG 126 2HD ARG 126 -1.541 -7.403 5.131 925 HD3 ARG 126 1HD ARG 126 -0.870 -7.690 3.515 926 HE ARG 126 HE ARG 126 1.279 -7.959 5.157 927 HH11 ARG 126 1HH1 ARG 126 -1.866 -9.535 5.109 928 HH12 ARG 126 2HH1 ARG 126 -1.264 -10.998 5.814 929 HH21 ARG 126 1HH2 ARG 126 2.014 -9.843 6.172 930 HH22 ARG 126 2HH2 ARG 126 0.927 -11.167 6.416 931 H TYR 127 H TYR 127 1.673 -4.080 3.432 932 HA TYR 127 HA TYR 127 0.873 -1.271 3.779 933 HB2 TYR 127 2HB TYR 127 2.762 -0.388 2.654 934 HB3 TYR 127 1HB TYR 127 3.405 -1.519 3.833 935 HD1 TYR 127 HD2 TYR 127 4.037 -3.932 2.909 936 HD2 TYR 127 HD1 TYR 127 3.473 -0.508 0.411 937 HE1 TYR 127 HE2 TYR 127 5.364 -4.992 1.127 938 HE2 TYR 127 HE1 TYR 127 4.800 -1.574 -1.358 939 HH TYR 127 HH TYR 127 5.692 -4.893 -1.237 940 H MET 128 H MET 128 0.283 -0.210 1.912 941 HA MET 128 HA MET 128 -0.293 -1.636 -0.567 942 HB2 MET 128 2HB MET 128 -2.334 -1.486 1.265 943 HB3 MET 128 1HB MET 128 -2.499 0.119 0.567 944 HG2 MET 128 2HG MET 128 -2.562 -2.434 -1.050 945 HG3 MET 128 1HG MET 128 -3.992 -1.598 -0.462 946 HE1 MET 128 3HE MET 128 -4.224 1.533 -2.638 947 HE2 MET 128 1HE MET 128 -3.740 1.370 -0.950 948 HE3 MET 128 2HE MET 128 -5.078 0.406 -1.583 949 H GLU 129 H GLU 129 -0.236 -0.091 -2.355 950 HA GLU 129 HA GLU 129 0.746 2.624 -1.634 951 HB2 GLU 129 2HB GLU 129 2.656 1.123 -2.095 952 HB3 GLU 129 1HB GLU 129 1.963 0.707 -3.659 953 HG2 GLU 129 2HG GLU 129 2.184 3.136 -4.314 954 HG3 GLU 129 1HG GLU 129 3.050 3.407 -2.803 955 H LEU 130 H LEU 130 -0.182 4.214 -2.753 956 HA LEU 130 HA LEU 130 -1.727 3.633 -5.217 957 HB2 LEU 130 2HB LEU 130 -2.257 6.066 -3.470 958 HB3 LEU 130 1HB LEU 130 -3.302 5.315 -4.661 959 HG LEU 130 HG LEU 130 -3.314 3.287 -2.928 960 HD11 LEU 130 1HD1 LEU 130 -3.212 4.020 -0.590 961 HD12 LEU 130 2HD1 LEU 130 -2.639 5.608 -1.104 962 HD13 LEU 130 3HD1 LEU 130 -1.651 4.173 -1.393 963 HD21 LEU 130 3HD2 LEU 130 -4.923 5.794 -2.398 964 HD22 LEU 130 1HD2 LEU 130 -5.332 4.152 -1.898 965 HD23 LEU 130 2HD2 LEU 130 -5.299 4.566 -3.609 966 H GLU 131 H GLU 131 -1.270 4.845 -6.996 967 HA GLU 131 HA GLU 131 0.486 7.221 -6.779 968 HB2 GLU 131 2HB GLU 131 0.402 5.113 -8.981 969 HB3 GLU 131 1HB GLU 131 1.309 6.619 -9.077 970 HG2 GLU 131 2HG GLU 131 2.819 5.937 -7.337 971 HG3 GLU 131 1HG GLU 131 1.816 4.542 -6.920 972 HA PRO 132 HA PRO 132 -3.718 8.436 -8.305 973 HB2 PRO 132 2HB PRO 132 -3.639 11.029 -7.356 974 HB3 PRO 132 1HB PRO 132 -4.062 9.639 -6.334 975 HG2 PRO 132 2HG PRO 132 -1.419 11.047 -6.589 976 HG3 PRO 132 1HG PRO 132 -2.272 10.512 -5.118 977 HD2 PRO 132 2HD PRO 132 -0.252 9.068 -6.183 978 HD3 PRO 132 1HD PRO 132 -1.636 8.284 -5.391 979 H ASP 133 H ASP 133 -4.464 10.048 -9.803 980 HA ASP 133 HA ASP 133 -2.777 10.329 -12.092 981 HB2 ASP 133 2HB ASP 133 -5.155 9.780 -12.315 982 HB3 ASP 133 1HB ASP 133 -5.620 11.242 -11.456 983 H ARG 134 H ARG 134 -3.503 12.260 -9.408 984 HA ARG 134 HA ARG 134 -1.835 14.461 -10.183 985 HB2 ARG 134 2HB ARG 134 -3.574 16.211 -9.700 986 HB3 ARG 134 1HB ARG 134 -3.892 15.289 -11.163 987 HG2 ARG 134 2HG ARG 134 -5.990 14.915 -10.407 988 HG3 ARG 134 1HG ARG 134 -5.311 13.882 -9.154 989 HD2 ARG 134 2HD ARG 134 -5.186 15.816 -7.621 990 HD3 ARG 134 1HD ARG 134 -5.818 16.871 -8.888 991 HE ARG 134 HE ARG 134 -7.300 15.140 -7.171 992 HH11 ARG 134 1HH1 ARG 134 -7.390 16.555 -10.416 993 HH12 ARG 134 2HH1 ARG 134 -9.112 16.445 -10.531 994 HH21 ARG 134 1HH2 ARG 134 -9.542 15.053 -7.357 995 HH22 ARG 134 2HH2 ARG 134 -10.327 15.597 -8.806 996 H ASP 135 H ASP 135 -1.711 16.004 -8.175 997 HA ASP 135 HA ASP 135 -1.164 14.177 -5.962 998 HB2 ASP 135 2HB ASP 135 0.445 16.063 -6.783 999 HB3 ASP 135 1HB ASP 135 -0.606 17.169 -5.894 1000 H LEU 136 H LEU 136 -2.024 14.465 -3.821 1001 HA LEU 136 HA LEU 136 -4.861 15.087 -4.077 1002 HB2 LEU 136 2HB LEU 136 -3.365 13.539 -1.945 1003 HB3 LEU 136 1HB LEU 136 -5.112 13.742 -1.995 1004 HG LEU 136 HG LEU 136 -3.396 12.214 -3.994 1005 HD11 LEU 136 1HD1 LEU 136 -3.798 11.051 -1.881 1006 HD12 LEU 136 2HD1 LEU 136 -4.604 10.258 -3.229 1007 HD13 LEU 136 3HD1 LEU 136 -5.539 11.238 -2.100 1008 HD21 LEU 136 3HD2 LEU 136 -5.150 13.315 -5.255 1009 HD22 LEU 136 1HD2 LEU 136 -6.383 12.764 -4.116 1010 HD23 LEU 136 2HD2 LEU 136 -5.518 11.597 -5.127 1011 H SER 137 H SER 137 -5.946 16.520 -2.974 1012 HA SER 137 HA SER 137 -4.564 18.363 -1.121 1013 HB2 SER 137 2HB SER 137 -6.896 18.828 -3.025 1014 HB3 SER 137 1HB SER 137 -6.215 20.050 -1.947 1015 HG SER 137 HG SER 137 -5.105 20.411 -3.746 1016 H ASP 138 H ASP 138 -6.243 19.543 0.327 1017 HA ASP 138 HA ASP 138 -7.521 17.565 1.975 1018 HB2 ASP 138 2HB ASP 138 -8.026 19.460 3.487 1019 HB3 ASP 138 1HB ASP 138 -6.331 19.414 3.025 1020 H GLY 139 H GLY 139 -9.434 16.732 1.454 1021 HA2 GLY 139 2HA GLY 139 -11.798 16.834 1.212 1022 HA3 GLY 139 1HA GLY 139 -11.662 18.428 0.484 1023 H ASP 140 H ASP 140 -9.260 16.653 -0.894 1024 HA ASP 140 HA ASP 140 -10.620 16.158 -3.395 1025 HB2 ASP 140 2HB ASP 140 -8.148 16.835 -3.075 1026 HB3 ASP 140 1HB ASP 140 -7.845 15.192 -2.555 1027 H GLU 141 H GLU 141 -10.573 13.856 -4.399 1028 HA GLU 141 HA GLU 141 -11.101 11.785 -2.339 1029 HB2 GLU 141 2HB GLU 141 -12.069 11.989 -5.221 1030 HB3 GLU 141 1HB GLU 141 -12.409 10.633 -4.143 1031 HG2 GLU 141 2HG GLU 141 -13.606 12.151 -2.605 1032 HG3 GLU 141 1HG GLU 141 -13.272 13.506 -3.685 1033 H ILE 142 H ILE 142 -10.634 9.536 -3.051 1034 HA ILE 142 HA ILE 142 -8.479 9.018 -4.919 1035 HB ILE 142 HB ILE 142 -7.217 9.838 -2.932 1036 HG12 ILE 142 2HG1 ILE 142 -5.695 7.863 -2.563 1037 HG13 ILE 142 1HG1 ILE 142 -6.880 6.827 -3.347 1038 HG21 ILE 142 1HG2 ILE 142 -7.265 8.639 -0.773 1039 HG22 ILE 142 2HG2 ILE 142 -8.560 7.604 -1.371 1040 HG23 ILE 142 3HG2 ILE 142 -8.836 9.336 -1.171 1041 HD11 ILE 142 3HD1 ILE 142 -6.537 8.019 -5.458 1042 HD12 ILE 142 1HD1 ILE 142 -5.014 7.386 -4.826 1043 HD13 ILE 142 2HD1 ILE 142 -5.389 9.104 -4.669 1044 H THR 143 H THR 143 -8.184 6.699 -5.178 1045 HA THR 143 HA THR 143 -10.559 5.103 -4.440 1046 HB THR 143 HB THR 143 -8.650 4.810 -6.806 1047 HG1 THR 143 HG1 THR 143 -9.842 6.311 -7.670 1048 HG21 THR 143 3HG2 THR 143 -9.725 2.670 -6.210 1049 HG22 THR 143 1HG2 THR 143 -10.358 3.293 -7.740 1050 HG23 THR 143 2HG2 THR 143 -11.308 3.447 -6.262 1051 H LEU 144 H LEU 144 -10.258 3.255 -3.214 1052 HA LEU 144 HA LEU 144 -7.527 2.397 -2.487 1053 HB2 LEU 144 2HB LEU 144 -9.999 2.877 -0.786 1054 HB3 LEU 144 1HB LEU 144 -8.892 1.618 -0.302 1055 HG LEU 144 HG LEU 144 -8.562 3.715 0.952 1056 HD11 LEU 144 1HD1 LEU 144 -6.165 2.982 -0.757 1057 HD12 LEU 144 2HD1 LEU 144 -6.694 2.161 0.713 1058 HD13 LEU 144 3HD1 LEU 144 -6.131 3.827 0.797 1059 HD21 LEU 144 3HD2 LEU 144 -7.689 4.947 -1.674 1060 HD22 LEU 144 1HD2 LEU 144 -7.629 5.704 -0.081 1061 HD23 LEU 144 2HD2 LEU 144 -9.183 5.308 -0.806 1062 H ASP 145 H ASP 145 -7.550 0.728 -4.065 1063 HA ASP 145 HA ASP 145 -9.468 -1.472 -3.525 1064 HB2 ASP 145 2HB ASP 145 -8.937 -2.348 -5.772 1065 HB3 ASP 145 1HB ASP 145 -9.660 -0.765 -5.802 1066 H PHE 146 H PHE 146 -8.651 -2.588 -2.010 1067 HA PHE 146 HA PHE 146 -5.890 -2.890 -1.402 1068 HB2 PHE 146 2HB PHE 146 -8.091 -4.579 -0.188 1069 HB3 PHE 146 1HB PHE 146 -6.588 -4.046 0.559 1070 HD1 PHE 146 HD2 PHE 146 -6.313 -1.436 0.854 1071 HD2 PHE 146 HD1 PHE 146 -10.064 -3.411 0.242 1072 HE1 PHE 146 HE2 PHE 146 -7.505 0.512 1.764 1073 HE2 PHE 146 HE1 PHE 146 -11.232 -1.457 1.147 1074 HZ PHE 146 HZ PHE 146 -9.957 0.503 1.907 1075 H ASN 147 H ASN 147 -7.514 -4.495 -3.797 1076 HA ASN 147 HA ASN 147 -6.394 -7.101 -3.635 1077 HB2 ASN 147 2HB ASN 147 -6.815 -7.269 -6.051 1078 HB3 ASN 147 1HB ASN 147 -8.202 -6.558 -5.239 1079 HD21 ASN 147 1HD2 ASN 147 -8.773 -4.443 -5.729 1080 HD22 ASN 147 2HD2 ASN 147 -8.041 -3.550 -7.014 1081 H LEU 148 H LEU 148 -5.149 -3.974 -4.548 1082 HA LEU 148 HA LEU 148 -2.769 -4.786 -5.891 1083 HB2 LEU 148 2HB LEU 148 -3.319 -2.153 -4.468 1084 HB3 LEU 148 1HB LEU 148 -2.106 -2.435 -5.714 1085 HG LEU 148 HG LEU 148 -5.116 -2.504 -6.091 1086 HD11 LEU 148 1HD1 LEU 148 -3.144 -0.450 -7.124 1087 HD12 LEU 148 2HD1 LEU 148 -4.243 -0.241 -5.754 1088 HD13 LEU 148 3HD1 LEU 148 -4.902 -0.481 -7.368 1089 HD21 LEU 148 3HD2 LEU 148 -2.926 -2.993 -8.131 1090 HD22 LEU 148 1HD2 LEU 148 -4.627 -2.705 -8.524 1091 HD23 LEU 148 2HD2 LEU 148 -4.175 -4.124 -7.587 1092 H ALA 149 H ALA 149 -3.552 -5.156 -2.654 1093 HA ALA 149 HA ALA 149 -1.340 -3.956 -1.333 1094 HB1 ALA 149 3HB ALA 149 -3.467 -4.404 -0.171 1095 HB2 ALA 149 1HB ALA 149 -2.118 -5.187 0.657 1096 HB3 ALA 149 2HB ALA 149 -3.213 -6.141 -0.346 1097 H TYR 150 H TYR 150 0.535 -4.750 -0.735 1098 HA TYR 150 HA TYR 150 1.499 -7.058 -2.296 1099 HB2 TYR 150 2HB TYR 150 3.273 -4.962 -0.993 1100 HB3 TYR 150 1HB TYR 150 3.606 -5.958 -2.403 1101 HD1 TYR 150 HD2 TYR 150 1.929 -2.904 -1.191 1102 HD2 TYR 150 HD1 TYR 150 2.737 -5.292 -4.618 1103 HE1 TYR 150 HE2 TYR 150 1.231 -1.060 -2.642 1104 HE2 TYR 150 HE1 TYR 150 2.045 -3.440 -6.058 1105 HH TYR 150 HH TYR 150 1.595 -0.274 -4.966 1106 H SER 151 H SER 151 2.796 -8.644 -1.334 1107 HA SER 151 HA SER 151 2.757 -9.136 1.425 1108 HB2 SER 151 2HB SER 151 3.163 -10.836 -0.391 1109 HB3 SER 151 1HB SER 151 4.763 -10.134 -0.646 1110 HG SER 151 HG SER 151 3.864 -11.817 1.319 1111 HA PRO 152 HA PRO 152 5.565 -5.829 2.560 1112 HB2 PRO 152 2HB PRO 152 5.814 -7.007 5.265 1113 HB3 PRO 152 1HB PRO 152 4.983 -5.520 4.771 1114 HG2 PRO 152 2HG PRO 152 3.631 -7.710 5.602 1115 HG3 PRO 152 1HG PRO 152 2.974 -6.598 4.379 1116 HD2 PRO 152 2HD PRO 152 4.335 -9.257 3.970 1117 HD3 PRO 152 1HD PRO 152 2.860 -8.618 3.206 1118 H PHE 153 H PHE 153 7.692 -5.606 2.062 1119 HA PHE 153 HA PHE 153 9.725 -7.278 1.824 1120 HB2 PHE 153 2HB PHE 153 9.977 -4.545 3.159 1121 HB3 PHE 153 1HB PHE 153 11.267 -5.405 2.345 1122 HD1 PHE 153 HD2 PHE 153 11.337 -5.511 -0.140 1123 HD2 PHE 153 HD1 PHE 153 8.336 -3.236 1.895 1124 HE1 PHE 153 HE2 PHE 153 10.863 -4.278 -2.212 1125 HE2 PHE 153 HE1 PHE 153 7.883 -1.996 -0.183 1126 HZ PHE 153 HZ PHE 153 9.144 -2.514 -2.234 1127 H CYS 154 H CYS 154 8.945 -5.637 4.896 1128 HA CYS 154 HA CYS 154 11.200 -6.675 6.303 1129 HB2 CYS 154 2HB CYS 154 8.762 -5.195 7.339 1130 HB3 CYS 154 1HB CYS 154 10.291 -5.422 8.200 1131 HG CYS 154 HG CYS 154 9.992 -3.734 5.241 1132 H ALA 155 H ALA 155 7.709 -7.439 6.356 1133 HA ALA 155 HA ALA 155 7.648 -9.113 8.602 1134 HB1 ALA 155 3HB ALA 155 5.614 -8.223 7.520 1135 HB2 ALA 155 1HB ALA 155 5.520 -9.974 7.727 1136 HB3 ALA 155 2HB ALA 155 5.876 -9.287 6.138 1137 H TYR 156 H TYR 156 8.389 -9.851 5.234 1138 HA TYR 156 HA TYR 156 8.714 -12.710 5.771 1139 HB2 TYR 156 2HB TYR 156 8.697 -11.058 3.220 1140 HB3 TYR 156 1HB TYR 156 9.153 -12.758 3.224 1141 HD1 TYR 156 HD1 TYR 156 6.369 -10.641 4.643 1142 HD2 TYR 156 HD2 TYR 156 7.427 -14.273 2.636 1143 HE1 TYR 156 HE1 TYR 156 4.001 -11.274 4.545 1144 HE2 TYR 156 HE2 TYR 156 5.048 -14.900 2.538 1145 HH TYR 156 HH TYR 156 2.953 -14.405 3.666 1146 H SER 157 H SER 157 10.772 -9.906 5.437 1147 HA SER 157 HA SER 157 13.126 -11.596 5.931 1148 HB2 SER 157 2HB SER 157 12.998 -9.536 3.684 1149 HB3 SER 157 1HB SER 157 14.494 -10.260 4.280 1150 HG SER 157 HG SER 157 12.288 -11.691 3.214 1151 H ASP 158 H ASP 158 14.157 -10.875 7.646 1152 HA ASP 158 HA ASP 158 13.392 -8.409 8.954 1153 HB2 ASP 158 2HB ASP 158 15.263 -10.676 9.754 1154 HB3 ASP 158 1HB ASP 158 15.024 -9.245 10.757 1155 H THR 159 H THR 159 16.019 -9.428 6.893 1156 HA THR 159 HA THR 159 17.946 -7.492 7.457 1157 HB THR 159 HB THR 159 18.332 -9.420 5.939 1158 HG1 THR 159 HG1 THR 159 18.815 -6.861 4.781 1159 HG21 THR 159 3HG2 THR 159 17.609 -9.368 3.588 1160 HG22 THR 159 1HG2 THR 159 16.677 -7.905 3.893 1161 HG23 THR 159 2HG2 THR 159 16.215 -9.422 4.673 1162 H PHE 160 H PHE 160 14.826 -7.171 5.953 1163 HA PHE 160 HA PHE 160 15.210 -4.315 5.364 1164 HB2 PHE 160 2HB PHE 160 12.768 -6.155 5.124 1165 HB3 PHE 160 1HB PHE 160 12.740 -4.437 4.753 1166 HD1 PHE 160 HD2 PHE 160 14.347 -7.660 3.730 1167 HD2 PHE 160 HD1 PHE 160 13.313 -3.675 2.574 1168 HE1 PHE 160 HE2 PHE 160 15.034 -8.145 1.419 1169 HE2 PHE 160 HE1 PHE 160 13.995 -4.172 0.262 1170 HZ PHE 160 HZ PHE 160 14.860 -6.405 -0.318 1171 H SER 161 H SER 161 15.009 -2.936 7.059 1172 HA SER 161 HA SER 161 14.291 -3.792 9.677 1173 HB2 SER 161 2HB SER 161 16.002 -2.048 9.222 1174 HB3 SER 161 1HB SER 161 14.739 -0.967 8.637 1175 HG SER 161 HG SER 161 14.348 -0.448 10.610 1176 H CYS 162 H CYS 162 12.431 -3.211 10.942 1177 HA CYS 162 HA CYS 162 10.074 -3.619 9.348 1178 HB2 CYS 162 2HB CYS 162 10.535 -4.937 11.392 1179 HB3 CYS 162 1HB CYS 162 10.428 -3.478 12.369 1180 HG CYS 162 HG CYS 162 7.662 -3.102 11.543 1181 HA PRO 163 HA PRO 163 8.470 0.630 9.651 1182 HB2 PRO 163 2HB PRO 163 5.848 0.204 8.950 1183 HB3 PRO 163 1HB PRO 163 7.172 0.137 7.774 1184 HG2 PRO 163 2HG PRO 163 5.729 -2.113 9.090 1185 HG3 PRO 163 1HG PRO 163 6.292 -1.964 7.417 1186 HD2 PRO 163 2HD PRO 163 7.653 -3.389 9.347 1187 HD3 PRO 163 1HD PRO 163 8.435 -2.674 7.922 1188 H LEU 164 H LEU 164 6.853 1.861 10.847 1189 HA LEU 164 HA LEU 164 5.831 0.588 13.311 1190 HB2 LEU 164 2HB LEU 164 7.450 2.370 13.800 1191 HB3 LEU 164 1HB LEU 164 6.592 3.485 12.752 1192 HG LEU 164 HG LEU 164 4.640 3.445 14.334 1193 HD11 LEU 164 1HD1 LEU 164 4.876 2.487 16.579 1194 HD12 LEU 164 2HD1 LEU 164 6.413 1.754 16.111 1195 HD13 LEU 164 3HD1 LEU 164 4.914 1.254 15.321 1196 HD21 LEU 164 3HD2 LEU 164 5.646 4.819 16.095 1197 HD22 LEU 164 1HD2 LEU 164 6.288 5.237 14.507 1198 HD23 LEU 164 2HD2 LEU 164 7.257 4.271 15.624 1199 HA PRO 165 HA PRO 165 2.037 1.623 10.866 1200 HB2 PRO 165 2HB PRO 165 0.600 -0.619 11.406 1201 HB3 PRO 165 1HB PRO 165 1.911 -0.635 10.206 1202 HG2 PRO 165 2HG PRO 165 1.960 -1.606 13.046 1203 HG3 PRO 165 1HG PRO 165 2.639 -2.361 11.586 1204 HD2 PRO 165 2HD PRO 165 4.136 -0.868 13.378 1205 HD3 PRO 165 1HD PRO 165 4.570 -1.098 11.670 1206 HA PRO 166 HA PRO 166 0.056 3.262 14.635 1207 HB2 PRO 166 2HB PRO 166 -2.237 4.274 13.433 1208 HB3 PRO 166 1HB PRO 166 -0.667 5.098 13.407 1209 HG2 PRO 166 2HG PRO 166 -1.940 3.420 11.278 1210 HG3 PRO 166 1HG PRO 166 -1.043 4.947 11.120 1211 HD2 PRO 166 2HD PRO 166 0.111 2.547 10.580 1212 HD3 PRO 166 1HD PRO 166 1.040 3.901 11.260 1213 H GLU 167 H GLU 167 -2.200 3.124 15.591 1214 HA GLU 167 HA GLU 167 -3.310 0.417 15.488 1215 HB2 GLU 167 2HB GLU 167 -4.070 2.807 17.231 1216 HB3 GLU 167 1HB GLU 167 -4.614 1.144 17.468 1217 HG2 GLU 167 2HG GLU 167 -2.407 0.401 18.053 1218 HG3 GLU 167 1HG GLU 167 -1.684 1.920 17.520 1219 H SER 168 H SER 168 -4.053 3.599 14.330 1220 HA SER 168 HA SER 168 -6.879 3.441 14.073 1221 HB2 SER 168 2HB SER 168 -4.936 5.253 12.578 1222 HB3 SER 168 1HB SER 168 -6.661 5.540 12.829 1223 HG SER 168 HG SER 168 -4.620 6.179 14.425 1224 H ASN 169 H ASN 169 -4.377 2.096 12.127 1225 HA ASN 169 HA ASN 169 -5.883 2.146 9.590 1226 HB2 ASN 169 2HB ASN 169 -3.774 1.464 8.544 1227 HB3 ASN 169 1HB ASN 169 -3.467 2.841 9.597 1228 HD21 ASN 169 1HD2 ASN 169 -1.433 1.091 8.721 1229 HD22 ASN 169 2HD2 ASN 169 -0.819 0.236 10.087 1230 H TRP 170 H TRP 170 -6.029 0.253 12.191 1231 HA TRP 170 HA TRP 170 -5.548 -2.388 11.106 1232 HB2 TRP 170 2HB TRP 170 -6.781 -1.468 13.739 1233 HB3 TRP 170 1HB TRP 170 -6.573 -3.165 13.313 1234 HD1 TRP 170 HD1 TRP 170 -3.533 -1.582 12.057 1235 HE1 TRP 170 HE1 TRP 170 -1.605 -1.754 13.742 1236 HE3 TRP 170 HE3 TRP 170 -6.190 -2.884 16.221 1237 HZ2 TRP 170 HZ2 TRP 170 -1.233 -2.370 16.460 1238 HZ3 TRP 170 HZ3 TRP 170 -4.972 -3.249 18.328 1239 HH2 TRP 170 HH2 TRP 170 -2.541 -2.998 18.450 1240 H LEU 171 H LEU 171 -6.912 -3.445 9.866 1241 HA LEU 171 HA LEU 171 -9.747 -2.704 9.628 1242 HB2 LEU 171 2HB LEU 171 -8.205 -4.624 7.831 1243 HB3 LEU 171 1HB LEU 171 -9.694 -3.770 7.470 1244 HG LEU 171 HG LEU 171 -6.894 -2.576 7.594 1245 HD11 LEU 171 1HD1 LEU 171 -7.353 -3.883 5.569 1246 HD12 LEU 171 2HD1 LEU 171 -7.138 -2.172 5.218 1247 HD13 LEU 171 3HD1 LEU 171 -8.762 -2.873 5.223 1248 HD21 LEU 171 3HD2 LEU 171 -8.456 -0.925 8.460 1249 HD22 LEU 171 1HD2 LEU 171 -9.501 -1.123 7.049 1250 HD23 LEU 171 2HD2 LEU 171 -7.880 -0.444 6.867 1251 H GLU 172 H GLU 172 -11.155 -3.997 10.800 1252 HA GLU 172 HA GLU 172 -10.352 -6.649 11.745 1253 HB2 GLU 172 2HB GLU 172 -11.580 -4.888 13.177 1254 HB3 GLU 172 1HB GLU 172 -13.020 -5.242 12.236 1255 HG2 GLU 172 2HG GLU 172 -13.094 -6.436 14.350 1256 HG3 GLU 172 1HG GLU 172 -12.940 -7.593 13.027 1257 H THR 173 H THR 173 -10.238 -6.929 9.273 1258 HA THR 173 HA THR 173 -12.321 -8.704 8.401 1259 HB THR 173 HB THR 173 -13.206 -6.499 7.632 1260 HG1 THR 173 HG1 THR 173 -13.938 -7.661 6.066 1261 HG21 THR 173 3HG2 THR 173 -11.108 -5.249 7.297 1262 HG22 THR 173 1HG2 THR 173 -12.086 -5.241 5.823 1263 HG23 THR 173 2HG2 THR 173 -10.682 -6.303 5.948 1264 H ALA 174 H ALA 174 -11.581 -10.001 6.612 1265 HA ALA 174 HA ALA 174 -8.662 -10.181 6.376 1266 HB1 ALA 174 3HB ALA 174 -9.891 -12.254 6.854 1267 HB2 ALA 174 1HB ALA 174 -9.107 -12.352 5.274 1268 HB3 ALA 174 2HB ALA 174 -10.845 -12.051 5.385 1269 H VAL 175 H VAL 175 -8.070 -8.552 5.013 1270 HA VAL 175 HA VAL 175 -9.214 -7.867 2.539 1271 HB VAL 175 HB VAL 175 -6.307 -7.639 3.452 1272 HG11 VAL 175 1HG1 VAL 175 -7.589 -6.315 1.017 1273 HG12 VAL 175 2HG1 VAL 175 -6.401 -7.623 0.964 1274 HG13 VAL 175 3HG1 VAL 175 -5.944 -6.043 1.604 1275 HG21 VAL 175 3HG2 VAL 175 -6.875 -5.256 3.842 1276 HG22 VAL 175 1HG2 VAL 175 -7.897 -6.330 4.801 1277 HG23 VAL 175 2HG2 VAL 175 -8.540 -5.571 3.342 1278 H THR 176 H THR 176 -9.830 -9.712 1.530 1279 HA THR 176 HA THR 176 -7.754 -11.171 0.026 1280 HB THR 176 HB THR 176 -9.444 -13.113 -0.009 1281 HG1 THR 176 HG1 THR 176 -10.591 -11.632 2.151 1282 HG21 THR 176 3HG2 THR 176 -7.459 -13.259 1.460 1283 HG22 THR 176 1HG2 THR 176 -8.869 -13.994 2.230 1284 HG23 THR 176 2HG2 THR 176 -8.328 -12.391 2.729 1285 H ALA 177 H ALA 177 -8.025 -10.948 -2.111 1286 HA ALA 177 HA ALA 177 -10.624 -10.333 -3.316 1287 HB1 ALA 177 3HB ALA 177 -9.659 -8.115 -2.781 1288 HB2 ALA 177 1HB ALA 177 -9.726 -8.374 -4.528 1289 HB3 ALA 177 2HB ALA 177 -8.193 -8.533 -3.668 1290 H GLY 178 H GLY 178 -10.781 -11.415 -5.246 1291 HA2 GLY 178 2HA GLY 178 -10.338 -13.245 -6.572 1292 HA3 GLY 178 1HA GLY 178 -8.841 -12.393 -6.926 1293 H GLU 179 H GLU 179 -7.629 -14.299 -7.106 1294 HA GLU 179 HA GLU 179 -7.264 -16.290 -5.143 1295 HB2 GLU 179 2HB GLU 179 -5.238 -15.260 -7.180 1296 HB3 GLU 179 1HB GLU 179 -5.133 -16.793 -6.312 1297 HG2 GLU 179 2HG GLU 179 -7.285 -17.489 -7.423 1298 HG3 GLU 179 1HG GLU 179 -7.217 -16.009 -8.376 1299 H ARG 180 H ARG 180 -5.485 -16.618 -3.700 1300 HA ARG 180 HA ARG 180 -3.839 -14.533 -2.690 1301 HB2 ARG 180 2HB ARG 180 -4.921 -14.073 -0.546 1302 HB3 ARG 180 1HB ARG 180 -6.020 -13.643 -1.843 1303 HG2 ARG 180 2HG ARG 180 -6.221 -16.270 -0.332 1304 HG3 ARG 180 1HG ARG 180 -7.031 -14.801 0.205 1305 HD2 ARG 180 2HD ARG 180 -8.307 -14.722 -1.905 1306 HD3 ARG 180 1HD ARG 180 -7.480 -16.173 -2.474 1307 HE ARG 180 HE ARG 180 -8.641 -16.881 -0.085 1308 HH11 ARG 180 1HH1 ARG 180 -9.847 -15.621 -3.165 1309 HH12 ARG 180 2HH1 ARG 180 -11.386 -16.407 -3.014 1310 HH21 ARG 180 1HH2 ARG 180 -10.638 -17.952 0.038 1311 HH22 ARG 180 2HH2 ARG 180 -11.830 -17.724 -1.200 1312 H THR 181 H THR 181 -2.740 -15.192 -0.611 1313 HA THR 181 HA THR 181 -1.833 -17.639 -0.122 1314 HB THR 181 HB THR 181 -2.759 -15.786 2.120 1315 HG1 THR 181 HG1 THR 181 -0.286 -15.817 0.686 1316 HG21 THR 181 3HG2 THR 181 -0.845 -16.751 3.387 1317 HG22 THR 181 1HG2 THR 181 -0.520 -17.853 2.048 1318 HG23 THR 181 2HG2 THR 181 -2.020 -17.997 2.965 1319 H ASP 182 H ASP 182 -2.709 -19.530 0.029 1320 HA ASP 182 HA ASP 182 -5.052 -20.117 1.701 1321 HB2 ASP 182 2HB ASP 182 -5.956 -19.810 -0.584 1322 HB3 ASP 182 1HB ASP 182 -4.751 -20.905 -1.242 1323 H LEU 183 H LEU 183 -5.131 -22.404 2.295 1324 HA LEU 183 HA LEU 183 -2.608 -23.291 3.170 1325 HB2 LEU 183 2HB LEU 183 -3.715 -25.055 4.319 1326 HB3 LEU 183 1HB LEU 183 -4.771 -23.663 4.388 1327 HG LEU 183 HG LEU 183 -5.190 -26.023 2.498 1328 HD11 LEU 183 1HD1 LEU 183 -5.411 -26.760 4.821 1329 HD12 LEU 183 2HD1 LEU 183 -6.968 -26.763 4.002 1330 HD13 LEU 183 3HD1 LEU 183 -6.578 -25.471 5.140 1331 HD21 LEU 183 3HD2 LEU 183 -7.093 -23.760 3.208 1332 HD22 LEU 183 1HD2 LEU 183 -7.461 -25.147 2.178 1333 HD23 LEU 183 2HD2 LEU 183 -6.257 -23.967 1.666 1334 H GLU 184 H GLU 184 -4.431 -24.179 0.322 1335 HA GLU 184 HA GLU 184 -2.257 -25.945 -0.585 1336 HB2 GLU 184 2HB GLU 184 -3.969 -27.560 -1.519 1337 HB3 GLU 184 1HB GLU 184 -3.832 -27.555 0.234 1338 HG2 GLU 184 2HG GLU 184 -5.892 -26.260 0.434 1339 HG3 GLU 184 1HG GLU 184 -6.017 -26.132 -1.322 1340 H HIS 185 H HIS 185 -1.945 -23.716 -1.533 1341 HA HIS 185 HA HIS 185 -2.861 -23.703 -4.306 1342 HB2 HIS 185 2HB HIS 185 -4.588 -22.312 -3.294 1343 HB3 HIS 185 1HB HIS 185 -3.400 -21.380 -2.394 1344 HD1 HIS 185 HD1 HIS 185 -2.538 -19.294 -3.494 1345 HD2 HIS 185 HD2 HIS 185 -4.504 -21.786 -6.183 1346 HE1 HIS 185 HE1 HIS 185 -2.684 -17.996 -5.639 1347 HE2 HIS 185 HE2 HIS 185 -3.753 -19.576 -7.274 Start of MODEL 14 1 H1 MET 1 1H MET 1 -19.346 1.914 -16.705 2 H2 MET 1 2H MET 1 -20.741 1.067 -16.291 3 H3 MET 1 3H MET 1 -19.915 0.689 -17.715 4 HA MET 1 HA MET 1 -18.876 0.354 -14.972 5 HB2 MET 1 2HB MET 1 -19.823 -1.740 -16.977 6 HB3 MET 1 1HB MET 1 -19.047 -2.102 -15.438 7 HG2 MET 1 2HG MET 1 -21.705 -0.700 -15.777 8 HG3 MET 1 1HG MET 1 -21.482 -2.388 -15.328 9 HE1 MET 1 3HE MET 1 -20.330 -3.151 -12.995 10 HE2 MET 1 1HE MET 1 -19.796 -2.010 -11.760 11 HE3 MET 1 2HE MET 1 -18.926 -2.122 -13.290 12 H ASP 2 H ASP 2 -18.366 -0.976 -18.260 13 HA ASP 2 HA ASP 2 -15.717 -1.774 -17.783 14 HB2 ASP 2 2HB ASP 2 -17.136 -1.311 -20.446 15 HB3 ASP 2 1HB ASP 2 -15.630 -2.209 -20.243 16 H GLU 3 H GLU 3 -16.999 1.172 -19.389 17 HA GLU 3 HA GLU 3 -14.544 2.062 -20.468 18 HB2 GLU 3 2HB GLU 3 -15.707 4.088 -21.032 19 HB3 GLU 3 1HB GLU 3 -16.837 2.767 -21.260 20 HG2 GLU 3 2HG GLU 3 -16.789 4.750 -18.971 21 HG3 GLU 3 1HG GLU 3 -17.948 4.703 -20.289 22 H ASP 4 H ASP 4 -15.898 2.331 -17.292 23 HA ASP 4 HA ASP 4 -14.069 4.421 -16.378 24 HB2 ASP 4 2HB ASP 4 -16.383 4.410 -15.558 25 HB3 ASP 4 1HB ASP 4 -16.203 2.763 -14.959 26 H THR 5 H THR 5 -14.620 0.960 -16.064 27 HA THR 5 HA THR 5 -12.735 0.481 -13.969 28 HB THR 5 HB THR 5 -14.122 -1.472 -15.865 29 HG1 THR 5 HG1 THR 5 -15.301 0.040 -14.278 30 HG21 THR 5 3HG2 THR 5 -12.794 -2.010 -13.172 31 HG22 THR 5 1HG2 THR 5 -12.190 -2.563 -14.735 32 HG23 THR 5 2HG2 THR 5 -13.721 -3.181 -14.113 33 H GLU 6 H GLU 6 -12.556 0.479 -17.497 34 HA GLU 6 HA GLU 6 -10.075 -0.850 -17.764 35 HB2 GLU 6 2HB GLU 6 -9.912 0.160 -19.998 36 HB3 GLU 6 1HB GLU 6 -11.509 -0.516 -19.707 37 HG2 GLU 6 2HG GLU 6 -12.402 1.742 -19.301 38 HG3 GLU 6 1HG GLU 6 -10.803 2.427 -19.585 39 H ASP 7 H ASP 7 -10.875 2.645 -17.376 40 HA ASP 7 HA ASP 7 -8.266 3.675 -17.432 41 HB2 ASP 7 2HB ASP 7 -10.801 4.659 -16.051 42 HB3 ASP 7 1HB ASP 7 -9.299 5.578 -16.006 43 H TRP 8 H TRP 8 -10.225 2.758 -14.585 44 HA TRP 8 HA TRP 8 -8.503 2.836 -12.511 45 HB2 TRP 8 2HB TRP 8 -10.690 1.984 -12.071 46 HB3 TRP 8 1HB TRP 8 -10.525 0.690 -13.241 47 HD1 TRP 8 HD1 TRP 8 -8.956 1.665 -9.801 48 HE1 TRP 8 HE1 TRP 8 -8.507 -0.512 -8.504 49 HE3 TRP 8 HE3 TRP 8 -10.387 -1.735 -13.339 50 HZ2 TRP 8 HZ2 TRP 8 -8.739 -3.279 -8.908 51 HZ3 TRP 8 HZ3 TRP 8 -10.252 -4.142 -12.809 52 HH2 TRP 8 HH2 TRP 8 -9.436 -4.891 -10.624 53 H GLU 9 H GLU 9 -8.588 0.176 -14.921 54 HA GLU 9 HA GLU 9 -6.236 -1.048 -13.766 55 HB2 GLU 9 2HB GLU 9 -8.095 -2.461 -14.570 56 HB3 GLU 9 1HB GLU 9 -7.802 -1.913 -16.218 57 HG2 GLU 9 2HG GLU 9 -5.567 -2.935 -16.188 58 HG3 GLU 9 1HG GLU 9 -5.786 -3.405 -14.505 59 H THR 10 H THR 10 -6.739 1.392 -16.142 60 HA THR 10 HA THR 10 -4.540 0.784 -17.887 61 HB THR 10 HB THR 10 -5.962 3.455 -17.407 62 HG1 THR 10 HG1 THR 10 -6.596 1.216 -18.844 63 HG21 THR 10 3HG2 THR 10 -4.094 2.647 -19.668 64 HG22 THR 10 1HG2 THR 10 -3.749 3.847 -18.419 65 HG23 THR 10 2HG2 THR 10 -5.027 4.143 -19.596 66 H GLN 11 H GLN 11 -4.946 3.242 -15.263 67 HA GLN 11 HA GLN 11 -2.230 3.804 -14.912 68 HB2 GLN 11 2HB GLN 11 -2.834 4.682 -12.682 69 HB3 GLN 11 1HB GLN 11 -3.919 5.244 -13.943 70 HG2 GLN 11 2HG GLN 11 -5.659 3.712 -13.211 71 HG3 GLN 11 1HG GLN 11 -4.577 2.994 -12.020 72 HE21 GLN 11 1HE2 GLN 11 -7.172 4.313 -11.640 73 HE22 GLN 11 2HE2 GLN 11 -6.890 5.604 -10.529 74 H LEU 12 H LEU 12 -4.249 1.247 -13.456 75 HA LEU 12 HA LEU 12 -2.504 0.426 -11.422 76 HB2 LEU 12 2HB LEU 12 -4.817 -0.210 -11.355 77 HB3 LEU 12 1HB LEU 12 -4.703 -1.015 -12.905 78 HG LEU 12 HG LEU 12 -3.342 -2.820 -11.920 79 HD11 LEU 12 1HD1 LEU 12 -2.143 -1.604 -10.196 80 HD12 LEU 12 2HD1 LEU 12 -2.979 -2.985 -9.494 81 HD13 LEU 12 3HD1 LEU 12 -3.633 -1.359 -9.281 82 HD21 LEU 12 3HD2 LEU 12 -5.078 -3.879 -10.548 83 HD22 LEU 12 1HD2 LEU 12 -5.781 -3.080 -11.954 84 HD23 LEU 12 2HD2 LEU 12 -5.901 -2.330 -10.360 85 H GLN 13 H GLN 13 -2.983 -0.986 -14.680 86 HA GLN 13 HA GLN 13 -1.264 -3.154 -14.435 87 HB2 GLN 13 2HB GLN 13 -1.306 -3.337 -16.872 88 HB3 GLN 13 1HB GLN 13 -2.907 -2.937 -16.267 89 HG2 GLN 13 2HG GLN 13 -2.529 -0.562 -16.915 90 HG3 GLN 13 1HG GLN 13 -0.972 -1.021 -17.599 91 HE21 GLN 13 1HE2 GLN 13 -4.446 -1.271 -17.969 92 HE22 GLN 13 2HE2 GLN 13 -4.415 -1.785 -19.617 93 H ALA 14 H ALA 14 -0.584 0.174 -15.431 94 HA ALA 14 HA ALA 14 2.157 -0.227 -16.124 95 HB1 ALA 14 3HB ALA 14 0.832 1.640 -17.001 96 HB2 ALA 14 1HB ALA 14 2.253 2.239 -16.148 97 HB3 ALA 14 2HB ALA 14 0.663 2.313 -15.378 98 H ASN 15 H ASN 15 0.509 1.070 -13.243 99 HA ASN 15 HA ASN 15 2.769 1.785 -11.726 100 HB2 ASN 15 2HB ASN 15 -0.086 1.164 -10.854 101 HB3 ASN 15 1HB ASN 15 1.141 1.734 -9.728 102 HD21 ASN 15 1HD2 ASN 15 -1.379 2.981 -10.485 103 HD22 ASN 15 2HD2 ASN 15 -0.979 4.542 -11.101 104 H ARG 16 H ARG 16 1.264 -1.353 -12.157 105 HA ARG 16 HA ARG 16 2.736 -2.457 -9.831 106 HB2 ARG 16 2HB ARG 16 1.251 -4.341 -9.869 107 HB3 ARG 16 1HB ARG 16 0.270 -2.881 -9.963 108 HG2 ARG 16 2HG ARG 16 -0.016 -3.221 -12.386 109 HG3 ARG 16 1HG ARG 16 0.976 -4.678 -12.309 110 HD2 ARG 16 2HD ARG 16 -0.698 -5.678 -10.749 111 HD3 ARG 16 1HD ARG 16 -1.708 -4.242 -10.958 112 HE ARG 16 HE ARG 16 -1.410 -4.985 -13.490 113 HH11 ARG 16 1HH1 ARG 16 -2.170 -6.979 -10.697 114 HH12 ARG 16 2HH1 ARG 16 -3.061 -8.138 -11.627 115 HH21 ARG 16 1HH2 ARG 16 -2.514 -6.543 -14.692 116 HH22 ARG 16 2HH2 ARG 16 -3.256 -7.891 -13.893 117 H ASP 17 H ASP 17 2.649 -2.545 -13.343 118 HA ASP 17 HA ASP 17 4.041 -4.992 -13.788 119 HB2 ASP 17 2HB ASP 17 2.761 -3.911 -15.572 120 HB3 ASP 17 1HB ASP 17 3.783 -2.482 -15.505 121 H GLU 18 H GLU 18 5.059 -1.628 -13.517 122 HA GLU 18 HA GLU 18 7.843 -1.983 -13.700 123 HB2 GLU 18 2HB GLU 18 8.024 0.188 -12.502 124 HB3 GLU 18 1HB GLU 18 6.861 0.241 -13.820 125 HG2 GLU 18 2HG GLU 18 5.001 0.035 -12.209 126 HG3 GLU 18 1HG GLU 18 6.159 -0.046 -10.882 127 H LYS 19 H LYS 19 5.609 -2.356 -10.951 128 HA LYS 19 HA LYS 19 7.657 -2.674 -8.951 129 HB2 LYS 19 2HB LYS 19 4.693 -3.343 -8.780 130 HB3 LYS 19 1HB LYS 19 5.809 -3.267 -7.418 131 HG2 LYS 19 2HG LYS 19 5.081 -0.943 -9.212 132 HG3 LYS 19 1HG LYS 19 4.396 -1.247 -7.617 133 HD2 LYS 19 2HD LYS 19 6.498 -0.796 -6.533 134 HD3 LYS 19 1HD LYS 19 7.373 -0.805 -8.071 135 HE2 LYS 19 2HE LYS 19 6.951 1.498 -7.152 136 HE3 LYS 19 1HE LYS 19 6.302 1.246 -8.769 137 HZ1 LYS 19 3HZ LYS 19 4.747 2.421 -7.364 138 HZ2 LYS 19 1HZ LYS 19 4.743 1.158 -6.240 139 HZ3 LYS 19 2HZ LYS 19 4.116 0.913 -7.792 140 H ASP 20 H ASP 20 5.957 -4.774 -11.097 141 HA ASP 20 HA ASP 20 6.328 -7.284 -9.842 142 HB2 ASP 20 2HB ASP 20 4.663 -7.023 -11.594 143 HB3 ASP 20 1HB ASP 20 5.868 -6.472 -12.749 144 H ARG 21 H ARG 21 8.206 -5.458 -12.218 145 HA ARG 21 HA ARG 21 10.411 -7.405 -12.123 146 HB2 ARG 21 2HB ARG 21 11.410 -6.133 -13.966 147 HB3 ARG 21 1HB ARG 21 9.761 -6.619 -14.341 148 HG2 ARG 21 2HG ARG 21 8.962 -4.337 -13.873 149 HG3 ARG 21 1HG ARG 21 10.607 -3.841 -13.454 150 HD2 ARG 21 2HD ARG 21 10.038 -3.147 -15.744 151 HD3 ARG 21 1HD ARG 21 11.347 -4.332 -15.754 152 HE ARG 21 HE ARG 21 9.816 -5.989 -16.538 153 HH11 ARG 21 1HH1 ARG 21 8.475 -2.742 -16.553 154 HH12 ARG 21 2HH1 ARG 21 7.215 -3.140 -17.677 155 HH21 ARG 21 1HH2 ARG 21 8.150 -6.502 -17.987 156 HH22 ARG 21 2HH2 ARG 21 7.034 -5.272 -18.490 157 H PHE 22 H PHE 22 9.487 -4.469 -10.612 158 HA PHE 22 HA PHE 22 11.913 -3.223 -9.981 159 HB2 PHE 22 2HB PHE 22 9.576 -2.409 -9.478 160 HB3 PHE 22 1HB PHE 22 9.487 -3.556 -8.163 161 HD1 PHE 22 HD2 PHE 22 10.822 -3.161 -6.098 162 HD2 PHE 22 HD1 PHE 22 10.731 -0.292 -9.255 163 HE1 PHE 22 HE2 PHE 22 11.575 -1.429 -4.533 164 HE2 PHE 22 HE1 PHE 22 11.498 1.446 -7.692 165 HZ PHE 22 HZ PHE 22 11.922 0.881 -5.330 166 H PHE 23 H PHE 23 10.287 -5.981 -8.431 167 HA PHE 23 HA PHE 23 12.306 -6.345 -6.391 168 HB2 PHE 23 2HB PHE 23 9.905 -7.994 -7.276 169 HB3 PHE 23 1HB PHE 23 11.009 -8.554 -6.025 170 HD1 PHE 23 HD2 PHE 23 9.852 -5.003 -6.469 171 HD2 PHE 23 HD1 PHE 23 9.518 -8.604 -4.172 172 HE1 PHE 23 HE2 PHE 23 8.595 -3.789 -4.741 173 HE2 PHE 23 HE1 PHE 23 8.262 -7.374 -2.457 174 HZ PHE 23 HZ PHE 23 7.818 -4.977 -2.738 175 H SER 24 H SER 24 12.027 -7.305 -9.684 176 HA SER 24 HA SER 24 13.508 -9.807 -9.390 177 HB2 SER 24 2HB SER 24 11.453 -9.626 -10.846 178 HB3 SER 24 1HB SER 24 12.362 -8.571 -11.928 179 HG SER 24 HG SER 24 12.547 -11.315 -11.518 180 H GLU 25 H GLU 25 13.958 -6.589 -10.888 181 HA GLU 25 HA GLU 25 16.742 -7.313 -11.629 182 HB2 GLU 25 2HB GLU 25 16.490 -5.892 -13.674 183 HB3 GLU 25 1HB GLU 25 15.431 -7.298 -13.672 184 HG2 GLU 25 2HG GLU 25 13.497 -5.955 -13.171 185 HG3 GLU 25 1HG GLU 25 14.482 -4.538 -12.843 186 H HIS 26 H HIS 26 14.546 -4.609 -10.817 187 HA HIS 26 HA HIS 26 16.556 -2.567 -10.968 188 HB2 HIS 26 2HB HIS 26 14.225 -1.975 -11.378 189 HB3 HIS 26 1HB HIS 26 13.732 -2.572 -9.787 190 HD2 HIS 26 HD2 HIS 26 15.540 0.552 -11.360 191 HE1 HIS 26 HE1 HIS 26 14.634 1.334 -7.299 192 HE2 HIS 26 HE2 HIS 26 15.309 2.359 -9.514 193 H ARG 27 H ARG 27 14.854 -4.120 -8.398 194 HA ARG 27 HA ARG 27 16.786 -3.244 -6.348 195 HB2 ARG 27 2HB ARG 27 13.815 -3.065 -6.425 196 HB3 ARG 27 1HB ARG 27 14.386 -3.898 -4.990 197 HG2 ARG 27 2HG ARG 27 15.154 -1.093 -5.847 198 HG3 ARG 27 1HG ARG 27 14.060 -1.540 -4.532 199 HD2 ARG 27 2HD ARG 27 17.051 -1.965 -4.691 200 HD3 ARG 27 1HD ARG 27 16.136 -1.038 -3.498 201 HE ARG 27 HE ARG 27 15.308 -3.737 -3.407 202 HH11 ARG 27 1HH1 ARG 27 18.023 -1.725 -2.466 203 HH12 ARG 27 2HH1 ARG 27 18.528 -2.801 -1.195 204 HH21 ARG 27 1HH2 ARG 27 16.036 -5.181 -1.825 205 HH22 ARG 27 2HH2 ARG 27 17.398 -4.756 -0.838 206 H GLN 28 H GLN 28 17.302 -4.782 -4.796 207 HA GLN 28 HA GLN 28 17.124 -7.550 -5.518 208 HB2 GLN 28 2HB GLN 28 18.075 -6.229 -2.939 209 HB3 GLN 28 1HB GLN 28 18.320 -7.922 -3.361 210 HG2 GLN 28 2HG GLN 28 19.463 -5.531 -4.836 211 HG3 GLN 28 1HG GLN 28 20.351 -6.613 -3.763 212 HE21 GLN 28 1HE2 GLN 28 18.916 -6.261 -6.920 213 HE22 GLN 28 2HE2 GLN 28 19.612 -7.678 -7.620 214 H SER 29 H SER 29 15.500 -8.844 -5.110 215 HA SER 29 HA SER 29 13.047 -8.216 -4.079 216 HB2 SER 29 2HB SER 29 12.612 -10.693 -4.063 217 HB3 SER 29 1HB SER 29 13.400 -10.138 -5.540 218 HG SER 29 HG SER 29 15.193 -10.848 -3.604 219 HA PRO 30 HA PRO 30 13.477 -8.594 0.507 220 HB2 PRO 30 2HB PRO 30 10.478 -8.504 0.260 221 HB3 PRO 30 1HB PRO 30 11.560 -7.522 1.271 222 HG2 PRO 30 2HG PRO 30 10.391 -6.477 -0.886 223 HG3 PRO 30 1HG PRO 30 12.057 -6.034 -0.439 224 HD2 PRO 30 2HD PRO 30 11.116 -7.927 -2.578 225 HD3 PRO 30 1HD PRO 30 12.442 -6.744 -2.621 226 H ILE 31 H ILE 31 11.486 -10.479 -1.733 227 HA ILE 31 HA ILE 31 10.808 -12.609 0.011 228 HB ILE 31 HB ILE 31 11.260 -12.863 -3.000 229 HG12 ILE 31 2HG1 ILE 31 9.754 -10.969 -2.689 230 HG13 ILE 31 1HG1 ILE 31 8.805 -12.333 -3.258 231 HG21 ILE 31 1HG2 ILE 31 9.574 -14.681 -2.864 232 HG22 ILE 31 2HG2 ILE 31 9.472 -14.457 -1.117 233 HG23 ILE 31 3HG2 ILE 31 10.977 -15.019 -1.847 234 HD11 ILE 31 3HD1 ILE 31 7.585 -11.129 -1.580 235 HD12 ILE 31 1HD1 ILE 31 8.926 -11.255 -0.442 236 HD13 ILE 31 2HD1 ILE 31 8.034 -12.703 -0.920 237 HA PRO 32 HA PRO 32 15.122 -13.460 0.752 238 HB2 PRO 32 2HB PRO 32 14.880 -15.770 2.297 239 HB3 PRO 32 1HB PRO 32 14.636 -14.123 2.907 240 HG2 PRO 32 2HG PRO 32 12.606 -16.135 2.058 241 HG3 PRO 32 1HG PRO 32 12.561 -14.994 3.417 242 HD2 PRO 32 2HD PRO 32 11.188 -14.540 1.124 243 HD3 PRO 32 1HD PRO 32 11.886 -13.219 2.087 244 HA PRO 33 HA PRO 33 16.654 -15.997 -2.486 245 HB2 PRO 33 2HB PRO 33 18.944 -17.128 -1.253 246 HB3 PRO 33 1HB PRO 33 18.863 -15.555 -2.064 247 HG2 PRO 33 2HG PRO 33 18.691 -16.171 0.855 248 HG3 PRO 33 1HG PRO 33 19.465 -14.798 0.033 249 HD2 PRO 33 2HD PRO 33 17.109 -14.510 1.278 250 HD3 PRO 33 1HD PRO 33 17.451 -13.651 -0.242 251 H GLU 34 H GLU 34 16.429 -17.611 0.646 252 HA GLU 34 HA GLU 34 16.343 -20.289 -0.254 253 HB2 GLU 34 2HB GLU 34 15.386 -20.783 2.002 254 HB3 GLU 34 1HB GLU 34 16.812 -19.754 2.076 255 HG2 GLU 34 2HG GLU 34 15.242 -17.759 2.264 256 HG3 GLU 34 1HG GLU 34 13.921 -18.909 2.451 257 H GLU 35 H GLU 35 13.713 -17.909 0.266 258 HA GLU 35 HA GLU 35 11.635 -19.829 -0.304 259 HB2 GLU 35 2HB GLU 35 11.539 -16.830 0.170 260 HB3 GLU 35 1HB GLU 35 10.109 -17.813 -0.122 261 HG2 GLU 35 2HG GLU 35 12.036 -18.276 2.170 262 HG3 GLU 35 1HG GLU 35 10.569 -17.313 2.297 263 H ARG 36 H ARG 36 13.200 -17.154 -2.181 264 HA ARG 36 HA ARG 36 11.113 -16.933 -4.119 265 HB2 ARG 36 2HB ARG 36 12.646 -15.417 -5.296 266 HB3 ARG 36 1HB ARG 36 12.636 -15.063 -3.570 267 HG2 ARG 36 2HG ARG 36 14.756 -16.416 -3.361 268 HG3 ARG 36 1HG ARG 36 14.792 -16.529 -5.120 269 HD2 ARG 36 2HD ARG 36 14.815 -13.918 -3.568 270 HD3 ARG 36 1HD ARG 36 16.259 -14.733 -4.168 271 HE ARG 36 HE ARG 36 14.191 -13.976 -6.119 272 HH11 ARG 36 1HH1 ARG 36 17.360 -13.317 -4.731 273 HH12 ARG 36 2HH1 ARG 36 17.848 -12.281 -6.031 274 HH21 ARG 36 1HH2 ARG 36 14.816 -12.521 -7.767 275 HH22 ARG 36 2HH2 ARG 36 16.404 -11.823 -7.754 276 H ASP 37 H ASP 37 13.572 -19.220 -3.741 277 HA ASP 37 HA ASP 37 14.005 -20.139 -6.371 278 HB2 ASP 37 2HB ASP 37 15.387 -20.834 -4.475 279 HB3 ASP 37 1HB ASP 37 14.005 -21.561 -3.668 280 H ASP 38 H ASP 38 11.661 -21.137 -3.876 281 HA ASP 38 HA ASP 38 10.122 -22.830 -5.690 282 HB2 ASP 38 2HB ASP 38 10.609 -23.562 -3.375 283 HB3 ASP 38 1HB ASP 38 9.781 -22.153 -2.729 284 H PHE 39 H PHE 39 9.892 -19.737 -4.128 285 HA PHE 39 HA PHE 39 7.076 -19.313 -4.798 286 HB2 PHE 39 2HB PHE 39 8.997 -17.812 -2.954 287 HB3 PHE 39 1HB PHE 39 7.378 -17.229 -3.331 288 HD1 PHE 39 HD1 PHE 39 9.234 -20.060 -1.729 289 HD2 PHE 39 HD2 PHE 39 5.458 -18.096 -2.177 290 HE1 PHE 39 HE1 PHE 39 8.304 -21.422 0.095 291 HE2 PHE 39 HE2 PHE 39 4.542 -19.463 -0.350 292 HZ PHE 39 HZ PHE 39 5.960 -21.124 0.785 293 H ASP 40 H ASP 40 6.482 -17.195 -5.627 294 HA ASP 40 HA ASP 40 8.229 -16.350 -7.852 295 HB2 ASP 40 2HB ASP 40 5.194 -16.358 -7.543 296 HB3 ASP 40 1HB ASP 40 6.007 -15.441 -8.811 297 H GLY 41 H GLY 41 7.847 -14.033 -8.487 298 HA2 GLY 41 2HA GLY 41 8.447 -12.018 -6.750 299 HA3 GLY 41 1HA GLY 41 7.539 -11.785 -8.231 300 H LEU 42 H LEU 42 6.146 -10.166 -7.514 301 HA LEU 42 HA LEU 42 5.080 -9.975 -4.888 302 HB2 LEU 42 2HB LEU 42 4.527 -8.543 -7.498 303 HB3 LEU 42 1HB LEU 42 3.444 -8.285 -6.136 304 HG LEU 42 HG LEU 42 6.441 -7.736 -6.094 305 HD11 LEU 42 1HD1 LEU 42 5.289 -6.145 -7.552 306 HD12 LEU 42 2HD1 LEU 42 5.845 -5.359 -6.078 307 HD13 LEU 42 3HD1 LEU 42 4.137 -5.768 -6.266 308 HD21 LEU 42 3HD2 LEU 42 5.602 -8.363 -3.890 309 HD22 LEU 42 1HD2 LEU 42 4.292 -7.185 -4.017 310 HD23 LEU 42 2HD2 LEU 42 5.969 -6.642 -3.924 311 H SER 43 H SER 43 4.025 -11.820 -4.310 312 HA SER 43 HA SER 43 1.684 -12.758 -5.795 313 HB2 SER 43 2HB SER 43 2.945 -13.776 -3.207 314 HB3 SER 43 1HB SER 43 1.671 -14.584 -4.126 315 HG SER 43 HG SER 43 4.396 -14.246 -4.756 316 H TYR 44 H TYR 44 -0.320 -12.083 -5.313 317 HA TYR 44 HA TYR 44 -1.053 -10.969 -2.741 318 HB2 TYR 44 2HB TYR 44 -1.659 -8.711 -3.639 319 HB3 TYR 44 1HB TYR 44 0.066 -9.021 -3.635 320 HD1 TYR 44 HD1 TYR 44 -2.904 -8.556 -5.809 321 HD2 TYR 44 HD2 TYR 44 1.335 -9.056 -5.744 322 HE1 TYR 44 HE1 TYR 44 -2.791 -7.826 -8.148 323 HE2 TYR 44 HE2 TYR 44 1.446 -8.332 -8.090 324 HH TYR 44 HH TYR 44 0.012 -8.177 -10.050 325 H PHE 45 H PHE 45 -3.285 -9.584 -3.405 326 HA PHE 45 HA PHE 45 -5.117 -11.775 -4.039 327 HB2 PHE 45 2HB PHE 45 -5.750 -8.954 -3.083 328 HB3 PHE 45 1HB PHE 45 -6.875 -10.297 -3.151 329 HD1 PHE 45 HD1 PHE 45 -6.454 -12.314 -1.605 330 HD2 PHE 45 HD2 PHE 45 -4.407 -8.576 -1.142 331 HE1 PHE 45 HE1 PHE 45 -5.870 -12.911 0.708 332 HE2 PHE 45 HE2 PHE 45 -3.828 -9.187 1.171 333 HZ PHE 45 HZ PHE 45 -4.557 -11.354 2.097 334 H ASP 46 H ASP 46 -6.512 -11.739 -5.869 335 HA ASP 46 HA ASP 46 -5.308 -10.372 -8.126 336 HB2 ASP 46 2HB ASP 46 -6.087 -12.741 -8.288 337 HB3 ASP 46 1HB ASP 46 -7.747 -12.198 -8.083 338 HA PRO 47 HA PRO 47 -7.520 -6.505 -7.545 339 HB2 PRO 47 2HB PRO 47 -7.354 -6.465 -10.574 340 HB3 PRO 47 1HB PRO 47 -6.973 -5.174 -9.412 341 HG2 PRO 47 2HG PRO 47 -5.016 -6.595 -10.533 342 HG3 PRO 47 1HG PRO 47 -4.922 -6.098 -8.828 343 HD2 PRO 47 2HD PRO 47 -5.435 -8.807 -9.966 344 HD3 PRO 47 1HD PRO 47 -4.700 -8.353 -8.414 345 H ASP 48 H ASP 48 -9.596 -6.563 -6.959 346 HA ASP 48 HA ASP 48 -11.715 -7.483 -8.833 347 HB2 ASP 48 2HB ASP 48 -11.770 -7.165 -5.799 348 HB3 ASP 48 1HB ASP 48 -13.222 -7.429 -6.759 349 HA PRO 49 HA PRO 49 -12.625 -3.001 -9.136 350 HB2 PRO 49 2HB PRO 49 -14.746 -3.194 -10.855 351 HB3 PRO 49 1HB PRO 49 -13.071 -3.436 -11.397 352 HG2 PRO 49 2HG PRO 49 -15.100 -5.527 -10.624 353 HG3 PRO 49 1HG PRO 49 -14.088 -5.443 -12.085 354 HD2 PRO 49 2HD PRO 49 -13.366 -6.986 -10.007 355 HD3 PRO 49 1HD PRO 49 -12.141 -6.088 -10.939 356 H ASP 50 H ASP 50 -14.715 -5.540 -7.998 357 HA ASP 50 HA ASP 50 -16.745 -3.764 -6.888 358 HB2 ASP 50 2HB ASP 50 -17.819 -5.881 -6.130 359 HB3 ASP 50 1HB ASP 50 -17.459 -5.894 -7.851 360 H TYR 51 H TYR 51 -13.767 -5.193 -5.854 361 HA TYR 51 HA TYR 51 -14.368 -4.797 -3.004 362 HB2 TYR 51 2HB TYR 51 -12.752 -6.662 -4.236 363 HB3 TYR 51 1HB TYR 51 -11.551 -5.452 -3.817 364 HD1 TYR 51 HD2 TYR 51 -11.272 -4.805 -1.331 365 HD2 TYR 51 HD1 TYR 51 -13.687 -8.110 -2.565 366 HE1 TYR 51 HE2 TYR 51 -11.228 -5.707 0.962 367 HE2 TYR 51 HE1 TYR 51 -13.645 -9.002 -0.283 368 HH TYR 51 HH TYR 51 -12.727 -7.245 2.378 369 H ARG 52 H ARG 52 -13.346 -3.038 -5.640 370 HA ARG 52 HA ARG 52 -11.573 -1.121 -4.659 371 HB2 ARG 52 2HB ARG 52 -12.228 -1.481 -7.061 372 HB3 ARG 52 1HB ARG 52 -13.804 -0.777 -6.717 373 HG2 ARG 52 2HG ARG 52 -12.757 1.387 -6.226 374 HG3 ARG 52 1HG ARG 52 -11.156 0.675 -6.444 375 HD2 ARG 52 2HD ARG 52 -11.560 1.781 -8.481 376 HD3 ARG 52 1HD ARG 52 -11.927 0.097 -8.844 377 HE ARG 52 HE ARG 52 -14.020 2.113 -8.236 378 HH11 ARG 52 1HH1 ARG 52 -12.875 -0.550 -10.226 379 HH12 ARG 52 2HH1 ARG 52 -14.303 -0.588 -11.208 380 HH21 ARG 52 1HH2 ARG 52 -15.852 2.102 -9.560 381 HH22 ARG 52 2HH2 ARG 52 -16.002 0.929 -10.829 382 H VAL 53 H VAL 53 -11.847 0.470 -3.180 383 HA VAL 53 HA VAL 53 -14.488 1.739 -2.819 384 HB VAL 53 HB VAL 53 -14.147 2.029 -0.409 385 HG11 VAL 53 1HG1 VAL 53 -13.884 -0.914 -1.134 386 HG12 VAL 53 2HG1 VAL 53 -15.381 0.018 -1.063 387 HG13 VAL 53 3HG1 VAL 53 -14.462 -0.279 0.413 388 HG21 VAL 53 3HG2 VAL 53 -12.318 0.936 0.849 389 HG22 VAL 53 1HG2 VAL 53 -11.692 2.105 -0.317 390 HG23 VAL 53 2HG2 VAL 53 -11.602 0.379 -0.667 391 H GLU 54 H GLU 54 -14.332 3.978 -2.584 392 HA GLU 54 HA GLU 54 -11.623 5.151 -2.946 393 HB2 GLU 54 2HB GLU 54 -12.814 7.163 -3.859 394 HB3 GLU 54 1HB GLU 54 -12.997 5.707 -4.828 395 HG2 GLU 54 2HG GLU 54 -15.267 5.375 -3.810 396 HG3 GLU 54 1HG GLU 54 -15.069 6.916 -2.976 397 H ALA 55 H ALA 55 -11.019 6.942 -1.665 398 HA ALA 55 HA ALA 55 -12.514 7.257 0.872 399 HB1 ALA 55 3HB ALA 55 -10.405 7.042 2.102 400 HB2 ALA 55 1HB ALA 55 -9.530 6.759 0.591 401 HB3 ALA 55 2HB ALA 55 -10.724 5.589 1.155 402 H THR 56 H THR 56 -12.340 9.262 1.857 403 HA THR 56 HA THR 56 -11.701 11.497 0.145 404 HB THR 56 HB THR 56 -12.724 11.464 3.028 405 HG1 THR 56 HG1 THR 56 -13.996 10.444 1.143 406 HG21 THR 56 3HG2 THR 56 -13.557 13.744 2.527 407 HG22 THR 56 1HG2 THR 56 -12.817 13.669 0.924 408 HG23 THR 56 2HG2 THR 56 -11.802 13.670 2.368 409 H VAL 57 H VAL 57 -9.771 12.424 0.111 410 HA VAL 57 HA VAL 57 -7.607 11.748 1.854 411 HB VAL 57 HB VAL 57 -7.747 13.928 -0.295 412 HG11 VAL 57 1HG1 VAL 57 -5.334 12.526 0.919 413 HG12 VAL 57 2HG1 VAL 57 -5.828 14.190 1.236 414 HG13 VAL 57 3HG1 VAL 57 -5.292 13.726 -0.376 415 HG21 VAL 57 3HG2 VAL 57 -6.790 12.268 -1.853 416 HG22 VAL 57 1HG2 VAL 57 -8.358 11.731 -1.244 417 HG23 VAL 57 2HG2 VAL 57 -6.873 11.026 -0.602 418 H THR 58 H THR 58 -7.029 12.768 3.657 419 HA THR 58 HA THR 58 -8.007 15.500 4.270 420 HB THR 58 HB THR 58 -7.569 13.239 6.289 421 HG1 THR 58 HG1 THR 58 -9.363 12.728 5.033 422 HG21 THR 58 3HG2 THR 58 -8.813 14.716 7.846 423 HG22 THR 58 1HG2 THR 58 -8.901 15.964 6.599 424 HG23 THR 58 2HG2 THR 58 -7.338 15.497 7.273 425 H VAL 59 H VAL 59 -6.181 16.721 3.955 426 HA VAL 59 HA VAL 59 -3.544 15.474 4.167 427 HB VAL 59 HB VAL 59 -4.369 18.207 3.069 428 HG11 VAL 59 1HG1 VAL 59 -2.061 18.341 3.942 429 HG12 VAL 59 2HG1 VAL 59 -2.061 18.398 2.181 430 HG13 VAL 59 3HG1 VAL 59 -1.609 16.908 3.013 431 HG21 VAL 59 3HG2 VAL 59 -3.828 17.203 0.870 432 HG22 VAL 59 1HG2 VAL 59 -5.131 16.334 1.684 433 HG23 VAL 59 2HG2 VAL 59 -3.499 15.657 1.657 434 H HIS 60 H HIS 60 -2.068 15.952 5.675 435 HA HIS 60 HA HIS 60 -2.858 17.565 7.980 436 HB2 HIS 60 2HB HIS 60 -0.629 15.546 7.490 437 HB3 HIS 60 1HB HIS 60 -0.691 16.539 8.949 438 HD1 HIS 60 HD1 HIS 60 -3.474 14.631 7.146 439 HD2 HIS 60 HD2 HIS 60 -1.723 14.927 10.905 440 HE1 HIS 60 HE1 HIS 60 -4.887 13.222 8.660 441 HE2 HIS 60 HE2 HIS 60 -3.761 13.347 10.902 442 H GLU 61 H GLU 61 -2.539 19.625 7.683 443 HA GLU 61 HA GLU 61 -0.793 21.107 6.170 444 HB2 GLU 61 2HB GLU 61 -1.185 22.954 7.845 445 HB3 GLU 61 1HB GLU 61 -2.664 22.144 7.337 446 HG2 GLU 61 2HG GLU 61 -2.756 20.873 9.409 447 HG3 GLU 61 1HG GLU 61 -1.185 21.489 9.906 448 H THR 62 H THR 62 -0.164 19.589 9.267 449 HA THR 62 HA THR 62 2.689 20.371 9.152 450 HB THR 62 HB THR 62 2.660 20.156 11.677 451 HG1 THR 62 HG1 THR 62 0.759 18.921 11.912 452 HG21 THR 62 3HG2 THR 62 1.549 22.321 12.137 453 HG22 THR 62 1HG2 THR 62 0.752 22.259 10.562 454 HG23 THR 62 2HG2 THR 62 2.509 22.408 10.661 455 HA PRO 63 HA PRO 63 2.352 15.804 8.471 456 HB2 PRO 63 2HB PRO 63 4.746 15.499 7.145 457 HB3 PRO 63 1HB PRO 63 3.281 16.108 6.349 458 HG2 PRO 63 2HG PRO 63 5.603 17.660 7.459 459 HG3 PRO 63 1HG PRO 63 4.756 17.862 5.906 460 HD2 PRO 63 2HD PRO 63 4.223 19.460 8.033 461 HD3 PRO 63 1HD PRO 63 2.958 18.991 6.875 462 H GLU 64 H GLU 64 2.790 14.428 10.086 463 HA GLU 64 HA GLU 64 4.985 14.957 11.958 464 HB2 GLU 64 2HB GLU 64 3.757 13.319 13.429 465 HB3 GLU 64 1HB GLU 64 2.795 14.717 12.966 466 HG2 GLU 64 2HG GLU 64 1.781 13.262 11.127 467 HG3 GLU 64 1HG GLU 64 2.574 11.893 11.895 468 H SER 65 H SER 65 6.506 13.370 12.543 469 HA SER 65 HA SER 65 7.398 11.727 10.351 470 HB2 SER 65 2HB SER 65 9.372 11.353 11.868 471 HB3 SER 65 1HB SER 65 9.005 13.053 11.595 472 HG SER 65 HG SER 65 8.435 11.488 13.886 473 H VAL 66 H VAL 66 6.914 9.629 10.078 474 HA VAL 66 HA VAL 66 6.225 7.857 12.339 475 HB VAL 66 HB VAL 66 4.912 7.697 9.571 476 HG11 VAL 66 1HG1 VAL 66 4.907 5.594 10.836 477 HG12 VAL 66 2HG1 VAL 66 3.270 6.231 10.686 478 HG13 VAL 66 3HG1 VAL 66 4.141 6.396 12.212 479 HG21 VAL 66 3HG2 VAL 66 4.222 9.835 10.524 480 HG22 VAL 66 1HG2 VAL 66 3.745 9.050 12.035 481 HG23 VAL 66 2HG2 VAL 66 2.864 8.709 10.542 482 H ASP 67 H ASP 67 7.615 6.114 12.355 483 HA ASP 67 HA ASP 67 9.569 5.860 10.210 484 HB2 ASP 67 2HB ASP 67 9.353 4.418 12.892 485 HB3 ASP 67 1HB ASP 67 10.668 4.183 11.739 486 H LEU 68 H LEU 68 9.055 4.689 8.506 487 HA LEU 68 HA LEU 68 7.718 2.052 8.788 488 HB2 LEU 68 2HB LEU 68 7.333 3.901 6.401 489 HB3 LEU 68 1HB LEU 68 6.454 2.426 6.766 490 HG LEU 68 HG LEU 68 6.228 5.009 8.367 491 HD11 LEU 68 1HD1 LEU 68 4.308 3.883 6.321 492 HD12 LEU 68 2HD1 LEU 68 5.377 5.267 6.081 493 HD13 LEU 68 3HD1 LEU 68 4.092 5.349 7.282 494 HD21 LEU 68 3HD2 LEU 68 4.529 2.496 8.497 495 HD22 LEU 68 1HD2 LEU 68 4.235 3.996 9.383 496 HD23 LEU 68 2HD2 LEU 68 5.676 3.041 9.724 497 H GLU 69 H GLU 69 8.333 0.573 6.990 498 HA GLU 69 HA GLU 69 11.138 0.815 6.267 499 HB2 GLU 69 2HB GLU 69 10.866 -1.451 5.352 500 HB3 GLU 69 1HB GLU 69 10.175 -1.354 6.970 501 HG2 GLU 69 2HG GLU 69 7.907 -1.059 5.908 502 HG3 GLU 69 1HG GLU 69 8.656 -1.374 4.343 503 H THR 70 H THR 70 11.967 1.031 4.188 504 HA THR 70 HA THR 70 10.149 1.936 2.042 505 HB THR 70 HB THR 70 12.037 3.453 2.639 506 HG1 THR 70 HG1 THR 70 11.554 3.776 0.572 507 HG21 THR 70 3HG2 THR 70 13.717 1.779 3.342 508 HG22 THR 70 1HG2 THR 70 14.369 2.855 2.105 509 HG23 THR 70 2HG2 THR 70 13.866 1.220 1.675 510 H SER 71 H SER 71 11.253 1.282 -0.236 511 HA SER 71 HA SER 71 11.075 -1.626 -0.384 512 HB2 SER 71 2HB SER 71 11.159 0.498 -2.576 513 HB3 SER 71 1HB SER 71 10.828 -1.219 -2.820 514 HG SER 71 HG SER 71 9.240 0.725 -1.522 515 H ASP 72 H ASP 72 13.600 -0.392 0.689 516 HA ASP 72 HA ASP 72 15.580 -1.237 -1.316 517 HB2 ASP 72 2HB ASP 72 15.115 1.232 -1.660 518 HB3 ASP 72 1HB ASP 72 15.650 1.528 -0.011 519 H ASP 73 H ASP 73 14.998 -2.743 0.775 520 HA ASP 73 HA ASP 73 15.774 -3.925 2.543 521 HB2 ASP 73 2HB ASP 73 18.336 -2.312 2.200 522 HB3 ASP 73 1HB ASP 73 18.179 -3.664 3.318 523 H ARG 74 H ARG 74 15.483 -0.531 2.897 524 HA ARG 74 HA ARG 74 16.755 -0.450 5.538 525 HB2 ARG 74 2HB ARG 74 17.454 1.008 3.492 526 HB3 ARG 74 1HB ARG 74 15.973 1.910 3.764 527 HG2 ARG 74 2HG ARG 74 16.758 2.674 5.927 528 HG3 ARG 74 1HG ARG 74 18.164 1.608 5.854 529 HD2 ARG 74 2HD ARG 74 17.621 3.958 3.995 530 HD3 ARG 74 1HD ARG 74 18.757 3.959 5.345 531 HE ARG 74 HE ARG 74 20.181 2.481 4.145 532 HH11 ARG 74 1HH1 ARG 74 17.436 3.482 2.201 533 HH12 ARG 74 2HH1 ARG 74 18.173 3.020 0.706 534 HH21 ARG 74 1HH2 ARG 74 21.116 1.824 2.174 535 HH22 ARG 74 2HH2 ARG 74 20.256 2.082 0.690 536 H THR 75 H THR 75 15.718 1.503 6.785 537 HA THR 75 HA THR 75 12.801 1.482 6.816 538 HB THR 75 HB THR 75 14.511 1.009 9.316 539 HG1 THR 75 HG1 THR 75 13.104 -0.692 7.590 540 HG21 THR 75 3HG2 THR 75 12.509 2.385 9.784 541 HG22 THR 75 1HG2 THR 75 12.327 0.767 10.466 542 HG23 THR 75 2HG2 THR 75 11.488 1.191 8.973 543 H VAL 76 H VAL 76 12.116 3.547 7.294 544 HA VAL 76 HA VAL 76 14.072 5.664 7.750 545 HB VAL 76 HB VAL 76 13.404 6.888 5.597 546 HG11 VAL 76 1HG1 VAL 76 15.068 5.757 4.186 547 HG12 VAL 76 2HG1 VAL 76 15.013 4.336 5.233 548 HG13 VAL 76 3HG1 VAL 76 15.631 5.868 5.855 549 HG21 VAL 76 3HG2 VAL 76 11.437 5.564 4.985 550 HG22 VAL 76 1HG2 VAL 76 12.445 4.139 4.727 551 HG23 VAL 76 2HG2 VAL 76 12.618 5.551 3.676 552 H ARG 77 H ARG 77 13.155 7.733 7.861 553 HA ARG 77 HA ARG 77 10.652 7.909 9.213 554 HB2 ARG 77 2HB ARG 77 12.661 9.300 9.715 555 HB3 ARG 77 1HB ARG 77 12.584 10.019 8.122 556 HG2 ARG 77 2HG ARG 77 10.386 10.382 10.183 557 HG3 ARG 77 1HG ARG 77 11.790 11.441 10.087 558 HD2 ARG 77 2HD ARG 77 9.545 11.107 8.096 559 HD3 ARG 77 1HD ARG 77 10.107 12.579 8.883 560 HE ARG 77 HE ARG 77 11.375 11.190 6.607 561 HH11 ARG 77 1HH1 ARG 77 11.248 14.055 8.660 562 HH12 ARG 77 2HH1 ARG 77 12.304 14.971 7.635 563 HH21 ARG 77 1HH2 ARG 77 12.787 12.380 5.330 564 HH22 ARG 77 2HH2 ARG 77 13.173 14.023 5.749 565 H TYR 78 H TYR 78 8.706 8.147 8.266 566 HA TYR 78 HA TYR 78 8.433 9.309 5.554 567 HB2 TYR 78 2HB TYR 78 6.685 7.338 7.086 568 HB3 TYR 78 1HB TYR 78 6.031 8.295 5.766 569 HD1 TYR 78 HD2 TYR 78 9.111 6.164 6.337 570 HD2 TYR 78 HD1 TYR 78 5.866 7.170 3.749 571 HE1 TYR 78 HE2 TYR 78 9.850 4.457 4.740 572 HE2 TYR 78 HE1 TYR 78 6.597 5.461 2.153 573 HH TYR 78 HH TYR 78 8.788 3.053 2.911 574 H LEU 79 H LEU 79 7.075 11.051 5.305 575 HA LEU 79 HA LEU 79 6.131 12.413 7.730 576 HB2 LEU 79 2HB LEU 79 6.502 13.410 4.877 577 HB3 LEU 79 1HB LEU 79 5.778 14.373 6.158 578 HG LEU 79 HG LEU 79 8.645 13.339 6.104 579 HD11 LEU 79 1HD1 LEU 79 8.260 15.253 4.606 580 HD12 LEU 79 2HD1 LEU 79 9.305 15.679 5.955 581 HD13 LEU 79 3HD1 LEU 79 7.613 16.190 5.956 582 HD21 LEU 79 3HD2 LEU 79 7.237 14.949 8.263 583 HD22 LEU 79 1HD2 LEU 79 8.968 14.601 8.203 584 HD23 LEU 79 2HD2 LEU 79 7.816 13.285 8.397 585 H HIS 80 H HIS 80 4.080 12.347 8.275 586 HA HIS 80 HA HIS 80 2.139 10.912 6.722 587 HB2 HIS 80 2HB HIS 80 2.233 10.721 9.188 588 HB3 HIS 80 1HB HIS 80 1.882 12.438 9.351 589 HD2 HIS 80 HD2 HIS 80 -0.218 10.113 6.976 590 HE1 HIS 80 HE1 HIS 80 -2.583 11.295 10.264 591 HE2 HIS 80 HE2 HIS 80 -2.505 9.915 8.150 592 H VAL 81 H VAL 81 1.548 11.960 4.942 593 HA VAL 81 HA VAL 81 1.036 14.851 4.953 594 HB VAL 81 HB VAL 81 1.066 14.680 2.479 595 HG11 VAL 81 1HG1 VAL 81 3.158 15.122 3.691 596 HG12 VAL 81 2HG1 VAL 81 3.474 14.162 2.247 597 HG13 VAL 81 3HG1 VAL 81 3.470 13.388 3.835 598 HG21 VAL 81 3HG2 VAL 81 1.703 12.559 1.363 599 HG22 VAL 81 1HG2 VAL 81 0.164 12.394 2.210 600 HG23 VAL 81 2HG2 VAL 81 1.632 11.713 2.912 601 H ALA 82 H ALA 82 -0.777 11.839 4.681 602 HA ALA 82 HA ALA 82 -3.276 13.385 4.539 603 HB1 ALA 82 3HB ALA 82 -2.675 13.041 2.167 604 HB2 ALA 82 1HB ALA 82 -4.137 12.149 2.590 605 HB3 ALA 82 2HB ALA 82 -2.598 11.298 2.426 606 H THR 83 H THR 83 -5.149 12.204 5.057 607 HA THR 83 HA THR 83 -4.872 9.403 5.933 608 HB THR 83 HB THR 83 -6.445 11.605 7.374 609 HG1 THR 83 HG1 THR 83 -4.482 9.992 8.591 610 HG21 THR 83 3HG2 THR 83 -6.268 8.633 8.043 611 HG22 THR 83 1HG2 THR 83 -7.700 9.456 7.413 612 HG23 THR 83 2HG2 THR 83 -7.076 9.867 9.010 613 H LEU 84 H LEU 84 -6.394 8.143 5.031 614 HA LEU 84 HA LEU 84 -8.258 9.379 3.105 615 HB2 LEU 84 2HB LEU 84 -7.212 6.518 3.049 616 HB3 LEU 84 1HB LEU 84 -7.992 7.409 1.751 617 HG LEU 84 HG LEU 84 -5.186 7.875 2.834 618 HD11 LEU 84 1HD1 LEU 84 -5.326 5.905 1.433 619 HD12 LEU 84 2HD1 LEU 84 -4.433 7.175 0.602 620 HD13 LEU 84 3HD1 LEU 84 -6.103 6.830 0.147 621 HD21 LEU 84 3HD2 LEU 84 -4.897 9.575 1.066 622 HD22 LEU 84 1HD2 LEU 84 -6.129 10.044 2.237 623 HD23 LEU 84 2HD2 LEU 84 -6.608 9.437 0.653 624 H SER 85 H SER 85 -10.214 9.486 4.030 625 HA SER 85 HA SER 85 -11.069 7.561 6.073 626 HB2 SER 85 2HB SER 85 -12.281 10.237 5.239 627 HB3 SER 85 1HB SER 85 -12.741 9.275 6.651 628 HG SER 85 HG SER 85 -10.294 9.489 7.067 629 H PHE 86 H PHE 86 -12.600 6.049 5.667 630 HA PHE 86 HA PHE 86 -14.627 6.324 3.608 631 HB2 PHE 86 2HB PHE 86 -13.979 4.261 2.373 632 HB3 PHE 86 1HB PHE 86 -12.749 5.503 2.236 633 HD1 PHE 86 HD1 PHE 86 -10.623 5.284 3.661 634 HD2 PHE 86 HD2 PHE 86 -13.422 2.083 3.212 635 HE1 PHE 86 HE1 PHE 86 -8.902 3.676 4.358 636 HE2 PHE 86 HE2 PHE 86 -11.697 0.484 3.919 637 HZ PHE 86 HZ PHE 86 -9.436 1.276 4.488 638 H ASP 87 H ASP 87 -15.674 3.927 3.469 639 HA ASP 87 HA ASP 87 -15.881 2.763 6.199 640 HB2 ASP 87 2HB ASP 87 -18.234 2.188 5.731 641 HB3 ASP 87 1HB ASP 87 -17.992 3.922 5.581 642 H LEU 88 H LEU 88 -16.005 0.481 6.289 643 HA LEU 88 HA LEU 88 -15.961 -1.134 3.881 644 HB2 LEU 88 2HB LEU 88 -13.576 -0.455 4.069 645 HB3 LEU 88 1HB LEU 88 -13.522 -1.087 5.705 646 HG LEU 88 HG LEU 88 -14.013 -3.397 4.748 647 HD11 LEU 88 1HD1 LEU 88 -13.497 -2.050 2.076 648 HD12 LEU 88 2HD1 LEU 88 -15.031 -2.732 2.626 649 HD13 LEU 88 3HD1 LEU 88 -13.650 -3.791 2.347 650 HD21 LEU 88 3HD2 LEU 88 -11.745 -2.750 5.397 651 HD22 LEU 88 1HD2 LEU 88 -11.461 -2.063 3.796 652 HD23 LEU 88 2HD2 LEU 88 -11.716 -3.801 3.984 653 H ASP 89 H ASP 89 -16.688 -3.154 4.240 654 HA ASP 89 HA ASP 89 -17.359 -5.084 5.149 655 HB2 ASP 89 2HB ASP 89 -15.145 -5.218 6.205 656 HB3 ASP 89 1HB ASP 89 -15.700 -4.226 7.550 657 H GLY 90 H GLY 90 -17.366 -3.147 8.141 658 HA2 GLY 90 2HA GLY 90 -20.237 -2.692 8.087 659 HA3 GLY 90 1HA GLY 90 -19.712 -3.871 9.288 660 H GLU 91 H GLU 91 -17.372 -1.483 8.656 661 HA GLU 91 HA GLU 91 -18.292 0.354 10.769 662 HB2 GLU 91 2HB GLU 91 -16.070 0.235 11.881 663 HB3 GLU 91 1HB GLU 91 -16.917 -1.307 11.942 664 HG2 GLU 91 2HG GLU 91 -15.501 -2.271 10.275 665 HG3 GLU 91 1HG GLU 91 -14.809 -0.709 9.839 666 H SER 92 H SER 92 -17.056 2.355 10.837 667 HA SER 92 HA SER 92 -16.142 3.381 8.310 668 HB2 SER 92 2HB SER 92 -17.227 4.875 9.939 669 HB3 SER 92 1HB SER 92 -15.967 4.552 11.130 670 HG SER 92 HG SER 92 -15.432 5.660 8.574 671 H ARG 93 H ARG 93 -14.058 3.383 7.530 672 HA ARG 93 HA ARG 93 -11.851 2.506 9.281 673 HB2 ARG 93 2HB ARG 93 -12.551 1.546 6.484 674 HB3 ARG 93 1HB ARG 93 -10.963 1.289 7.189 675 HG2 ARG 93 2HG ARG 93 -13.547 0.246 8.384 676 HG3 ARG 93 1HG ARG 93 -12.495 -0.684 7.317 677 HD2 ARG 93 2HD ARG 93 -11.955 -1.358 9.533 678 HD3 ARG 93 1HD ARG 93 -10.633 -0.316 9.015 679 HE ARG 93 HE ARG 93 -12.830 0.538 10.810 680 HH11 ARG 93 1HH1 ARG 93 -9.421 0.688 9.931 681 HH12 ARG 93 2HH1 ARG 93 -9.014 1.740 11.243 682 HH21 ARG 93 1HH2 ARG 93 -12.283 1.911 12.487 683 HH22 ARG 93 2HH2 ARG 93 -10.643 2.437 12.696 684 H ASP 94 H ASP 94 -9.885 3.382 8.916 685 HA ASP 94 HA ASP 94 -9.576 5.447 6.795 686 HB2 ASP 94 2HB ASP 94 -8.420 5.409 9.630 687 HB3 ASP 94 1HB ASP 94 -7.902 6.540 8.383 688 H LEU 95 H LEU 95 -7.616 5.473 5.680 689 HA LEU 95 HA LEU 95 -5.396 3.742 6.592 690 HB2 LEU 95 2HB LEU 95 -6.289 4.147 3.697 691 HB3 LEU 95 1HB LEU 95 -4.729 3.471 4.152 692 HG LEU 95 HG LEU 95 -7.467 2.231 4.566 693 HD11 LEU 95 1HD1 LEU 95 -5.026 1.348 3.004 694 HD12 LEU 95 2HD1 LEU 95 -6.568 1.913 2.351 695 HD13 LEU 95 3HD1 LEU 95 -6.492 0.391 3.231 696 HD21 LEU 95 3HD2 LEU 95 -4.828 1.203 5.639 697 HD22 LEU 95 1HD2 LEU 95 -6.380 0.367 5.708 698 HD23 LEU 95 2HD2 LEU 95 -6.147 1.861 6.606 699 H HIS 96 H HIS 96 -3.547 4.918 6.844 700 HA HIS 96 HA HIS 96 -3.669 7.775 6.175 701 HB2 HIS 96 2HB HIS 96 -1.742 6.188 7.937 702 HB3 HIS 96 1HB HIS 96 -1.687 7.934 7.702 703 HD2 HIS 96 HD2 HIS 96 -4.439 5.385 9.058 704 HE1 HIS 96 HE1 HIS 96 -4.517 8.977 11.281 705 HE2 HIS 96 HE2 HIS 96 -5.691 6.788 10.835 706 H ALA 97 H ALA 97 -2.392 8.692 4.674 707 HA ALA 97 HA ALA 97 -0.634 7.007 3.007 708 HB1 ALA 97 3HB ALA 97 -0.971 8.720 1.259 709 HB2 ALA 97 1HB ALA 97 -1.953 9.681 2.374 710 HB3 ALA 97 2HB ALA 97 -2.516 8.097 1.838 711 H PHE 98 H PHE 98 1.505 7.402 2.963 712 HA PHE 98 HA PHE 98 2.618 9.892 4.133 713 HB2 PHE 98 2HB PHE 98 3.968 7.177 4.466 714 HB3 PHE 98 1HB PHE 98 4.271 8.662 5.346 715 HD1 PHE 98 HD2 PHE 98 1.999 5.765 5.014 716 HD2 PHE 98 HD1 PHE 98 3.033 9.171 7.371 717 HE1 PHE 98 HE2 PHE 98 0.630 4.902 6.864 718 HE2 PHE 98 HE1 PHE 98 1.666 8.293 9.215 719 HZ PHE 98 HZ PHE 98 0.470 6.163 8.960 720 H ARG 99 H ARG 99 4.986 10.043 3.566 721 HA ARG 99 HA ARG 99 6.104 8.512 1.407 722 HB2 ARG 99 2HB ARG 99 6.468 10.431 -0.141 723 HB3 ARG 99 1HB ARG 99 4.773 10.021 0.047 724 HG2 ARG 99 2HG ARG 99 5.020 12.000 1.939 725 HG3 ARG 99 1HG ARG 99 6.205 12.533 0.747 726 HD2 ARG 99 2HD ARG 99 3.267 11.965 0.252 727 HD3 ARG 99 1HD ARG 99 4.035 13.546 0.313 728 HE ARG 99 HE ARG 99 5.168 11.827 -1.699 729 HH11 ARG 99 1HH1 ARG 99 2.488 14.033 -1.100 730 HH12 ARG 99 2HH1 ARG 99 2.252 14.380 -2.780 731 HH21 ARG 99 1HH2 ARG 99 4.835 12.289 -3.881 732 HH22 ARG 99 2HH2 ARG 99 3.585 13.389 -4.351 733 H GLN 100 H GLN 100 8.400 8.868 1.278 734 HA GLN 100 HA GLN 100 9.435 8.738 3.808 735 HB2 GLN 100 2HB GLN 100 11.009 9.270 1.260 736 HB3 GLN 100 1HB GLN 100 11.674 8.623 2.758 737 HG2 GLN 100 2HG GLN 100 10.321 6.608 2.544 738 HG3 GLN 100 1HG GLN 100 9.505 7.262 1.130 739 HE21 GLN 100 1HE2 GLN 100 12.999 7.439 1.727 740 HE22 GLN 100 2HE2 GLN 100 13.440 6.409 0.418 741 H ALA 101 H ALA 101 10.713 11.338 1.632 742 HA ALA 101 HA ALA 101 10.743 13.141 3.990 743 HB1 ALA 101 3HB ALA 101 13.000 12.532 3.252 744 HB2 ALA 101 1HB ALA 101 12.695 14.250 3.005 745 HB3 ALA 101 2HB ALA 101 12.657 13.138 1.631 746 H ALA 102 H ALA 102 11.165 13.848 0.497 747 HA ALA 102 HA ALA 102 8.887 15.739 0.634 748 HB1 ALA 102 3HB ALA 102 11.653 16.228 -0.547 749 HB2 ALA 102 1HB ALA 102 11.052 16.890 0.977 750 HB3 ALA 102 2HB ALA 102 10.308 17.373 -0.547 751 H ASP 103 H ASP 103 8.585 13.186 -0.480 752 HA ASP 103 HA ASP 103 9.315 12.841 -3.169 753 HB2 ASP 103 2HB ASP 103 8.533 10.956 -1.819 754 HB3 ASP 103 1HB ASP 103 6.956 11.709 -1.612 755 H GLU 104 H GLU 104 8.456 13.493 -5.067 756 HA GLU 104 HA GLU 104 5.722 14.630 -5.189 757 HB2 GLU 104 2HB GLU 104 6.647 16.255 -6.916 758 HB3 GLU 104 1HB GLU 104 7.182 16.521 -5.262 759 HG2 GLU 104 2HG GLU 104 9.307 15.219 -5.888 760 HG3 GLU 104 1HG GLU 104 8.776 15.358 -7.562 761 H SER 105 H SER 105 7.344 12.036 -5.906 762 HA SER 105 HA SER 105 6.717 11.681 -8.734 763 HB2 SER 105 2HB SER 105 8.872 10.894 -7.718 764 HB3 SER 105 1HB SER 105 7.960 9.769 -6.712 765 HG SER 105 HG SER 105 7.393 8.626 -8.511 766 H ARG 106 H ARG 106 4.669 11.871 -6.413 767 HA ARG 106 HA ARG 106 2.507 11.238 -6.101 768 HB2 ARG 106 2HB ARG 106 2.948 9.357 -8.465 769 HB3 ARG 106 1HB ARG 106 1.388 9.649 -7.713 770 HG2 ARG 106 2HG ARG 106 3.050 11.785 -9.088 771 HG3 ARG 106 1HG ARG 106 1.738 10.888 -9.851 772 HD2 ARG 106 2HD ARG 106 0.138 11.816 -8.240 773 HD3 ARG 106 1HD ARG 106 1.442 12.673 -7.416 774 HE ARG 106 HE ARG 106 0.447 13.249 -10.139 775 HH11 ARG 106 1HH1 ARG 106 2.188 14.317 -7.277 776 HH12 ARG 106 2HH1 ARG 106 2.321 15.957 -7.827 777 HH21 ARG 106 1HH2 ARG 106 0.565 15.421 -10.803 778 HH22 ARG 106 2HH2 ARG 106 1.400 16.580 -9.818 779 H THR 107 H THR 107 5.020 9.501 -5.154 780 HA THR 107 HA THR 107 3.887 6.843 -4.915 781 HB THR 107 HB THR 107 6.536 7.940 -3.873 782 HG1 THR 107 HG1 THR 107 5.687 7.002 -6.371 783 HG21 THR 107 3HG2 THR 107 5.900 5.827 -2.750 784 HG22 THR 107 1HG2 THR 107 7.255 5.563 -3.851 785 HG23 THR 107 2HG2 THR 107 5.627 5.064 -4.318 786 H LEU 108 H LEU 108 2.240 6.853 -3.473 787 HA LEU 108 HA LEU 108 2.665 7.917 -0.735 788 HB2 LEU 108 2HB LEU 108 0.027 7.221 -2.066 789 HB3 LEU 108 1HB LEU 108 0.240 8.020 -0.520 790 HG LEU 108 HG LEU 108 0.771 9.156 -3.289 791 HD11 LEU 108 1HD1 LEU 108 -0.944 10.794 -2.679 792 HD12 LEU 108 2HD1 LEU 108 -1.172 9.990 -1.123 793 HD13 LEU 108 3HD1 LEU 108 -1.566 9.145 -2.623 794 HD21 LEU 108 3HD2 LEU 108 1.383 10.462 -0.607 795 HD22 LEU 108 1HD2 LEU 108 1.455 11.264 -2.179 796 HD23 LEU 108 2HD2 LEU 108 2.565 9.948 -1.814 797 H PHE 109 H PHE 109 2.718 6.513 0.897 798 HA PHE 109 HA PHE 109 2.427 3.627 0.353 799 HB2 PHE 109 2HB PHE 109 4.642 4.515 1.152 800 HB3 PHE 109 1HB PHE 109 3.865 5.106 2.614 801 HD1 PHE 109 HD1 PHE 109 4.755 2.007 0.722 802 HD2 PHE 109 HD2 PHE 109 3.519 3.629 4.488 803 HE1 PHE 109 HE1 PHE 109 5.228 -0.149 1.819 804 HE2 PHE 109 HE2 PHE 109 3.998 1.475 5.571 805 HZ PHE 109 HZ PHE 109 4.853 -0.413 4.240 806 H VAL 110 H VAL 110 0.463 2.855 0.986 807 HA VAL 110 HA VAL 110 -0.811 3.919 3.453 808 HB VAL 110 HB VAL 110 -3.049 3.261 2.440 809 HG11 VAL 110 1HG1 VAL 110 -2.353 5.598 2.517 810 HG12 VAL 110 2HG1 VAL 110 -3.235 5.285 1.022 811 HG13 VAL 110 3HG1 VAL 110 -1.476 5.421 0.994 812 HG21 VAL 110 3HG2 VAL 110 -1.469 3.055 -0.158 813 HG22 VAL 110 1HG2 VAL 110 -3.231 3.039 -0.021 814 HG23 VAL 110 2HG2 VAL 110 -2.279 1.727 0.670 815 HA PRO 111 HA PRO 111 -0.189 -0.513 4.476 816 HB2 PRO 111 2HB PRO 111 0.152 -0.165 7.170 817 HB3 PRO 111 1HB PRO 111 1.467 0.146 6.016 818 HG2 PRO 111 2HG PRO 111 -0.373 2.114 7.345 819 HG3 PRO 111 1HG PRO 111 1.386 2.213 7.093 820 HD2 PRO 111 2HD PRO 111 -0.427 3.484 5.467 821 HD3 PRO 111 1HD PRO 111 1.167 2.937 4.901 822 H PHE 112 H PHE 112 -1.822 -1.954 5.084 823 HA PHE 112 HA PHE 112 -3.895 -0.992 6.917 824 HB2 PHE 112 2HB PHE 112 -5.722 -1.954 5.728 825 HB3 PHE 112 1HB PHE 112 -4.839 -0.969 4.588 826 HD1 PHE 112 HD1 PHE 112 -3.503 -2.064 2.774 827 HD2 PHE 112 HD2 PHE 112 -6.040 -4.315 5.381 828 HE1 PHE 112 HE1 PHE 112 -3.523 -3.928 1.180 829 HE2 PHE 112 HE2 PHE 112 -6.038 -6.172 3.779 830 HZ PHE 112 HZ PHE 112 -4.788 -5.977 1.671 831 H ARG 113 H ARG 113 -3.968 -2.259 8.686 832 HA ARG 113 HA ARG 113 -2.729 -4.962 8.561 833 HB2 ARG 113 2HB ARG 113 -1.784 -3.105 10.090 834 HB3 ARG 113 1HB ARG 113 -3.244 -3.285 11.058 835 HG2 ARG 113 2HG ARG 113 -2.665 -5.632 11.522 836 HG3 ARG 113 1HG ARG 113 -1.241 -5.491 10.494 837 HD2 ARG 113 2HD ARG 113 -0.510 -3.581 12.086 838 HD3 ARG 113 1HD ARG 113 -1.746 -4.199 13.185 839 HE ARG 113 HE ARG 113 0.690 -5.601 12.301 840 HH11 ARG 113 1HH1 ARG 113 -2.057 -5.500 14.488 841 HH12 ARG 113 2HH1 ARG 113 -1.432 -6.747 15.520 842 HH21 ARG 113 1HH2 ARG 113 1.505 -7.210 13.675 843 HH22 ARG 113 2HH2 ARG 113 0.581 -7.708 15.056 844 H ASP 114 H ASP 114 -4.227 -6.646 8.561 845 HA ASP 114 HA ASP 114 -6.972 -5.998 9.430 846 HB2 ASP 114 2HB ASP 114 -7.859 -6.976 7.445 847 HB3 ASP 114 1HB ASP 114 -6.578 -5.899 6.904 848 H LYS 115 H LYS 115 -8.036 -8.594 8.801 849 HA LYS 115 HA LYS 115 -7.051 -10.028 11.156 850 HB2 LYS 115 2HB LYS 115 -9.570 -10.403 9.500 851 HB3 LYS 115 1HB LYS 115 -9.155 -11.402 10.881 852 HG2 LYS 115 2HG LYS 115 -9.614 -8.406 11.034 853 HG3 LYS 115 1HG LYS 115 -10.854 -9.615 11.331 854 HD2 LYS 115 2HD LYS 115 -10.202 -9.179 13.508 855 HD3 LYS 115 1HD LYS 115 -9.114 -10.513 13.141 856 HE2 LYS 115 2HE LYS 115 -7.311 -8.876 12.649 857 HE3 LYS 115 1HE LYS 115 -8.416 -7.556 13.047 858 HZ1 LYS 115 3HZ LYS 115 -7.561 -9.698 14.916 859 HZ2 LYS 115 1HZ LYS 115 -8.581 -8.407 15.292 860 HZ3 LYS 115 2HZ LYS 115 -6.966 -8.122 14.900 861 H THR 116 H THR 116 -6.456 -10.273 7.783 862 HA THR 116 HA THR 116 -5.838 -13.101 7.848 863 HB THR 116 HB THR 116 -4.535 -12.800 5.800 864 HG1 THR 116 HG1 THR 116 -5.007 -10.030 5.725 865 HG21 THR 116 3HG2 THR 116 -6.979 -12.889 5.487 866 HG22 THR 116 1HG2 THR 116 -6.229 -11.842 4.277 867 HG23 THR 116 2HG2 THR 116 -7.073 -11.133 5.655 868 H THR 117 H THR 117 -4.354 -10.231 9.021 869 HA THR 117 HA THR 117 -1.630 -10.892 9.081 870 HB THR 117 HB THR 117 -3.229 -9.069 10.935 871 HG1 THR 117 HG1 THR 117 -3.271 -8.561 8.641 872 HG21 THR 117 3HG2 THR 117 -1.076 -7.922 11.401 873 HG22 THR 117 1HG2 THR 117 -0.222 -9.130 10.438 874 HG23 THR 117 2HG2 THR 117 -1.022 -9.602 11.937 875 H GLY 118 H GLY 118 -0.866 -12.680 9.966 876 HA2 GLY 118 2HA GLY 118 -0.138 -14.171 11.536 877 HA3 GLY 118 1HA GLY 118 -0.913 -13.192 12.765 878 H GLN 119 H GLN 119 -3.037 -14.281 10.259 879 HA GLN 119 HA GLN 119 -4.070 -16.435 12.024 880 HB2 GLN 119 2HB GLN 119 -5.668 -14.481 10.312 881 HB3 GLN 119 1HB GLN 119 -6.359 -15.834 11.195 882 HG2 GLN 119 2HG GLN 119 -4.933 -13.476 12.464 883 HG3 GLN 119 1HG GLN 119 -6.680 -13.645 12.334 884 HE21 GLN 119 1HE2 GLN 119 -3.825 -14.703 14.008 885 HE22 GLN 119 2HE2 GLN 119 -4.632 -15.594 15.246 886 H GLN 120 H GLN 120 -5.189 -15.562 8.733 887 HA GLN 120 HA GLN 120 -4.440 -18.251 7.779 888 HB2 GLN 120 2HB GLN 120 -5.936 -17.842 5.862 889 HB3 GLN 120 1HB GLN 120 -6.779 -17.684 7.391 890 HG2 GLN 120 2HG GLN 120 -5.738 -15.189 6.072 891 HG3 GLN 120 1HG GLN 120 -7.168 -15.965 5.400 892 HE21 GLN 120 1HE2 GLN 120 -8.485 -14.208 5.932 893 HE22 GLN 120 2HE2 GLN 120 -8.951 -13.842 7.555 894 H SER 121 H SER 121 -2.851 -15.656 8.063 895 HA SER 121 HA SER 121 -1.075 -15.972 5.824 896 HB2 SER 121 2HB SER 121 -2.424 -13.241 6.198 897 HB3 SER 121 1HB SER 121 -1.137 -13.609 5.047 898 HG SER 121 HG SER 121 -2.852 -15.310 4.353 899 H TYR 122 H TYR 122 0.768 -14.216 6.168 900 HA TYR 122 HA TYR 122 1.786 -14.815 8.774 901 HB2 TYR 122 2HB TYR 122 3.061 -14.612 6.482 902 HB3 TYR 122 1HB TYR 122 3.130 -12.893 6.838 903 HD1 TYR 122 HD2 TYR 122 4.211 -16.259 7.996 904 HD2 TYR 122 HD1 TYR 122 4.721 -12.047 8.512 905 HE1 TYR 122 HE2 TYR 122 6.216 -16.663 9.356 906 HE2 TYR 122 HE1 TYR 122 6.719 -12.459 9.873 907 HH TYR 122 HH TYR 122 7.738 -14.156 11.163 908 H ASP 123 H ASP 123 2.813 -13.107 10.161 909 HA ASP 123 HA ASP 123 0.804 -11.115 10.860 910 HB2 ASP 123 2HB ASP 123 2.136 -10.775 12.908 911 HB3 ASP 123 1HB ASP 123 1.779 -12.475 12.643 912 H GLY 124 H GLY 124 2.242 -9.056 12.020 913 HA2 GLY 124 2HA GLY 124 3.649 -7.227 11.576 914 HA3 GLY 124 1HA GLY 124 3.909 -7.815 9.938 915 H GLY 125 H GLY 125 1.344 -8.173 9.044 916 HA2 GLY 125 2HA GLY 125 -0.718 -6.805 8.852 917 HA3 GLY 125 1HA GLY 125 0.323 -5.383 8.891 918 H ARG 126 H ARG 126 -1.278 -5.467 6.802 919 HA ARG 126 HA ARG 126 0.348 -6.414 4.504 920 HB2 ARG 126 2HB ARG 126 -2.503 -5.315 4.362 921 HB3 ARG 126 1HB ARG 126 -1.621 -6.165 3.107 922 HG2 ARG 126 2HG ARG 126 -2.644 -7.422 5.665 923 HG3 ARG 126 1HG ARG 126 -3.472 -7.474 4.112 924 HD2 ARG 126 2HD ARG 126 -2.386 -9.574 4.366 925 HD3 ARG 126 1HD ARG 126 -1.417 -8.673 3.197 926 HE ARG 126 HE ARG 126 0.233 -8.298 4.887 927 HH11 ARG 126 1HH1 ARG 126 -2.254 -10.605 5.898 928 HH12 ARG 126 2HH1 ARG 126 -1.257 -11.290 7.144 929 HH21 ARG 126 1HH2 ARG 126 1.481 -9.178 6.534 930 HH22 ARG 126 2HH2 ARG 126 0.864 -10.473 7.502 931 H TYR 127 H TYR 127 0.865 -4.737 2.913 932 HA TYR 127 HA TYR 127 -0.085 -2.060 3.501 933 HB2 TYR 127 2HB TYR 127 2.461 -1.266 2.973 934 HB3 TYR 127 1HB TYR 127 1.808 -1.460 4.582 935 HD1 TYR 127 HD2 TYR 127 2.409 -3.472 5.954 936 HD2 TYR 127 HD1 TYR 127 4.314 -2.667 2.202 937 HE1 TYR 127 HE2 TYR 127 4.269 -4.924 6.590 938 HE2 TYR 127 HE1 TYR 127 6.180 -4.135 2.854 939 HH TYR 127 HH TYR 127 7.182 -4.958 5.091 940 H MET 128 H MET 128 -0.690 -1.064 1.881 941 HA MET 128 HA MET 128 -0.089 -1.884 -0.860 942 HB2 MET 128 2HB MET 128 -2.184 -0.063 0.407 943 HB3 MET 128 1HB MET 128 -1.973 -0.203 -1.343 944 HG2 MET 128 2HG MET 128 -2.319 -2.795 -0.789 945 HG3 MET 128 1HG MET 128 -3.173 -2.113 0.603 946 HE1 MET 128 3HE MET 128 -5.202 -0.352 0.349 947 HE2 MET 128 1HE MET 128 -5.861 0.124 -1.216 948 HE3 MET 128 2HE MET 128 -4.249 0.660 -0.740 949 H GLU 129 H GLU 129 0.336 -0.221 -2.433 950 HA GLU 129 HA GLU 129 1.184 2.429 -1.490 951 HB2 GLU 129 2HB GLU 129 3.238 0.975 -1.755 952 HB3 GLU 129 1HB GLU 129 2.808 0.722 -3.442 953 HG2 GLU 129 2HG GLU 129 2.959 3.238 -3.755 954 HG3 GLU 129 1HG GLU 129 3.622 3.333 -2.123 955 H LEU 130 H LEU 130 0.154 3.917 -2.693 956 HA LEU 130 HA LEU 130 -0.791 3.224 -5.406 957 HB2 LEU 130 2HB LEU 130 -2.645 5.095 -4.782 958 HB3 LEU 130 1HB LEU 130 -2.897 3.370 -4.565 959 HG LEU 130 HG LEU 130 -2.203 3.706 -2.118 960 HD11 LEU 130 1HD1 LEU 130 -1.082 5.850 -2.282 961 HD12 LEU 130 2HD1 LEU 130 -2.445 5.958 -1.172 962 HD13 LEU 130 3HD1 LEU 130 -2.577 6.630 -2.801 963 HD21 LEU 130 3HD2 LEU 130 -4.706 5.087 -3.105 964 HD22 LEU 130 1HD2 LEU 130 -4.419 4.527 -1.455 965 HD23 LEU 130 2HD2 LEU 130 -4.519 3.364 -2.775 966 H GLU 131 H GLU 131 -0.714 4.759 -6.921 967 HA GLU 131 HA GLU 131 0.711 7.270 -6.347 968 HB2 GLU 131 2HB GLU 131 1.238 5.410 -8.715 969 HB3 GLU 131 1HB GLU 131 2.001 6.978 -8.437 970 HG2 GLU 131 2HG GLU 131 2.978 6.097 -6.307 971 HG3 GLU 131 1HG GLU 131 2.265 4.529 -6.664 972 HA PRO 132 HA PRO 132 -3.390 8.307 -8.220 973 HB2 PRO 132 2HB PRO 132 -3.387 10.934 -7.341 974 HB3 PRO 132 1HB PRO 132 -3.848 9.572 -6.307 975 HG2 PRO 132 2HG PRO 132 -1.186 10.960 -6.495 976 HG3 PRO 132 1HG PRO 132 -2.116 10.522 -5.042 977 HD2 PRO 132 2HD PRO 132 -0.079 8.999 -5.850 978 HD3 PRO 132 1HD PRO 132 -1.555 8.249 -5.203 979 H ASP 133 H ASP 133 -4.108 10.126 -9.642 980 HA ASP 133 HA ASP 133 -2.394 10.466 -11.889 981 HB2 ASP 133 2HB ASP 133 -4.857 10.314 -12.117 982 HB3 ASP 133 1HB ASP 133 -5.060 11.788 -11.179 983 H ARG 134 H ARG 134 -3.886 12.879 -9.685 984 HA ARG 134 HA ARG 134 -1.491 14.601 -9.974 985 HB2 ARG 134 2HB ARG 134 -2.956 16.505 -9.495 986 HB3 ARG 134 1HB ARG 134 -3.548 15.601 -10.876 987 HG2 ARG 134 2HG ARG 134 -5.541 16.021 -9.781 988 HG3 ARG 134 1HG ARG 134 -5.139 14.466 -9.087 989 HD2 ARG 134 2HD ARG 134 -4.737 15.332 -6.994 990 HD3 ARG 134 1HD ARG 134 -4.102 16.850 -7.614 991 HE ARG 134 HE ARG 134 -6.943 16.171 -7.205 992 HH11 ARG 134 1HH1 ARG 134 -4.478 18.612 -7.809 993 HH12 ARG 134 2HH1 ARG 134 -5.556 19.938 -7.514 994 HH21 ARG 134 1HH2 ARG 134 -8.315 17.918 -6.759 995 HH22 ARG 134 2HH2 ARG 134 -7.729 19.546 -6.920 996 H ASP 135 H ASP 135 -1.539 16.191 -7.835 997 HA ASP 135 HA ASP 135 -0.813 14.376 -5.680 998 HB2 ASP 135 2HB ASP 135 0.659 16.302 -6.167 999 HB3 ASP 135 1HB ASP 135 -0.654 17.419 -5.819 1000 H LEU 136 H LEU 136 -2.114 13.890 -3.988 1001 HA LEU 136 HA LEU 136 -4.888 14.571 -4.152 1002 HB2 LEU 136 2HB LEU 136 -3.313 12.967 -2.109 1003 HB3 LEU 136 1HB LEU 136 -5.065 13.111 -2.107 1004 HG LEU 136 HG LEU 136 -3.429 11.843 -4.333 1005 HD11 LEU 136 1HD1 LEU 136 -3.390 10.534 -2.244 1006 HD12 LEU 136 2HD1 LEU 136 -4.274 9.714 -3.524 1007 HD13 LEU 136 3HD1 LEU 136 -5.156 10.516 -2.222 1008 HD21 LEU 136 3HD2 LEU 136 -6.444 12.010 -3.966 1009 HD22 LEU 136 1HD2 LEU 136 -5.614 11.054 -5.199 1010 HD23 LEU 136 2HD2 LEU 136 -5.492 12.811 -5.219 1011 H SER 137 H SER 137 -5.915 16.165 -3.142 1012 HA SER 137 HA SER 137 -4.584 17.678 -0.957 1013 HB2 SER 137 2HB SER 137 -6.507 18.725 -3.087 1014 HB3 SER 137 1HB SER 137 -5.688 19.680 -1.847 1015 HG SER 137 HG SER 137 -4.242 18.104 -3.695 1016 H ASP 138 H ASP 138 -6.240 18.812 0.484 1017 HA ASP 138 HA ASP 138 -7.965 16.826 1.574 1018 HB2 ASP 138 2HB ASP 138 -8.548 18.517 3.286 1019 HB3 ASP 138 1HB ASP 138 -6.812 18.372 3.069 1020 H GLY 139 H GLY 139 -9.728 16.253 0.527 1021 HA2 GLY 139 2HA GLY 139 -12.142 17.012 0.291 1022 HA3 GLY 139 1HA GLY 139 -11.498 18.274 -0.758 1023 H ASP 140 H ASP 140 -9.434 16.520 -1.914 1024 HA ASP 140 HA ASP 140 -10.806 15.185 -4.022 1025 HB2 ASP 140 2HB ASP 140 -7.928 15.001 -3.025 1026 HB3 ASP 140 1HB ASP 140 -8.485 14.050 -4.398 1027 H GLU 141 H GLU 141 -10.647 12.852 -4.486 1028 HA GLU 141 HA GLU 141 -10.466 11.102 -2.106 1029 HB2 GLU 141 2HB GLU 141 -12.447 10.795 -4.409 1030 HB3 GLU 141 1HB GLU 141 -12.251 9.679 -3.058 1031 HG2 GLU 141 2HG GLU 141 -12.936 11.472 -1.481 1032 HG3 GLU 141 1HG GLU 141 -13.152 12.567 -2.844 1033 H ILE 142 H ILE 142 -10.145 8.748 -2.853 1034 HA ILE 142 HA ILE 142 -8.249 8.504 -5.070 1035 HB ILE 142 HB ILE 142 -6.810 9.381 -3.332 1036 HG12 ILE 142 2HG1 ILE 142 -5.210 7.465 -2.901 1037 HG13 ILE 142 1HG1 ILE 142 -6.422 6.356 -3.528 1038 HG21 ILE 142 1HG2 ILE 142 -6.596 8.397 -1.084 1039 HG22 ILE 142 2HG2 ILE 142 -7.902 7.273 -1.451 1040 HG23 ILE 142 3HG2 ILE 142 -8.227 9.004 -1.383 1041 HD11 ILE 142 3HD1 ILE 142 -4.674 6.858 -5.156 1042 HD12 ILE 142 1HD1 ILE 142 -5.094 8.570 -5.098 1043 HD13 ILE 142 2HD1 ILE 142 -6.253 7.394 -5.725 1044 H THR 143 H THR 143 -7.938 6.365 -5.694 1045 HA THR 143 HA THR 143 -9.981 4.468 -4.975 1046 HB THR 143 HB THR 143 -7.609 4.203 -6.881 1047 HG1 THR 143 HG1 THR 143 -9.158 5.979 -7.285 1048 HG21 THR 143 3HG2 THR 143 -10.215 2.661 -6.677 1049 HG22 THR 143 1HG2 THR 143 -8.597 2.032 -6.358 1050 HG23 THR 143 2HG2 THR 143 -9.049 2.506 -7.997 1051 H LEU 144 H LEU 144 -9.745 2.645 -3.694 1052 HA LEU 144 HA LEU 144 -7.127 1.867 -2.596 1053 HB2 LEU 144 2HB LEU 144 -9.690 2.471 -1.051 1054 HB3 LEU 144 1HB LEU 144 -8.540 1.314 -0.424 1055 HG LEU 144 HG LEU 144 -8.306 3.449 0.716 1056 HD11 LEU 144 1HD1 LEU 144 -6.289 2.122 0.474 1057 HD12 LEU 144 2HD1 LEU 144 -5.909 3.841 0.475 1058 HD13 LEU 144 3HD1 LEU 144 -5.900 2.935 -1.041 1059 HD21 LEU 144 3HD2 LEU 144 -7.587 5.501 -0.353 1060 HD22 LEU 144 1HD2 LEU 144 -9.118 4.959 -1.036 1061 HD23 LEU 144 2HD2 LEU 144 -7.619 4.728 -1.939 1062 H ASP 145 H ASP 145 -7.198 0.111 -4.097 1063 HA ASP 145 HA ASP 145 -9.174 -2.019 -3.515 1064 HB2 ASP 145 2HB ASP 145 -7.003 -1.870 -5.644 1065 HB3 ASP 145 1HB ASP 145 -7.978 -3.306 -5.344 1066 H PHE 146 H PHE 146 -8.640 -3.034 -1.705 1067 HA PHE 146 HA PHE 146 -6.075 -3.242 -0.525 1068 HB2 PHE 146 2HB PHE 146 -8.481 -5.029 0.018 1069 HB3 PHE 146 1HB PHE 146 -7.157 -4.669 1.129 1070 HD1 PHE 146 HD2 PHE 146 -6.764 -2.066 1.555 1071 HD2 PHE 146 HD1 PHE 146 -10.466 -3.788 0.274 1072 HE1 PHE 146 HE2 PHE 146 -7.960 -0.080 2.313 1073 HE2 PHE 146 HE1 PHE 146 -11.659 -1.780 1.041 1074 HZ PHE 146 HZ PHE 146 -10.405 0.074 2.062 1075 H ASN 147 H ASN 147 -7.370 -4.904 -3.083 1076 HA ASN 147 HA ASN 147 -6.175 -7.433 -3.001 1077 HB2 ASN 147 2HB ASN 147 -6.859 -5.750 -5.446 1078 HB3 ASN 147 1HB ASN 147 -6.618 -7.497 -5.413 1079 HD21 ASN 147 1HD2 ASN 147 -8.552 -8.299 -5.858 1080 HD22 ASN 147 2HD2 ASN 147 -10.026 -7.903 -5.061 1081 H LEU 148 H LEU 148 -4.960 -4.275 -3.824 1082 HA LEU 148 HA LEU 148 -2.685 -5.196 -5.384 1083 HB2 LEU 148 2HB LEU 148 -3.197 -2.342 -4.468 1084 HB3 LEU 148 1HB LEU 148 -2.328 -2.886 -5.895 1085 HG LEU 148 HG LEU 148 -5.335 -2.980 -5.463 1086 HD11 LEU 148 1HD1 LEU 148 -3.731 -1.279 -7.384 1087 HD12 LEU 148 2HD1 LEU 148 -4.537 -0.728 -5.914 1088 HD13 LEU 148 3HD1 LEU 148 -5.494 -1.336 -7.263 1089 HD21 LEU 148 3HD2 LEU 148 -5.565 -3.790 -7.763 1090 HD22 LEU 148 1HD2 LEU 148 -4.688 -4.938 -6.755 1091 HD23 LEU 148 2HD2 LEU 148 -3.810 -3.925 -7.903 1092 H ALA 149 H ALA 149 -3.055 -5.616 -2.321 1093 HA ALA 149 HA ALA 149 -0.964 -4.255 -0.980 1094 HB1 ALA 149 3HB ALA 149 -2.308 -6.891 -0.267 1095 HB2 ALA 149 1HB ALA 149 -2.873 -5.289 0.206 1096 HB3 ALA 149 2HB ALA 149 -1.336 -5.895 0.823 1097 H TYR 150 H TYR 150 1.149 -4.597 -1.138 1098 HA TYR 150 HA TYR 150 2.206 -6.746 -2.802 1099 HB2 TYR 150 2HB TYR 150 3.658 -4.507 -1.311 1100 HB3 TYR 150 1HB TYR 150 4.394 -5.577 -2.501 1101 HD1 TYR 150 HD1 TYR 150 1.925 -5.513 -4.448 1102 HD2 TYR 150 HD2 TYR 150 4.182 -2.433 -2.512 1103 HE1 TYR 150 HE1 TYR 150 1.321 -3.947 -6.231 1104 HE2 TYR 150 HE2 TYR 150 3.574 -0.866 -4.311 1105 HH TYR 150 HH TYR 150 1.116 -1.440 -6.503 1106 H SER 151 H SER 151 3.211 -8.584 -2.066 1107 HA SER 151 HA SER 151 2.870 -9.721 0.347 1108 HB2 SER 151 2HB SER 151 4.920 -11.171 -0.283 1109 HB3 SER 151 1HB SER 151 3.636 -11.076 -1.489 1110 HG SER 151 HG SER 151 5.854 -9.322 -1.525 1111 HA PRO 152 HA PRO 152 4.857 -6.694 2.888 1112 HB2 PRO 152 2HB PRO 152 4.776 -8.794 5.055 1113 HB3 PRO 152 1HB PRO 152 4.119 -7.145 5.063 1114 HG2 PRO 152 2HG PRO 152 2.485 -9.213 4.823 1115 HG3 PRO 152 1HG PRO 152 2.214 -7.752 3.839 1116 HD2 PRO 152 2HD PRO 152 3.460 -10.376 3.018 1117 HD3 PRO 152 1HD PRO 152 2.305 -9.349 2.135 1118 H PHE 153 H PHE 153 6.947 -6.158 2.676 1119 HA PHE 153 HA PHE 153 8.968 -7.857 2.041 1120 HB2 PHE 153 2HB PHE 153 9.440 -5.107 3.229 1121 HB3 PHE 153 1HB PHE 153 10.420 -5.950 2.054 1122 HD1 PHE 153 HD1 PHE 153 7.184 -6.376 0.752 1123 HD2 PHE 153 HD2 PHE 153 10.095 -3.313 1.453 1124 HE1 PHE 153 HE1 PHE 153 6.154 -4.986 -0.997 1125 HE2 PHE 153 HE2 PHE 153 9.055 -1.949 -0.303 1126 HZ PHE 153 HZ PHE 153 7.098 -2.766 -1.528 1127 H CYS 154 H CYS 154 8.441 -6.192 5.176 1128 HA CYS 154 HA CYS 154 10.651 -7.156 6.602 1129 HB2 CYS 154 2HB CYS 154 9.302 -5.272 7.384 1130 HB3 CYS 154 1HB CYS 154 7.902 -6.318 7.613 1131 HG CYS 154 HG CYS 154 10.352 -5.595 9.670 1132 H ALA 155 H ALA 155 7.392 -8.458 6.257 1133 HA ALA 155 HA ALA 155 7.436 -10.525 8.134 1134 HB1 ALA 155 3HB ALA 155 5.395 -9.719 7.055 1135 HB2 ALA 155 1HB ALA 155 5.547 -11.461 6.841 1136 HB3 ALA 155 2HB ALA 155 5.927 -10.370 5.505 1137 H TYR 156 H TYR 156 8.701 -10.420 4.860 1138 HA TYR 156 HA TYR 156 9.400 -13.285 4.899 1139 HB2 TYR 156 2HB TYR 156 9.233 -11.219 2.675 1140 HB3 TYR 156 1HB TYR 156 10.023 -12.774 2.431 1141 HD1 TYR 156 HD1 TYR 156 6.734 -11.212 3.316 1142 HD2 TYR 156 HD2 TYR 156 8.731 -14.773 2.036 1143 HE1 TYR 156 HE1 TYR 156 4.560 -12.273 2.881 1144 HE2 TYR 156 HE2 TYR 156 6.555 -15.828 1.596 1145 HH TYR 156 HH TYR 156 4.238 -15.624 2.299 1146 H SER 157 H SER 157 10.932 -10.110 5.025 1147 HA SER 157 HA SER 157 13.603 -11.409 4.980 1148 HB2 SER 157 2HB SER 157 13.100 -10.008 2.925 1149 HB3 SER 157 1HB SER 157 13.031 -8.595 3.971 1150 HG SER 157 HG SER 157 15.191 -10.075 3.104 1151 H ASP 158 H ASP 158 14.733 -11.133 6.744 1152 HA ASP 158 HA ASP 158 13.900 -9.800 9.055 1153 HB2 ASP 158 2HB ASP 158 15.410 -11.737 9.085 1154 HB3 ASP 158 1HB ASP 158 16.671 -10.808 8.283 1155 H THR 159 H THR 159 15.833 -8.647 6.380 1156 HA THR 159 HA THR 159 17.369 -6.706 7.727 1157 HB THR 159 HB THR 159 17.985 -7.674 5.511 1158 HG1 THR 159 HG1 THR 159 19.048 -5.809 6.133 1159 HG21 THR 159 3HG2 THR 159 15.909 -5.774 4.368 1160 HG22 THR 159 1HG2 THR 159 15.786 -7.535 4.380 1161 HG23 THR 159 2HG2 THR 159 17.054 -6.745 3.441 1162 H PHE 160 H PHE 160 14.009 -6.543 6.893 1163 HA PHE 160 HA PHE 160 14.005 -3.583 6.886 1164 HB2 PHE 160 2HB PHE 160 11.717 -5.553 6.376 1165 HB3 PHE 160 1HB PHE 160 11.586 -3.802 6.303 1166 HD1 PHE 160 HD2 PHE 160 13.150 -6.761 4.657 1167 HD2 PHE 160 HD1 PHE 160 12.091 -2.634 4.268 1168 HE1 PHE 160 HE2 PHE 160 13.663 -6.849 2.258 1169 HE2 PHE 160 HE1 PHE 160 12.604 -2.744 1.862 1170 HZ PHE 160 HZ PHE 160 13.391 -4.846 0.856 1171 H SER 161 H SER 161 13.802 -2.723 8.934 1172 HA SER 161 HA SER 161 12.704 -4.178 11.180 1173 HB2 SER 161 2HB SER 161 13.311 -1.201 10.868 1174 HB3 SER 161 1HB SER 161 12.934 -2.014 12.390 1175 HG SER 161 HG SER 161 14.815 -3.361 11.939 1176 H CYS 162 H CYS 162 10.561 -4.042 11.995 1177 HA CYS 162 HA CYS 162 8.586 -3.758 10.014 1178 HB2 CYS 162 2HB CYS 162 8.461 -5.401 11.868 1179 HB3 CYS 162 1HB CYS 162 8.301 -4.093 13.033 1180 HG CYS 162 HG CYS 162 6.010 -4.685 10.561 1181 HA PRO 163 HA PRO 163 7.536 0.608 10.340 1182 HB2 PRO 163 2HB PRO 163 4.728 -0.232 9.637 1183 HB3 PRO 163 1HB PRO 163 5.820 0.880 8.786 1184 HG2 PRO 163 2HG PRO 163 5.299 -1.521 7.785 1185 HG3 PRO 163 1HG PRO 163 6.936 -0.823 7.677 1186 HD2 PRO 163 2HD PRO 163 5.891 -2.888 9.618 1187 HD3 PRO 163 1HD PRO 163 7.426 -2.863 8.716 1188 H LEU 164 H LEU 164 6.015 2.050 11.497 1189 HA LEU 164 HA LEU 164 4.686 0.792 13.824 1190 HB2 LEU 164 2HB LEU 164 5.957 3.567 13.654 1191 HB3 LEU 164 1HB LEU 164 4.938 3.025 14.972 1192 HG LEU 164 HG LEU 164 7.183 2.873 15.777 1193 HD11 LEU 164 1HD1 LEU 164 6.382 0.050 15.001 1194 HD12 LEU 164 2HD1 LEU 164 5.798 0.945 16.405 1195 HD13 LEU 164 3HD1 LEU 164 7.499 0.506 16.293 1196 HD21 LEU 164 3HD2 LEU 164 9.015 1.689 14.648 1197 HD22 LEU 164 1HD2 LEU 164 8.390 3.001 13.647 1198 HD23 LEU 164 2HD2 LEU 164 7.959 1.330 13.280 1199 HA PRO 165 HA PRO 165 1.636 2.602 10.901 1200 HB2 PRO 165 2HB PRO 165 -0.130 0.318 11.300 1201 HB3 PRO 165 1HB PRO 165 0.891 0.662 9.892 1202 HG2 PRO 165 2HG PRO 165 1.295 -1.469 11.610 1203 HG3 PRO 165 1HG PRO 165 2.560 -0.756 10.582 1204 HD2 PRO 165 2HD PRO 165 1.999 -0.258 13.507 1205 HD3 PRO 165 1HD PRO 165 3.557 -0.480 12.677 1206 HA PRO 166 HA PRO 166 -0.741 4.485 14.353 1207 HB2 PRO 166 2HB PRO 166 -2.527 5.848 12.631 1208 HB3 PRO 166 1HB PRO 166 -0.967 6.484 13.181 1209 HG2 PRO 166 2HG PRO 166 -1.630 5.093 10.609 1210 HG3 PRO 166 1HG PRO 166 -0.595 6.516 10.886 1211 HD2 PRO 166 2HD PRO 166 0.521 4.129 10.478 1212 HD3 PRO 166 1HD PRO 166 1.194 5.219 11.713 1213 H GLU 167 H GLU 167 -2.355 3.457 15.434 1214 HA GLU 167 HA GLU 167 -3.421 1.061 14.542 1215 HB2 GLU 167 2HB GLU 167 -4.485 2.760 16.828 1216 HB3 GLU 167 1HB GLU 167 -4.791 1.040 16.593 1217 HG2 GLU 167 2HG GLU 167 -2.380 0.570 16.860 1218 HG3 GLU 167 1HG GLU 167 -2.078 2.288 17.110 1219 H SER 168 H SER 168 -4.662 4.162 13.839 1220 HA SER 168 HA SER 168 -7.426 3.525 13.458 1221 HB2 SER 168 2HB SER 168 -6.555 5.814 13.932 1222 HB3 SER 168 1HB SER 168 -5.793 5.838 12.338 1223 HG SER 168 HG SER 168 -8.062 6.759 12.760 1224 H ASN 169 H ASN 169 -4.610 2.828 11.543 1225 HA ASN 169 HA ASN 169 -6.120 2.687 9.023 1226 HB2 ASN 169 2HB ASN 169 -4.086 2.453 7.809 1227 HB3 ASN 169 1HB ASN 169 -3.755 3.676 9.023 1228 HD21 ASN 169 1HD2 ASN 169 -3.192 0.290 8.166 1229 HD22 ASN 169 2HD2 ASN 169 -1.743 0.115 9.093 1230 H TRP 170 H TRP 170 -5.834 0.787 11.611 1231 HA TRP 170 HA TRP 170 -5.304 -1.779 10.317 1232 HB2 TRP 170 2HB TRP 170 -6.155 -1.158 13.180 1233 HB3 TRP 170 1HB TRP 170 -5.643 -2.731 12.580 1234 HD1 TRP 170 HD1 TRP 170 -3.314 -0.130 11.219 1235 HE1 TRP 170 HE1 TRP 170 -1.167 -0.035 12.625 1236 HE3 TRP 170 HE3 TRP 170 -4.835 -2.921 15.242 1237 HZ2 TRP 170 HZ2 TRP 170 -0.223 -1.017 15.089 1238 HZ3 TRP 170 HZ3 TRP 170 -3.245 -3.293 17.083 1239 HH2 TRP 170 HH2 TRP 170 -0.990 -2.355 17.011 1240 H LEU 171 H LEU 171 -6.898 -2.928 9.379 1241 HA LEU 171 HA LEU 171 -9.713 -2.103 9.685 1242 HB2 LEU 171 2HB LEU 171 -8.657 -4.133 7.684 1243 HB3 LEU 171 1HB LEU 171 -10.119 -3.169 7.585 1244 HG LEU 171 HG LEU 171 -7.265 -2.187 7.175 1245 HD11 LEU 171 1HD1 LEU 171 -8.140 -3.492 5.297 1246 HD12 LEU 171 2HD1 LEU 171 -7.926 -1.801 4.858 1247 HD13 LEU 171 3HD1 LEU 171 -9.543 -2.425 5.191 1248 HD21 LEU 171 3HD2 LEU 171 -8.549 -0.410 8.259 1249 HD22 LEU 171 1HD2 LEU 171 -9.817 -0.554 7.039 1250 HD23 LEU 171 2HD2 LEU 171 -8.207 0.007 6.582 1251 H GLU 172 H GLU 172 -10.946 -3.330 11.174 1252 HA GLU 172 HA GLU 172 -9.926 -5.962 11.970 1253 HB2 GLU 172 2HB GLU 172 -10.766 -4.257 13.649 1254 HB3 GLU 172 1HB GLU 172 -12.399 -4.563 13.067 1255 HG2 GLU 172 2HG GLU 172 -12.208 -6.931 13.752 1256 HG3 GLU 172 1HG GLU 172 -10.556 -6.654 14.302 1257 H THR 173 H THR 173 -10.322 -6.553 9.666 1258 HA THR 173 HA THR 173 -12.578 -8.327 9.447 1259 HB THR 173 HB THR 173 -13.663 -6.334 8.541 1260 HG1 THR 173 HG1 THR 173 -14.416 -7.822 7.249 1261 HG21 THR 173 3HG2 THR 173 -11.340 -6.080 6.588 1262 HG22 THR 173 1HG2 THR 173 -11.677 -4.987 7.933 1263 HG23 THR 173 2HG2 THR 173 -12.807 -5.100 6.583 1264 H ALA 174 H ALA 174 -12.279 -9.809 7.633 1265 HA ALA 174 HA ALA 174 -9.435 -10.244 6.990 1266 HB1 ALA 174 3HB ALA 174 -10.160 -12.468 6.227 1267 HB2 ALA 174 1HB ALA 174 -11.848 -12.035 6.518 1268 HB3 ALA 174 2HB ALA 174 -10.722 -12.158 7.869 1269 H VAL 175 H VAL 175 -8.678 -9.533 5.081 1270 HA VAL 175 HA VAL 175 -10.534 -8.642 2.990 1271 HB VAL 175 HB VAL 175 -7.491 -8.382 3.173 1272 HG11 VAL 175 1HG1 VAL 175 -9.378 -7.245 1.064 1273 HG12 VAL 175 2HG1 VAL 175 -8.187 -8.520 0.803 1274 HG13 VAL 175 3HG1 VAL 175 -7.653 -6.886 1.196 1275 HG21 VAL 175 3HG2 VAL 175 -7.996 -5.961 3.541 1276 HG22 VAL 175 1HG2 VAL 175 -8.683 -6.986 4.806 1277 HG23 VAL 175 2HG2 VAL 175 -9.720 -6.335 3.535 1278 H THR 176 H THR 176 -11.353 -10.647 2.435 1279 HA THR 176 HA THR 176 -9.635 -12.568 1.044 1280 HB THR 176 HB THR 176 -11.840 -13.896 0.972 1281 HG1 THR 176 HG1 THR 176 -12.832 -12.347 3.072 1282 HG21 THR 176 3HG2 THR 176 -10.101 -14.387 2.663 1283 HG22 THR 176 1HG2 THR 176 -11.716 -14.578 3.351 1284 HG23 THR 176 2HG2 THR 176 -10.765 -13.138 3.720 1285 H ALA 177 H ALA 177 -9.155 -11.675 -0.852 1286 HA ALA 177 HA ALA 177 -11.295 -11.018 -2.776 1287 HB1 ALA 177 3HB ALA 177 -8.851 -9.278 -2.235 1288 HB2 ALA 177 1HB ALA 177 -10.519 -8.883 -1.802 1289 HB3 ALA 177 2HB ALA 177 -10.055 -9.011 -3.500 1290 H GLY 178 H GLY 178 -10.818 -11.640 -4.868 1291 HA2 GLY 178 2HA GLY 178 -9.857 -12.851 -6.559 1292 HA3 GLY 178 1HA GLY 178 -8.401 -11.982 -6.105 1293 H GLU 179 H GLU 179 -7.094 -13.773 -6.672 1294 HA GLU 179 HA GLU 179 -7.061 -16.248 -5.290 1295 HB2 GLU 179 2HB GLU 179 -5.724 -15.728 -7.345 1296 HB3 GLU 179 1HB GLU 179 -4.718 -14.633 -6.397 1297 HG2 GLU 179 2HG GLU 179 -3.984 -16.549 -4.995 1298 HG3 GLU 179 1HG GLU 179 -4.958 -17.636 -5.986 1299 H ARG 180 H ARG 180 -6.051 -16.816 -3.322 1300 HA ARG 180 HA ARG 180 -5.683 -14.575 -1.421 1301 HB2 ARG 180 2HB ARG 180 -6.388 -17.505 -0.930 1302 HB3 ARG 180 1HB ARG 180 -6.207 -16.284 0.332 1303 HG2 ARG 180 2HG ARG 180 -8.093 -15.013 -0.590 1304 HG3 ARG 180 1HG ARG 180 -8.269 -16.189 -1.898 1305 HD2 ARG 180 2HD ARG 180 -8.610 -16.770 1.064 1306 HD3 ARG 180 1HD ARG 180 -9.918 -16.560 -0.101 1307 HE ARG 180 HE ARG 180 -7.930 -18.721 -0.456 1308 HH11 ARG 180 1HH1 ARG 180 -11.273 -17.772 0.028 1309 HH12 ARG 180 2HH1 ARG 180 -11.897 -19.364 -0.265 1310 HH21 ARG 180 1HH2 ARG 180 -8.745 -20.808 -0.795 1311 HH22 ARG 180 2HH2 ARG 180 -10.455 -21.091 -0.732 1312 H THR 181 H THR 181 -4.342 -16.058 0.612 1313 HA THR 181 HA THR 181 -1.769 -16.872 -0.403 1314 HB THR 181 HB THR 181 -1.478 -14.432 -0.618 1315 HG1 THR 181 HG1 THR 181 0.373 -15.489 0.018 1316 HG21 THR 181 3HG2 THR 181 -3.120 -13.625 1.029 1317 HG22 THR 181 1HG2 THR 181 -1.531 -12.925 1.347 1318 HG23 THR 181 2HG2 THR 181 -2.128 -14.250 2.348 1319 H ASP 182 H ASP 182 -0.477 -17.848 1.211 1320 HA ASP 182 HA ASP 182 -1.586 -18.030 3.952 1321 HB2 ASP 182 2HB ASP 182 -2.132 -20.089 2.649 1322 HB3 ASP 182 1HB ASP 182 -0.420 -20.329 2.306 1323 H LEU 183 H LEU 183 0.102 -18.873 5.491 1324 HA LEU 183 HA LEU 183 2.503 -17.246 5.126 1325 HB2 LEU 183 2HB LEU 183 2.718 -17.169 7.523 1326 HB3 LEU 183 1HB LEU 183 1.127 -16.655 7.022 1327 HG LEU 183 HG LEU 183 1.706 -19.380 8.268 1328 HD11 LEU 183 1HD1 LEU 183 0.625 -16.865 9.593 1329 HD12 LEU 183 2HD1 LEU 183 2.203 -17.605 9.878 1330 HD13 LEU 183 3HD1 LEU 183 0.738 -18.462 10.343 1331 HD21 LEU 183 3HD2 LEU 183 -0.348 -19.500 7.006 1332 HD22 LEU 183 1HD2 LEU 183 -0.925 -17.971 7.676 1333 HD23 LEU 183 2HD2 LEU 183 -0.772 -19.396 8.709 1334 H GLU 184 H GLU 184 1.627 -20.610 5.952 1335 HA GLU 184 HA GLU 184 4.514 -21.333 5.964 1336 HB2 GLU 184 2HB GLU 184 2.386 -22.261 7.936 1337 HB3 GLU 184 1HB GLU 184 3.980 -23.002 7.796 1338 HG2 GLU 184 2HG GLU 184 5.048 -20.866 8.409 1339 HG3 GLU 184 1HG GLU 184 3.467 -20.095 8.516 1340 H HIS 185 H HIS 185 1.318 -23.030 6.060 1341 HA HIS 185 HA HIS 185 2.250 -24.839 3.899 1342 HB2 HIS 185 2HB HIS 185 0.999 -25.829 6.509 1343 HB3 HIS 185 1HB HIS 185 1.481 -26.829 5.141 1344 HD1 HIS 185 HD1 HIS 185 4.237 -26.258 4.560 1345 HD2 HIS 185 HD2 HIS 185 2.864 -26.011 8.464 1346 HE1 HIS 185 HE1 HIS 185 6.282 -26.361 5.995 1347 HE2 HIS 185 HE2 HIS 185 5.442 -25.974 8.323 Start of MODEL 15 1 H1 MET 1 1H MET 1 -19.508 0.042 -12.847 2 H2 MET 1 2H MET 1 -20.515 -0.761 -13.936 3 H3 MET 1 3H MET 1 -21.111 0.549 -13.050 4 HA MET 1 HA MET 1 -20.658 1.157 -15.324 5 HB2 MET 1 2HB MET 1 -18.690 2.438 -13.365 6 HB3 MET 1 1HB MET 1 -19.250 3.155 -14.875 7 HG2 MET 1 2HG MET 1 -20.433 4.177 -13.033 8 HG3 MET 1 1HG MET 1 -21.564 3.188 -13.961 9 HE1 MET 1 3HE MET 1 -23.049 2.612 -10.382 10 HE2 MET 1 1HE MET 1 -23.454 2.843 -12.083 11 HE3 MET 1 2HE MET 1 -22.575 4.097 -11.204 12 H ASP 2 H ASP 2 -19.651 0.360 -17.034 13 HA ASP 2 HA ASP 2 -17.422 -1.377 -16.991 14 HB2 ASP 2 2HB ASP 2 -18.671 0.099 -19.345 15 HB3 ASP 2 1HB ASP 2 -17.580 -1.276 -19.481 16 H GLU 3 H GLU 3 -17.764 2.029 -17.705 17 HA GLU 3 HA GLU 3 -15.288 2.647 -18.871 18 HB2 GLU 3 2HB GLU 3 -16.993 4.414 -17.065 19 HB3 GLU 3 1HB GLU 3 -15.621 4.998 -17.996 20 HG2 GLU 3 2HG GLU 3 -17.597 5.621 -19.165 21 HG3 GLU 3 1HG GLU 3 -16.840 4.325 -20.091 22 H ASP 4 H ASP 4 -16.248 2.652 -15.451 23 HA ASP 4 HA ASP 4 -13.821 3.387 -14.245 24 HB2 ASP 4 2HB ASP 4 -15.774 3.417 -12.865 25 HB3 ASP 4 1HB ASP 4 -16.193 1.758 -13.265 26 H THR 5 H THR 5 -15.120 0.166 -14.982 27 HA THR 5 HA THR 5 -13.112 -1.293 -13.638 28 HB THR 5 HB THR 5 -15.087 -2.225 -15.761 29 HG1 THR 5 HG1 THR 5 -15.853 -1.179 -13.699 30 HG21 THR 5 3HG2 THR 5 -13.337 -3.914 -15.419 31 HG22 THR 5 1HG2 THR 5 -14.859 -4.461 -14.717 32 HG23 THR 5 2HG2 THR 5 -13.580 -3.840 -13.672 33 H GLU 6 H GLU 6 -13.626 -0.680 -17.112 34 HA GLU 6 HA GLU 6 -11.395 -2.167 -18.025 35 HB2 GLU 6 2HB GLU 6 -11.774 -1.174 -20.206 36 HB3 GLU 6 1HB GLU 6 -13.320 -1.600 -19.488 37 HG2 GLU 6 2HG GLU 6 -13.644 0.794 -18.862 38 HG3 GLU 6 1HG GLU 6 -12.129 1.184 -19.674 39 H ASP 7 H ASP 7 -11.796 1.270 -17.122 40 HA ASP 7 HA ASP 7 -9.247 2.153 -17.972 41 HB2 ASP 7 2HB ASP 7 -11.291 3.581 -17.395 42 HB3 ASP 7 1HB ASP 7 -10.879 3.340 -15.705 43 H TRP 8 H TRP 8 -10.447 1.307 -14.734 44 HA TRP 8 HA TRP 8 -8.191 1.150 -13.221 45 HB2 TRP 8 2HB TRP 8 -10.315 0.605 -12.230 46 HB3 TRP 8 1HB TRP 8 -10.545 -0.764 -13.309 47 HD1 TRP 8 HD1 TRP 8 -8.212 0.249 -10.341 48 HE1 TRP 8 HE1 TRP 8 -7.586 -1.886 -9.068 49 HE3 TRP 8 HE3 TRP 8 -10.431 -3.225 -13.391 50 HZ2 TRP 8 HZ2 TRP 8 -7.978 -4.670 -9.290 51 HZ3 TRP 8 HZ3 TRP 8 -10.256 -5.602 -12.774 52 HH2 TRP 8 HH2 TRP 8 -9.053 -6.311 -10.772 53 H GLU 9 H GLU 9 -9.281 -1.278 -15.600 54 HA GLU 9 HA GLU 9 -7.082 -3.064 -15.174 55 HB2 GLU 9 2HB GLU 9 -9.321 -3.759 -16.117 56 HB3 GLU 9 1HB GLU 9 -8.902 -2.924 -17.611 57 HG2 GLU 9 2HG GLU 9 -6.902 -4.433 -17.828 58 HG3 GLU 9 1HG GLU 9 -7.462 -5.316 -16.409 59 H THR 10 H THR 10 -7.551 -0.220 -17.195 60 HA THR 10 HA THR 10 -5.474 -0.698 -19.090 61 HB THR 10 HB THR 10 -6.714 1.957 -18.222 62 HG1 THR 10 HG1 THR 10 -7.861 -0.034 -19.435 63 HG21 THR 10 3HG2 THR 10 -5.144 1.271 -20.748 64 HG22 THR 10 1HG2 THR 10 -4.582 2.308 -19.433 65 HG23 THR 10 2HG2 THR 10 -5.953 2.805 -20.425 66 H GLN 11 H GLN 11 -5.615 1.571 -16.273 67 HA GLN 11 HA GLN 11 -2.874 2.111 -16.096 68 HB2 GLN 11 2HB GLN 11 -3.331 2.973 -13.854 69 HB3 GLN 11 1HB GLN 11 -4.660 3.413 -14.927 70 HG2 GLN 11 2HG GLN 11 -5.984 1.497 -14.028 71 HG3 GLN 11 1HG GLN 11 -4.664 1.132 -12.921 72 HE21 GLN 11 1HE2 GLN 11 -6.016 1.360 -11.140 73 HE22 GLN 11 2HE2 GLN 11 -6.566 2.901 -10.584 74 H LEU 12 H LEU 12 -4.625 -0.709 -15.111 75 HA LEU 12 HA LEU 12 -3.216 -1.599 -12.863 76 HB2 LEU 12 2HB LEU 12 -5.470 -2.362 -13.657 77 HB3 LEU 12 1HB LEU 12 -4.682 -3.277 -14.923 78 HG LEU 12 HG LEU 12 -3.636 -4.737 -13.240 79 HD11 LEU 12 1HD1 LEU 12 -4.225 -4.596 -10.864 80 HD12 LEU 12 2HD1 LEU 12 -5.129 -3.110 -11.156 81 HD13 LEU 12 3HD1 LEU 12 -3.380 -3.145 -11.397 82 HD21 LEU 12 3HD2 LEU 12 -5.664 -5.922 -12.529 83 HD22 LEU 12 1HD2 LEU 12 -5.844 -5.337 -14.178 84 HD23 LEU 12 2HD2 LEU 12 -6.649 -4.493 -12.850 85 H GLN 13 H GLN 13 -2.485 -2.000 -16.299 86 HA GLN 13 HA GLN 13 -0.538 -4.058 -15.959 87 HB2 GLN 13 2HB GLN 13 0.333 -3.337 -18.274 88 HB3 GLN 13 1HB GLN 13 -1.293 -3.966 -18.171 89 HG2 GLN 13 2HG GLN 13 -1.312 -2.180 -19.737 90 HG3 GLN 13 1HG GLN 13 -2.168 -1.643 -18.303 91 HE21 GLN 13 1HE2 GLN 13 0.865 -1.361 -20.087 92 HE22 GLN 13 2HE2 GLN 13 1.296 0.194 -19.467 93 H ALA 14 H ALA 14 -0.334 -0.509 -15.878 94 HA ALA 14 HA ALA 14 2.511 -0.327 -15.651 95 HB1 ALA 14 3HB ALA 14 2.103 2.006 -14.943 96 HB2 ALA 14 1HB ALA 14 0.383 1.653 -14.752 97 HB3 ALA 14 2HB ALA 14 1.121 1.588 -16.354 98 H ASN 15 H ASN 15 -0.151 -0.361 -13.316 99 HA ASN 15 HA ASN 15 1.167 -0.123 -10.893 100 HB2 ASN 15 2HB ASN 15 -1.311 -1.776 -11.549 101 HB3 ASN 15 1HB ASN 15 -0.776 -1.418 -9.909 102 HD21 ASN 15 1HD2 ASN 15 -2.699 -0.294 -9.414 103 HD22 ASN 15 2HD2 ASN 15 -3.048 1.264 -10.066 104 H ARG 16 H ARG 16 1.007 -2.947 -12.994 105 HA ARG 16 HA ARG 16 2.314 -4.633 -10.953 106 HB2 ARG 16 2HB ARG 16 1.678 -6.557 -12.223 107 HB3 ARG 16 1HB ARG 16 0.269 -5.508 -12.147 108 HG2 ARG 16 2HG ARG 16 0.694 -4.752 -14.451 109 HG3 ARG 16 1HG ARG 16 2.139 -5.755 -14.524 110 HD2 ARG 16 2HD ARG 16 0.435 -6.931 -15.694 111 HD3 ARG 16 1HD ARG 16 0.641 -7.768 -14.157 112 HE ARG 16 HE ARG 16 -1.563 -5.868 -14.729 113 HH11 ARG 16 1HH1 ARG 16 -0.450 -8.840 -13.224 114 HH12 ARG 16 2HH1 ARG 16 -2.016 -9.253 -12.612 115 HH21 ARG 16 1HH2 ARG 16 -3.622 -6.480 -13.986 116 HH22 ARG 16 2HH2 ARG 16 -3.812 -7.923 -13.042 117 H ASP 17 H ASP 17 3.002 -3.050 -14.035 118 HA ASP 17 HA ASP 17 5.134 -4.558 -14.992 119 HB2 ASP 17 2HB ASP 17 4.528 -1.601 -15.308 120 HB3 ASP 17 1HB ASP 17 5.969 -2.298 -16.035 121 H GLU 18 H GLU 18 5.669 -1.353 -13.509 122 HA GLU 18 HA GLU 18 8.410 -1.794 -13.041 123 HB2 GLU 18 2HB GLU 18 8.395 0.316 -11.780 124 HB3 GLU 18 1HB GLU 18 7.457 0.461 -13.259 125 HG2 GLU 18 2HG GLU 18 5.366 0.313 -12.017 126 HG3 GLU 18 1HG GLU 18 6.240 0.004 -10.518 127 H LYS 19 H LYS 19 5.626 -2.467 -11.047 128 HA LYS 19 HA LYS 19 6.904 -2.444 -8.501 129 HB2 LYS 19 2HB LYS 19 4.460 -2.074 -8.881 130 HB3 LYS 19 1HB LYS 19 4.287 -3.775 -9.304 131 HG2 LYS 19 2HG LYS 19 5.031 -4.398 -7.018 132 HG3 LYS 19 1HG LYS 19 5.175 -2.690 -6.612 133 HD2 LYS 19 2HD LYS 19 3.095 -3.274 -5.707 134 HD3 LYS 19 1HD LYS 19 2.663 -2.521 -7.237 135 HE2 LYS 19 2HE LYS 19 2.815 -5.513 -6.737 136 HE3 LYS 19 1HE LYS 19 1.338 -4.557 -6.736 137 HZ1 LYS 19 3HZ LYS 19 1.578 -5.684 -8.805 138 HZ2 LYS 19 1HZ LYS 19 3.122 -5.055 -9.051 139 HZ3 LYS 19 2HZ LYS 19 1.777 -4.029 -9.080 140 H ASP 20 H ASP 20 5.839 -5.107 -10.610 141 HA ASP 20 HA ASP 20 6.744 -7.191 -8.877 142 HB2 ASP 20 2HB ASP 20 5.842 -7.212 -11.786 143 HB3 ASP 20 1HB ASP 20 6.273 -8.679 -10.909 144 H ARG 21 H ARG 21 8.154 -5.493 -11.625 145 HA ARG 21 HA ARG 21 10.490 -7.251 -11.756 146 HB2 ARG 21 2HB ARG 21 11.264 -5.936 -13.596 147 HB3 ARG 21 1HB ARG 21 9.529 -6.131 -13.819 148 HG2 ARG 21 2HG ARG 21 9.159 -3.844 -12.959 149 HG3 ARG 21 1HG ARG 21 10.894 -3.653 -12.717 150 HD2 ARG 21 2HD ARG 21 10.222 -2.536 -14.773 151 HD3 ARG 21 1HD ARG 21 11.250 -3.922 -15.149 152 HE ARG 21 HE ARG 21 9.026 -5.130 -15.540 153 HH11 ARG 21 1HH1 ARG 21 9.442 -1.715 -16.267 154 HH12 ARG 21 2HH1 ARG 21 8.237 -1.724 -17.506 155 HH21 ARG 21 1HH2 ARG 21 7.478 -5.121 -17.159 156 HH22 ARG 21 2HH2 ARG 21 7.119 -3.656 -18.014 157 H PHE 22 H PHE 22 9.526 -4.511 -9.917 158 HA PHE 22 HA PHE 22 12.046 -3.423 -9.257 159 HB2 PHE 22 2HB PHE 22 9.762 -2.428 -8.713 160 HB3 PHE 22 1HB PHE 22 9.625 -3.595 -7.409 161 HD1 PHE 22 HD1 PHE 22 11.453 -0.608 -8.616 162 HD2 PHE 22 HD2 PHE 22 10.854 -3.266 -5.322 163 HE1 PHE 22 HE1 PHE 22 12.615 0.966 -7.133 164 HE2 PHE 22 HE2 PHE 22 12.011 -1.683 -3.837 165 HZ PHE 22 HZ PHE 22 12.896 0.436 -4.740 166 H PHE 23 H PHE 23 10.222 -6.184 -8.008 167 HA PHE 23 HA PHE 23 12.154 -6.852 -5.954 168 HB2 PHE 23 2HB PHE 23 9.676 -8.247 -7.027 169 HB3 PHE 23 1HB PHE 23 10.747 -9.037 -5.875 170 HD1 PHE 23 HD2 PHE 23 9.391 -5.498 -6.059 171 HD2 PHE 23 HD1 PHE 23 9.696 -9.114 -3.790 172 HE1 PHE 23 HE2 PHE 23 8.207 -4.435 -4.184 173 HE2 PHE 23 HE1 PHE 23 8.515 -8.041 -1.923 174 HZ PHE 23 HZ PHE 23 7.775 -5.703 -2.111 175 H SER 24 H SER 24 11.466 -7.955 -9.263 176 HA SER 24 HA SER 24 13.221 -10.248 -9.073 177 HB2 SER 24 2HB SER 24 11.753 -9.059 -11.457 178 HB3 SER 24 1HB SER 24 12.612 -10.599 -11.466 179 HG SER 24 HG SER 24 11.034 -10.755 -9.408 180 H GLU 25 H GLU 25 13.449 -7.012 -10.556 181 HA GLU 25 HA GLU 25 16.018 -7.744 -11.839 182 HB2 GLU 25 2HB GLU 25 14.098 -5.508 -12.609 183 HB3 GLU 25 1HB GLU 25 15.560 -5.964 -13.480 184 HG2 GLU 25 2HG GLU 25 13.056 -7.645 -13.144 185 HG3 GLU 25 1HG GLU 25 13.582 -6.826 -14.612 186 H HIS 26 H HIS 26 14.412 -5.106 -10.059 187 HA HIS 26 HA HIS 26 16.767 -3.404 -10.079 188 HB2 HIS 26 2HB HIS 26 14.540 -2.358 -10.163 189 HB3 HIS 26 1HB HIS 26 14.083 -3.117 -8.639 190 HD2 HIS 26 HD2 HIS 26 16.320 -0.152 -9.928 191 HE1 HIS 26 HE1 HIS 26 15.932 0.112 -5.719 192 HE2 HIS 26 HE2 HIS 26 16.621 1.346 -7.827 193 H ARG 27 H ARG 27 14.865 -4.907 -7.489 194 HA ARG 27 HA ARG 27 17.018 -4.502 -5.538 195 HB2 ARG 27 2HB ARG 27 14.011 -4.738 -5.361 196 HB3 ARG 27 1HB ARG 27 14.931 -5.318 -3.982 197 HG2 ARG 27 2HG ARG 27 15.099 -2.513 -5.120 198 HG3 ARG 27 1HG ARG 27 14.146 -2.989 -3.710 199 HD2 ARG 27 2HD ARG 27 16.235 -3.740 -2.585 200 HD3 ARG 27 1HD ARG 27 17.166 -3.186 -3.981 201 HE ARG 27 HE ARG 27 15.728 -1.001 -3.171 202 HH11 ARG 27 1HH1 ARG 27 18.041 -3.118 -1.574 203 HH12 ARG 27 2HH1 ARG 27 18.622 -1.873 -0.519 204 HH21 ARG 27 1HH2 ARG 27 16.513 0.605 -1.812 205 HH22 ARG 27 2HH2 ARG 27 17.746 0.243 -0.661 206 H GLN 28 H GLN 28 17.831 -6.188 -4.290 207 HA GLN 28 HA GLN 28 17.641 -8.899 -4.965 208 HB2 GLN 28 2HB GLN 28 18.594 -9.376 -2.741 209 HB3 GLN 28 1HB GLN 28 19.441 -8.050 -3.511 210 HG2 GLN 28 2HG GLN 28 17.355 -7.682 -1.326 211 HG3 GLN 28 1HG GLN 28 19.084 -7.793 -1.027 212 HE21 GLN 28 1HE2 GLN 28 19.863 -6.147 -3.330 213 HE22 GLN 28 2HE2 GLN 28 19.415 -4.527 -2.942 214 H SER 29 H SER 29 15.785 -10.017 -5.080 215 HA SER 29 HA SER 29 13.341 -9.244 -3.938 216 HB2 SER 29 2HB SER 29 12.628 -11.653 -4.670 217 HB3 SER 29 1HB SER 29 13.175 -10.537 -5.919 218 HG SER 29 HG SER 29 15.152 -12.047 -4.724 219 HA PRO 30 HA PRO 30 13.884 -10.863 0.275 220 HB2 PRO 30 2HB PRO 30 11.309 -10.445 1.152 221 HB3 PRO 30 1HB PRO 30 12.472 -9.115 0.967 222 HG2 PRO 30 2HG PRO 30 10.337 -10.017 -0.948 223 HG3 PRO 30 1HG PRO 30 10.717 -8.370 -0.384 224 HD2 PRO 30 2HD PRO 30 11.604 -9.238 -2.764 225 HD3 PRO 30 1HD PRO 30 12.623 -8.197 -1.742 226 H ILE 31 H ILE 31 11.417 -11.837 -2.018 227 HA ILE 31 HA ILE 31 10.311 -14.110 -0.897 228 HB ILE 31 HB ILE 31 11.009 -13.767 -3.859 229 HG12 ILE 31 2HG1 ILE 31 9.819 -11.745 -2.998 230 HG13 ILE 31 1HG1 ILE 31 8.858 -12.621 -4.178 231 HG21 ILE 31 1HG2 ILE 31 8.793 -15.370 -2.533 232 HG22 ILE 31 2HG2 ILE 31 10.240 -16.029 -3.298 233 HG23 ILE 31 3HG2 ILE 31 9.030 -15.196 -4.276 234 HD11 ILE 31 3HD1 ILE 31 8.469 -12.633 -1.177 235 HD12 ILE 31 1HD1 ILE 31 7.520 -13.580 -2.327 236 HD13 ILE 31 2HD1 ILE 31 7.463 -11.821 -2.375 237 HA PRO 32 HA PRO 32 14.323 -16.286 -0.387 238 HB2 PRO 32 2HB PRO 32 12.521 -18.542 0.509 239 HB3 PRO 32 1HB PRO 32 13.907 -17.808 1.348 240 HG2 PRO 32 2HG PRO 32 11.457 -17.278 2.168 241 HG3 PRO 32 1HG PRO 32 12.669 -15.975 2.089 242 HD2 PRO 32 2HD PRO 32 10.439 -16.593 0.152 243 HD3 PRO 32 1HD PRO 32 10.956 -15.025 0.808 244 HA PRO 33 HA PRO 33 14.947 -18.889 -4.014 245 HB2 PRO 33 2HB PRO 33 16.403 -21.045 -2.909 246 HB3 PRO 33 1HB PRO 33 17.096 -19.499 -3.434 247 HG2 PRO 33 2HG PRO 33 16.290 -20.362 -0.678 248 HG3 PRO 33 1HG PRO 33 17.735 -19.464 -1.203 249 HD2 PRO 33 2HD PRO 33 15.708 -18.169 -0.063 250 HD3 PRO 33 1HD PRO 33 16.548 -17.443 -1.453 251 H GLU 34 H GLU 34 13.653 -20.429 -1.121 252 HA GLU 34 HA GLU 34 12.654 -22.794 -2.435 253 HB2 GLU 34 2HB GLU 34 11.599 -23.282 -0.218 254 HB3 GLU 34 1HB GLU 34 13.330 -22.980 -0.131 255 HG2 GLU 34 2HG GLU 34 12.779 -20.609 0.588 256 HG3 GLU 34 1HG GLU 34 11.094 -21.115 0.701 257 H GLU 35 H GLU 35 11.155 -19.757 -1.226 258 HA GLU 35 HA GLU 35 8.515 -20.339 -2.074 259 HB2 GLU 35 2HB GLU 35 9.957 -17.842 -1.229 260 HB3 GLU 35 1HB GLU 35 8.453 -17.618 -2.106 261 HG2 GLU 35 2HG GLU 35 8.096 -17.528 0.309 262 HG3 GLU 35 1HG GLU 35 7.232 -18.885 -0.410 263 H ARG 36 H ARG 36 11.112 -18.423 -3.729 264 HA ARG 36 HA ARG 36 9.513 -17.782 -5.969 265 HB2 ARG 36 2HB ARG 36 11.461 -16.746 -6.901 266 HB3 ARG 36 1HB ARG 36 11.517 -16.452 -5.168 267 HG2 ARG 36 2HG ARG 36 13.195 -18.246 -4.916 268 HG3 ARG 36 1HG ARG 36 13.119 -18.565 -6.648 269 HD2 ARG 36 2HD ARG 36 15.070 -17.248 -6.323 270 HD3 ARG 36 1HD ARG 36 13.870 -16.143 -6.998 271 HE ARG 36 HE ARG 36 13.658 -15.906 -4.255 272 HH11 ARG 36 1HH1 ARG 36 16.200 -15.345 -6.620 273 HH12 ARG 36 2HH1 ARG 36 16.974 -14.119 -5.670 274 HH21 ARG 36 1HH2 ARG 36 14.727 -14.321 -3.008 275 HH22 ARG 36 2HH2 ARG 36 16.142 -13.545 -3.630 276 H ASP 37 H ASP 37 11.310 -20.588 -5.153 277 HA ASP 37 HA ASP 37 11.865 -21.865 -7.554 278 HB2 ASP 37 2HB ASP 37 12.490 -22.867 -5.434 279 HB3 ASP 37 1HB ASP 37 10.816 -22.927 -4.897 280 H ASP 38 H ASP 38 8.811 -21.940 -5.700 281 HA ASP 38 HA ASP 38 7.361 -23.201 -7.875 282 HB2 ASP 38 2HB ASP 38 6.973 -23.750 -5.451 283 HB3 ASP 38 1HB ASP 38 6.301 -22.136 -5.231 284 H PHE 39 H PHE 39 7.670 -19.948 -6.513 285 HA PHE 39 HA PHE 39 5.633 -18.910 -8.424 286 HB2 PHE 39 2HB PHE 39 6.602 -17.574 -5.852 287 HB3 PHE 39 1HB PHE 39 5.270 -17.048 -6.878 288 HD1 PHE 39 HD2 PHE 39 3.151 -18.432 -6.953 289 HD2 PHE 39 HD1 PHE 39 6.262 -19.264 -4.139 290 HE1 PHE 39 HE2 PHE 39 1.589 -19.781 -5.620 291 HE2 PHE 39 HE1 PHE 39 4.693 -20.617 -2.816 292 HZ PHE 39 HZ PHE 39 2.356 -20.881 -3.552 293 H ASP 40 H ASP 40 6.843 -18.349 -10.191 294 HA ASP 40 HA ASP 40 9.348 -16.838 -9.849 295 HB2 ASP 40 2HB ASP 40 9.598 -17.079 -12.335 296 HB3 ASP 40 1HB ASP 40 9.523 -18.609 -11.478 297 H GLY 41 H GLY 41 8.464 -15.020 -8.960 298 HA2 GLY 41 2HA GLY 41 8.066 -12.731 -10.254 299 HA3 GLY 41 1HA GLY 41 6.450 -13.427 -10.352 300 H LEU 42 H LEU 42 6.684 -11.064 -9.067 301 HA LEU 42 HA LEU 42 7.025 -11.155 -6.256 302 HB2 LEU 42 2HB LEU 42 6.653 -9.133 -7.960 303 HB3 LEU 42 1HB LEU 42 4.963 -9.349 -7.564 304 HG LEU 42 HG LEU 42 7.228 -8.435 -5.759 305 HD11 LEU 42 1HD1 LEU 42 6.182 -6.711 -7.119 306 HD12 LEU 42 2HD1 LEU 42 5.840 -6.448 -5.412 307 HD13 LEU 42 3HD1 LEU 42 4.593 -7.121 -6.467 308 HD21 LEU 42 3HD2 LEU 42 5.973 -10.023 -4.386 309 HD22 LEU 42 1HD2 LEU 42 4.461 -9.195 -4.765 310 HD23 LEU 42 2HD2 LEU 42 5.712 -8.375 -3.824 311 H SER 43 H SER 43 5.924 -12.639 -4.997 312 HA SER 43 HA SER 43 3.202 -13.433 -5.496 313 HB2 SER 43 2HB SER 43 4.936 -13.899 -3.027 314 HB3 SER 43 1HB SER 43 3.465 -14.775 -3.462 315 HG SER 43 HG SER 43 4.644 -15.383 -5.426 316 H TYR 44 H TYR 44 1.499 -12.183 -4.992 317 HA TYR 44 HA TYR 44 1.114 -10.960 -2.421 318 HB2 TYR 44 2HB TYR 44 0.972 -8.604 -3.105 319 HB3 TYR 44 1HB TYR 44 2.568 -9.220 -3.503 320 HD1 TYR 44 HD2 TYR 44 3.013 -9.895 -5.977 321 HD2 TYR 44 HD1 TYR 44 -0.364 -7.554 -4.807 322 HE1 TYR 44 HE2 TYR 44 2.733 -9.146 -8.291 323 HE2 TYR 44 HE1 TYR 44 -0.643 -6.801 -7.126 324 HH TYR 44 HH TYR 44 1.129 -8.190 -9.764 325 H PHE 45 H PHE 45 -0.927 -9.208 -2.970 326 HA PHE 45 HA PHE 45 -3.153 -10.952 -3.442 327 HB2 PHE 45 2HB PHE 45 -2.975 -7.938 -2.998 328 HB3 PHE 45 1HB PHE 45 -4.504 -8.795 -3.176 329 HD1 PHE 45 HD2 PHE 45 -1.426 -8.626 -1.030 330 HD2 PHE 45 HD1 PHE 45 -5.519 -9.842 -1.298 331 HE1 PHE 45 HE2 PHE 45 -1.443 -9.142 1.376 332 HE2 PHE 45 HE1 PHE 45 -5.524 -10.357 1.099 333 HZ PHE 45 HZ PHE 45 -3.489 -10.015 2.439 334 H ASP 46 H ASP 46 -4.261 -11.299 -5.300 335 HA ASP 46 HA ASP 46 -3.288 -10.037 -7.763 336 HB2 ASP 46 2HB ASP 46 -3.339 -12.494 -7.715 337 HB3 ASP 46 1HB ASP 46 -5.043 -12.490 -7.288 338 HA PRO 47 HA PRO 47 -6.465 -6.897 -8.136 339 HB2 PRO 47 2HB PRO 47 -6.728 -8.118 -10.903 340 HB3 PRO 47 1HB PRO 47 -6.681 -6.402 -10.430 341 HG2 PRO 47 2HG PRO 47 -4.510 -7.645 -11.375 342 HG3 PRO 47 1HG PRO 47 -4.399 -6.399 -10.112 343 HD2 PRO 47 2HD PRO 47 -3.955 -9.307 -9.890 344 HD3 PRO 47 1HD PRO 47 -3.441 -8.009 -8.804 345 H ASP 48 H ASP 48 -8.199 -7.301 -6.951 346 HA ASP 48 HA ASP 48 -10.292 -9.165 -7.862 347 HB2 ASP 48 2HB ASP 48 -9.047 -9.948 -5.808 348 HB3 ASP 48 1HB ASP 48 -9.535 -8.479 -4.980 349 HA PRO 49 HA PRO 49 -12.400 -5.232 -8.406 350 HB2 PRO 49 2HB PRO 49 -15.003 -6.193 -8.655 351 HB3 PRO 49 1HB PRO 49 -13.789 -6.246 -9.946 352 HG2 PRO 49 2HG PRO 49 -14.590 -8.412 -8.025 353 HG3 PRO 49 1HG PRO 49 -14.312 -8.507 -9.784 354 HD2 PRO 49 2HD PRO 49 -12.436 -9.329 -8.062 355 HD3 PRO 49 1HD PRO 49 -11.986 -8.484 -9.556 356 H ASP 50 H ASP 50 -13.503 -7.446 -5.866 357 HA ASP 50 HA ASP 50 -15.454 -5.748 -4.671 358 HB2 ASP 50 2HB ASP 50 -14.045 -8.185 -3.507 359 HB3 ASP 50 1HB ASP 50 -15.536 -7.476 -2.903 360 H TYR 51 H TYR 51 -12.061 -5.513 -4.466 361 HA TYR 51 HA TYR 51 -12.255 -4.058 -1.879 362 HB2 TYR 51 2HB TYR 51 -10.018 -5.799 -2.941 363 HB3 TYR 51 1HB TYR 51 -9.696 -4.568 -1.715 364 HD1 TYR 51 HD2 TYR 51 -11.286 -4.587 0.374 365 HD2 TYR 51 HD1 TYR 51 -10.739 -7.974 -2.181 366 HE1 TYR 51 HE2 TYR 51 -12.130 -6.051 2.143 367 HE2 TYR 51 HE1 TYR 51 -11.596 -9.436 -0.405 368 HH TYR 51 HH TYR 51 -13.141 -8.250 2.398 369 H ARG 52 H ARG 52 -12.475 -3.292 -4.845 370 HA ARG 52 HA ARG 52 -10.773 -0.894 -4.672 371 HB2 ARG 52 2HB ARG 52 -11.006 -1.966 -6.899 372 HB3 ARG 52 1HB ARG 52 -12.754 -1.773 -6.830 373 HG2 ARG 52 2HG ARG 52 -12.583 0.617 -6.994 374 HG3 ARG 52 1HG ARG 52 -10.844 0.583 -6.721 375 HD2 ARG 52 2HD ARG 52 -11.206 1.027 -9.042 376 HD3 ARG 52 1HD ARG 52 -10.593 -0.618 -8.925 377 HE ARG 52 HE ARG 52 -13.311 0.228 -9.662 378 HH11 ARG 52 1HH1 ARG 52 -11.030 -2.414 -9.260 379 HH12 ARG 52 2HH1 ARG 52 -11.996 -3.538 -10.156 380 HH21 ARG 52 1HH2 ARG 52 -14.537 -1.242 -10.867 381 HH22 ARG 52 2HH2 ARG 52 -13.985 -2.874 -11.067 382 H VAL 53 H VAL 53 -11.573 0.493 -3.153 383 HA VAL 53 HA VAL 53 -14.460 1.192 -3.240 384 HB VAL 53 HB VAL 53 -14.450 1.727 -0.872 385 HG11 VAL 53 1HG1 VAL 53 -13.189 -1.014 -1.266 386 HG12 VAL 53 2HG1 VAL 53 -14.904 -0.624 -1.401 387 HG13 VAL 53 3HG1 VAL 53 -14.094 -0.494 0.159 388 HG21 VAL 53 3HG2 VAL 53 -11.486 1.009 -0.786 389 HG22 VAL 53 1HG2 VAL 53 -12.486 1.394 0.619 390 HG23 VAL 53 2HG2 VAL 53 -12.171 2.625 -0.603 391 H GLU 54 H GLU 54 -14.984 3.408 -3.124 392 HA GLU 54 HA GLU 54 -12.836 5.262 -3.851 393 HB2 GLU 54 2HB GLU 54 -14.659 6.806 -4.427 394 HB3 GLU 54 1HB GLU 54 -14.885 5.245 -5.200 395 HG2 GLU 54 2HG GLU 54 -16.564 4.653 -3.448 396 HG3 GLU 54 1HG GLU 54 -16.380 6.265 -2.762 397 H ALA 55 H ALA 55 -12.383 7.170 -2.663 398 HA ALA 55 HA ALA 55 -13.271 7.285 0.141 399 HB1 ALA 55 3HB ALA 55 -10.357 6.958 -0.657 400 HB2 ALA 55 1HB ALA 55 -11.360 5.721 0.099 401 HB3 ALA 55 2HB ALA 55 -10.967 7.195 0.985 402 H THR 56 H THR 56 -12.662 9.201 1.237 403 HA THR 56 HA THR 56 -12.117 11.549 -0.472 404 HB THR 56 HB THR 56 -13.260 11.434 2.362 405 HG1 THR 56 HG1 THR 56 -14.639 10.514 0.736 406 HG21 THR 56 3HG2 THR 56 -13.190 13.751 0.383 407 HG22 THR 56 1HG2 THR 56 -12.201 13.624 1.842 408 HG23 THR 56 2HG2 THR 56 -13.953 13.769 1.974 409 H VAL 57 H VAL 57 -10.227 12.588 -0.272 410 HA VAL 57 HA VAL 57 -8.138 11.766 1.519 411 HB VAL 57 HB VAL 57 -8.153 14.182 -0.360 412 HG11 VAL 57 1HG1 VAL 57 -5.814 12.582 0.757 413 HG12 VAL 57 2HG1 VAL 57 -6.301 14.202 1.257 414 HG13 VAL 57 3HG1 VAL 57 -5.696 13.934 -0.376 415 HG21 VAL 57 3HG2 VAL 57 -7.313 11.334 -1.030 416 HG22 VAL 57 1HG2 VAL 57 -7.156 12.741 -2.087 417 HG23 VAL 57 2HG2 VAL 57 -8.755 12.158 -1.628 418 H THR 58 H THR 58 -7.747 12.598 3.482 419 HA THR 58 HA THR 58 -8.724 15.300 4.247 420 HB THR 58 HB THR 58 -8.395 12.811 5.994 421 HG1 THR 58 HG1 THR 58 -10.511 13.941 4.616 422 HG21 THR 58 3HG2 THR 58 -9.355 15.592 6.794 423 HG22 THR 58 1HG2 THR 58 -7.829 14.851 7.285 424 HG23 THR 58 2HG2 THR 58 -9.359 14.168 7.835 425 H VAL 59 H VAL 59 -6.914 16.567 4.003 426 HA VAL 59 HA VAL 59 -4.249 15.388 4.391 427 HB VAL 59 HB VAL 59 -5.153 17.907 2.925 428 HG11 VAL 59 1HG1 VAL 59 -2.779 18.389 2.407 429 HG12 VAL 59 2HG1 VAL 59 -2.266 17.087 3.479 430 HG13 VAL 59 3HG1 VAL 59 -3.083 18.504 4.139 431 HG21 VAL 59 3HG2 VAL 59 -4.080 16.779 0.984 432 HG22 VAL 59 1HG2 VAL 59 -5.370 15.803 1.690 433 HG23 VAL 59 2HG2 VAL 59 -3.683 15.399 2.012 434 H HIS 60 H HIS 60 -3.107 15.802 6.099 435 HA HIS 60 HA HIS 60 -3.926 17.731 8.103 436 HB2 HIS 60 2HB HIS 60 -1.719 15.626 8.044 437 HB3 HIS 60 1HB HIS 60 -2.007 16.706 9.414 438 HD1 HIS 60 HD1 HIS 60 -3.484 13.741 7.642 439 HD2 HIS 60 HD2 HIS 60 -4.363 16.199 10.882 440 HE1 HIS 60 HE1 HIS 60 -5.434 12.667 8.796 441 HE2 HIS 60 HE2 HIS 60 -5.896 14.119 10.796 442 H GLU 61 H GLU 61 -3.534 19.683 7.457 443 HA GLU 61 HA GLU 61 -1.337 20.731 6.012 444 HB2 GLU 61 2HB GLU 61 -2.141 22.954 6.818 445 HB3 GLU 61 1HB GLU 61 -3.415 21.954 6.134 446 HG2 GLU 61 2HG GLU 61 -4.124 21.337 8.454 447 HG3 GLU 61 1HG GLU 61 -2.903 22.442 9.086 448 H THR 62 H THR 62 -1.591 19.837 9.336 449 HA THR 62 HA THR 62 1.132 20.861 9.877 450 HB THR 62 HB THR 62 0.587 20.336 12.292 451 HG1 THR 62 HG1 THR 62 -1.166 19.225 12.705 452 HG21 THR 62 3HG2 THR 62 -1.367 22.257 10.953 453 HG22 THR 62 1HG2 THR 62 0.276 22.646 11.472 454 HG23 THR 62 2HG2 THR 62 -0.953 22.238 12.667 455 HA PRO 63 HA PRO 63 1.526 16.314 8.924 456 HB2 PRO 63 2HB PRO 63 3.855 16.389 7.500 457 HB3 PRO 63 1HB PRO 63 2.297 16.833 6.775 458 HG2 PRO 63 2HG PRO 63 4.475 18.614 7.798 459 HG3 PRO 63 1HG PRO 63 3.472 18.780 6.341 460 HD2 PRO 63 2HD PRO 63 2.994 20.148 8.692 461 HD3 PRO 63 1HD PRO 63 1.739 19.782 7.487 462 H GLU 64 H GLU 64 2.224 15.052 10.566 463 HA GLU 64 HA GLU 64 4.522 15.888 12.218 464 HB2 GLU 64 2HB GLU 64 3.579 14.385 13.946 465 HB3 GLU 64 1HB GLU 64 2.440 15.621 13.429 466 HG2 GLU 64 2HG GLU 64 1.368 13.852 11.934 467 HG3 GLU 64 1HG GLU 64 2.376 12.664 12.764 468 H SER 65 H SER 65 5.802 13.976 13.187 469 HA SER 65 HA SER 65 6.932 12.676 10.797 470 HB2 SER 65 2HB SER 65 8.998 12.542 12.232 471 HB3 SER 65 1HB SER 65 8.414 14.182 11.960 472 HG SER 65 HG SER 65 8.011 12.605 14.289 473 H VAL 66 H VAL 66 6.366 10.607 10.499 474 HA VAL 66 HA VAL 66 6.010 8.759 12.784 475 HB VAL 66 HB VAL 66 4.975 8.436 9.922 476 HG11 VAL 66 1HG1 VAL 66 4.320 6.833 12.427 477 HG12 VAL 66 2HG1 VAL 66 5.279 6.283 11.052 478 HG13 VAL 66 3HG1 VAL 66 3.561 6.621 10.845 479 HG21 VAL 66 3HG2 VAL 66 3.878 10.365 10.949 480 HG22 VAL 66 1HG2 VAL 66 3.463 9.418 12.384 481 HG23 VAL 66 2HG2 VAL 66 2.727 9.035 10.826 482 H ASP 67 H ASP 67 7.598 7.299 13.047 483 HA ASP 67 HA ASP 67 9.792 7.093 11.157 484 HB2 ASP 67 2HB ASP 67 9.315 5.731 13.846 485 HB3 ASP 67 1HB ASP 67 10.791 5.568 12.896 486 H LEU 68 H LEU 68 9.428 5.914 9.421 487 HA LEU 68 HA LEU 68 8.445 3.128 9.670 488 HB2 LEU 68 2HB LEU 68 8.466 4.878 7.158 489 HB3 LEU 68 1HB LEU 68 7.844 3.239 7.280 490 HG LEU 68 HG LEU 68 6.653 5.711 8.598 491 HD11 LEU 68 1HD1 LEU 68 5.567 4.024 6.326 492 HD12 LEU 68 2HD1 LEU 68 6.239 5.650 6.195 493 HD13 LEU 68 3HD1 LEU 68 4.747 5.389 7.092 494 HD21 LEU 68 3HD2 LEU 68 6.318 3.786 10.083 495 HD22 LEU 68 1HD2 LEU 68 5.646 2.839 8.751 496 HD23 LEU 68 2HD2 LEU 68 4.791 4.263 9.350 497 H GLU 69 H GLU 69 9.612 1.942 7.575 498 HA GLU 69 HA GLU 69 12.507 2.579 7.770 499 HB2 GLU 69 2HB GLU 69 13.024 0.251 7.606 500 HB3 GLU 69 1HB GLU 69 11.780 0.414 8.828 501 HG2 GLU 69 2HG GLU 69 10.874 -1.371 7.770 502 HG3 GLU 69 1HG GLU 69 10.195 -0.149 6.708 503 H THR 70 H THR 70 13.759 1.786 5.914 504 HA THR 70 HA THR 70 12.314 1.725 3.331 505 HB THR 70 HB THR 70 13.552 3.928 3.721 506 HG1 THR 70 HG1 THR 70 13.168 3.498 1.639 507 HG21 THR 70 3HG2 THR 70 16.052 2.224 3.398 508 HG22 THR 70 1HG2 THR 70 15.566 3.054 4.881 509 HG23 THR 70 2HG2 THR 70 15.987 3.986 3.445 510 H SER 71 H SER 71 13.595 0.457 1.657 511 HA SER 71 HA SER 71 13.946 -2.112 2.792 512 HB2 SER 71 2HB SER 71 14.433 -2.833 0.415 513 HB3 SER 71 1HB SER 71 12.924 -1.956 0.634 514 HG SER 71 HG SER 71 14.623 -0.102 0.099 515 H ASP 72 H ASP 72 16.433 0.297 1.907 516 HA ASP 72 HA ASP 72 18.670 -1.329 2.447 517 HB2 ASP 72 2HB ASP 72 18.294 1.651 2.953 518 HB3 ASP 72 1HB ASP 72 19.843 0.822 2.957 519 H ASP 73 H ASP 73 16.560 -1.858 4.536 520 HA ASP 73 HA ASP 73 16.268 -2.311 6.706 521 HB2 ASP 73 2HB ASP 73 18.116 -3.375 7.862 522 HB3 ASP 73 1HB ASP 73 18.157 -3.824 6.169 523 H ARG 74 H ARG 74 16.635 0.546 6.111 524 HA ARG 74 HA ARG 74 18.037 1.645 8.476 525 HB2 ARG 74 2HB ARG 74 18.628 2.330 6.065 526 HB3 ARG 74 1HB ARG 74 17.054 3.098 5.975 527 HG2 ARG 74 2HG ARG 74 17.760 4.605 7.876 528 HG3 ARG 74 1HG ARG 74 19.367 3.875 7.786 529 HD2 ARG 74 2HD ARG 74 17.965 5.500 5.628 530 HD3 ARG 74 1HD ARG 74 19.403 5.954 6.545 531 HE ARG 74 HE ARG 74 20.491 3.960 5.412 532 HH11 ARG 74 1HH1 ARG 74 17.960 5.814 3.821 533 HH12 ARG 74 2HH1 ARG 74 18.510 5.416 2.230 534 HH21 ARG 74 1HH2 ARG 74 21.170 3.421 3.308 535 HH22 ARG 74 2HH2 ARG 74 20.325 4.065 1.939 536 H THR 75 H THR 75 16.940 3.698 9.345 537 HA THR 75 HA THR 75 13.990 3.405 9.443 538 HB THR 75 HB THR 75 15.700 4.614 11.679 539 HG1 THR 75 HG1 THR 75 14.893 2.005 11.151 540 HG21 THR 75 3HG2 THR 75 13.403 5.518 11.617 541 HG22 THR 75 1HG2 THR 75 13.572 4.427 12.995 542 HG23 THR 75 2HG2 THR 75 12.732 3.887 11.536 543 H VAL 76 H VAL 76 12.923 5.130 8.723 544 HA VAL 76 HA VAL 76 14.333 7.622 8.111 545 HB VAL 76 HB VAL 76 13.275 7.617 5.793 546 HG11 VAL 76 1HG1 VAL 76 15.023 6.200 4.751 547 HG12 VAL 76 2HG1 VAL 76 15.356 5.456 6.317 548 HG13 VAL 76 3HG1 VAL 76 15.674 7.173 6.072 549 HG21 VAL 76 3HG2 VAL 76 12.604 5.461 4.791 550 HG22 VAL 76 1HG2 VAL 76 11.568 5.867 6.161 551 HG23 VAL 76 2HG2 VAL 76 12.835 4.652 6.343 552 H ARG 77 H ARG 77 13.176 9.352 8.414 553 HA ARG 77 HA ARG 77 10.595 9.248 9.658 554 HB2 ARG 77 2HB ARG 77 12.310 10.830 10.397 555 HB3 ARG 77 1HB ARG 77 12.396 11.562 8.808 556 HG2 ARG 77 2HG ARG 77 9.774 11.671 10.291 557 HG3 ARG 77 1HG ARG 77 11.093 12.714 10.817 558 HD2 ARG 77 2HD ARG 77 9.917 12.661 8.011 559 HD3 ARG 77 1HD ARG 77 9.576 13.870 9.250 560 HE ARG 77 HE ARG 77 11.887 14.580 9.120 561 HH11 ARG 77 1HH1 ARG 77 10.842 12.574 6.433 562 HH12 ARG 77 2HH1 ARG 77 12.097 13.137 5.383 563 HH21 ARG 77 1HH2 ARG 77 13.522 15.287 7.721 564 HH22 ARG 77 2HH2 ARG 77 13.609 14.666 6.106 565 H TYR 78 H TYR 78 8.752 9.154 8.609 566 HA TYR 78 HA TYR 78 8.350 10.488 5.999 567 HB2 TYR 78 2HB TYR 78 6.805 8.338 7.498 568 HB3 TYR 78 1HB TYR 78 6.027 9.285 6.234 569 HD1 TYR 78 HD2 TYR 78 9.285 7.397 6.649 570 HD2 TYR 78 HD1 TYR 78 5.927 8.229 4.139 571 HE1 TYR 78 HE2 TYR 78 10.141 5.841 4.953 572 HE2 TYR 78 HE1 TYR 78 6.790 6.670 2.459 573 HH TYR 78 HH TYR 78 9.290 4.466 3.091 574 H LEU 79 H LEU 79 6.645 11.982 5.804 575 HA LEU 79 HA LEU 79 5.647 13.225 8.295 576 HB2 LEU 79 2HB LEU 79 5.918 14.322 5.463 577 HB3 LEU 79 1HB LEU 79 5.095 15.175 6.763 578 HG LEU 79 HG LEU 79 8.037 14.393 6.805 579 HD11 LEU 79 1HD1 LEU 79 8.540 16.764 6.462 580 HD12 LEU 79 2HD1 LEU 79 6.818 17.125 6.311 581 HD13 LEU 79 3HD1 LEU 79 7.618 16.110 5.109 582 HD21 LEU 79 3HD2 LEU 79 6.444 16.110 8.752 583 HD22 LEU 79 1HD2 LEU 79 8.192 15.847 8.801 584 HD23 LEU 79 2HD2 LEU 79 7.093 14.500 9.070 585 H HIS 80 H HIS 80 3.529 13.112 8.742 586 HA HIS 80 HA HIS 80 1.778 11.504 7.109 587 HB2 HIS 80 2HB HIS 80 1.773 11.378 9.606 588 HB3 HIS 80 1HB HIS 80 1.205 13.044 9.687 589 HD2 HIS 80 HD2 HIS 80 -0.366 10.446 7.211 590 HE1 HIS 80 HE1 HIS 80 -3.179 11.380 10.222 591 HE2 HIS 80 HE2 HIS 80 -2.811 10.206 8.009 592 H VAL 81 H VAL 81 1.249 12.505 5.284 593 HA VAL 81 HA VAL 81 0.674 15.361 5.190 594 HB VAL 81 HB VAL 81 0.607 15.105 2.741 595 HG11 VAL 81 1HG1 VAL 81 2.783 15.500 3.770 596 HG12 VAL 81 2HG1 VAL 81 2.975 14.443 2.371 597 HG13 VAL 81 3HG1 VAL 81 3.032 13.767 4.001 598 HG21 VAL 81 3HG2 VAL 81 -0.417 12.848 2.614 599 HG22 VAL 81 1HG2 VAL 81 1.087 12.127 3.192 600 HG23 VAL 81 2HG2 VAL 81 1.037 12.947 1.630 601 H ALA 82 H ALA 82 -1.047 12.282 4.909 602 HA ALA 82 HA ALA 82 -3.627 13.660 4.860 603 HB1 ALA 82 3HB ALA 82 -4.406 12.567 2.785 604 HB2 ALA 82 1HB ALA 82 -2.809 11.848 2.550 605 HB3 ALA 82 2HB ALA 82 -3.011 13.597 2.462 606 H THR 83 H THR 83 -5.420 12.172 5.022 607 HA THR 83 HA THR 83 -4.868 9.364 5.619 608 HB THR 83 HB THR 83 -6.737 11.089 7.329 609 HG1 THR 83 HG1 THR 83 -5.041 10.317 8.946 610 HG21 THR 83 3HG2 THR 83 -5.889 8.173 7.630 611 HG22 THR 83 1HG2 THR 83 -7.483 8.722 7.100 612 HG23 THR 83 2HG2 THR 83 -6.931 9.065 8.740 613 H LEU 84 H LEU 84 -5.899 8.403 4.049 614 HA LEU 84 HA LEU 84 -8.141 9.503 2.614 615 HB2 LEU 84 2HB LEU 84 -7.035 6.671 2.384 616 HB3 LEU 84 1HB LEU 84 -7.881 7.602 1.154 617 HG LEU 84 HG LEU 84 -5.040 8.065 2.156 618 HD11 LEU 84 1HD1 LEU 84 -6.024 7.171 -0.567 619 HD12 LEU 84 2HD1 LEU 84 -5.227 6.163 0.642 620 HD13 LEU 84 3HD1 LEU 84 -4.342 7.481 -0.120 621 HD21 LEU 84 3HD2 LEU 84 -6.561 9.723 0.109 622 HD22 LEU 84 1HD2 LEU 84 -4.839 9.865 0.475 623 HD23 LEU 84 2HD2 LEU 84 -6.034 10.255 1.708 624 H SER 85 H SER 85 -9.960 9.585 3.817 625 HA SER 85 HA SER 85 -10.769 7.456 5.650 626 HB2 SER 85 2HB SER 85 -10.882 9.867 6.328 627 HB3 SER 85 1HB SER 85 -12.055 10.164 5.048 628 HG SER 85 HG SER 85 -12.434 9.170 7.528 629 H PHE 86 H PHE 86 -12.491 6.116 5.295 630 HA PHE 86 HA PHE 86 -14.382 6.393 3.123 631 HB2 PHE 86 2HB PHE 86 -13.693 4.252 1.973 632 HB3 PHE 86 1HB PHE 86 -12.510 5.536 1.811 633 HD1 PHE 86 HD1 PHE 86 -10.316 5.385 2.921 634 HD2 PHE 86 HD2 PHE 86 -13.152 2.209 3.283 635 HE1 PHE 86 HE1 PHE 86 -8.562 3.908 3.774 636 HE2 PHE 86 HE2 PHE 86 -11.386 0.737 4.141 637 HZ PHE 86 HZ PHE 86 -9.087 1.583 4.391 638 H ASP 87 H ASP 87 -15.442 3.978 2.924 639 HA ASP 87 HA ASP 87 -15.743 2.805 5.634 640 HB2 ASP 87 2HB ASP 87 -18.047 2.273 5.162 641 HB3 ASP 87 1HB ASP 87 -17.823 3.980 4.821 642 H LEU 88 H LEU 88 -15.678 0.548 5.762 643 HA LEU 88 HA LEU 88 -15.477 -1.100 3.380 644 HB2 LEU 88 2HB LEU 88 -13.119 -0.329 3.741 645 HB3 LEU 88 1HB LEU 88 -13.160 -1.000 5.363 646 HG LEU 88 HG LEU 88 -13.532 -3.289 4.336 647 HD11 LEU 88 1HD1 LEU 88 -14.465 -2.619 2.175 648 HD12 LEU 88 2HD1 LEU 88 -13.038 -3.624 1.944 649 HD13 LEU 88 3HD1 LEU 88 -12.929 -1.877 1.713 650 HD21 LEU 88 3HD2 LEU 88 -10.967 -1.886 3.520 651 HD22 LEU 88 1HD2 LEU 88 -11.196 -3.631 3.659 652 HD23 LEU 88 2HD2 LEU 88 -11.299 -2.615 5.094 653 H ASP 89 H ASP 89 -16.029 -3.178 3.764 654 HA ASP 89 HA ASP 89 -16.898 -5.012 4.659 655 HB2 ASP 89 2HB ASP 89 -14.956 -5.024 6.210 656 HB3 ASP 89 1HB ASP 89 -15.862 -4.043 7.361 657 H GLY 90 H GLY 90 -17.486 -2.746 7.335 658 HA2 GLY 90 2HA GLY 90 -20.255 -2.309 6.700 659 HA3 GLY 90 1HA GLY 90 -20.037 -3.422 8.047 660 H GLU 91 H GLU 91 -17.541 -1.115 7.808 661 HA GLU 91 HA GLU 91 -18.764 0.799 9.663 662 HB2 GLU 91 2HB GLU 91 -16.878 0.615 11.247 663 HB3 GLU 91 1HB GLU 91 -17.731 -0.919 11.110 664 HG2 GLU 91 2HG GLU 91 -15.961 -1.802 9.647 665 HG3 GLU 91 1HG GLU 91 -15.122 -0.253 9.699 666 H SER 92 H SER 92 -17.390 2.711 10.014 667 HA SER 92 HA SER 92 -16.086 3.713 7.668 668 HB2 SER 92 2HB SER 92 -17.322 5.212 9.186 669 HB3 SER 92 1HB SER 92 -16.233 4.815 10.516 670 HG SER 92 HG SER 92 -15.957 6.674 8.600 671 H ARG 93 H ARG 93 -13.990 3.484 7.117 672 HA ARG 93 HA ARG 93 -11.932 2.765 9.099 673 HB2 ARG 93 2HB ARG 93 -12.425 1.489 6.383 674 HB3 ARG 93 1HB ARG 93 -10.910 1.317 7.247 675 HG2 ARG 93 2HG ARG 93 -13.593 0.355 8.298 676 HG3 ARG 93 1HG ARG 93 -12.424 -0.653 7.443 677 HD2 ARG 93 2HD ARG 93 -12.051 -1.105 9.736 678 HD3 ARG 93 1HD ARG 93 -10.745 -0.005 9.287 679 HE ARG 93 HE ARG 93 -13.218 0.890 10.643 680 HH11 ARG 93 1HH1 ARG 93 -9.675 0.948 10.519 681 HH12 ARG 93 2HH1 ARG 93 -9.554 2.088 11.820 682 HH21 ARG 93 1HH2 ARG 93 -12.997 2.395 12.298 683 HH22 ARG 93 2HH2 ARG 93 -11.427 2.902 12.823 684 H ASP 94 H ASP 94 -9.897 3.662 8.709 685 HA ASP 94 HA ASP 94 -9.619 5.547 6.444 686 HB2 ASP 94 2HB ASP 94 -8.771 7.289 7.939 687 HB3 ASP 94 1HB ASP 94 -10.386 6.810 8.434 688 H LEU 95 H LEU 95 -7.581 5.764 5.637 689 HA LEU 95 HA LEU 95 -5.377 4.185 6.854 690 HB2 LEU 95 2HB LEU 95 -5.962 4.513 3.881 691 HB3 LEU 95 1HB LEU 95 -4.506 3.782 4.542 692 HG LEU 95 HG LEU 95 -7.329 2.699 4.657 693 HD11 LEU 95 1HD1 LEU 95 -6.396 0.773 3.470 694 HD12 LEU 95 2HD1 LEU 95 -4.803 1.536 3.456 695 HD13 LEU 95 3HD1 LEU 95 -6.142 2.267 2.568 696 HD21 LEU 95 3HD2 LEU 95 -6.466 0.806 5.990 697 HD22 LEU 95 1HD2 LEU 95 -6.381 2.331 6.866 698 HD23 LEU 95 2HD2 LEU 95 -4.919 1.637 6.163 699 H HIS 96 H HIS 96 -3.446 5.175 6.987 700 HA HIS 96 HA HIS 96 -3.466 8.080 6.564 701 HB2 HIS 96 2HB HIS 96 -1.639 6.302 8.234 702 HB3 HIS 96 1HB HIS 96 -1.584 8.065 8.182 703 HD2 HIS 96 HD2 HIS 96 -4.289 5.330 9.202 704 HE1 HIS 96 HE1 HIS 96 -4.763 8.790 11.576 705 HE2 HIS 96 HE2 HIS 96 -5.779 6.581 10.896 706 H ALA 97 H ALA 97 -2.327 8.974 5.033 707 HA ALA 97 HA ALA 97 -0.500 7.395 3.356 708 HB1 ALA 97 3HB ALA 97 -2.447 8.369 2.207 709 HB2 ALA 97 1HB ALA 97 -0.952 9.117 1.641 710 HB3 ALA 97 2HB ALA 97 -2.000 9.981 2.771 711 H PHE 98 H PHE 98 1.597 7.824 3.506 712 HA PHE 98 HA PHE 98 2.513 10.428 4.608 713 HB2 PHE 98 2HB PHE 98 4.135 7.867 4.920 714 HB3 PHE 98 1HB PHE 98 4.253 9.379 5.810 715 HD1 PHE 98 HD1 PHE 98 2.629 9.877 7.632 716 HD2 PHE 98 HD2 PHE 98 2.666 6.098 5.643 717 HE1 PHE 98 HE1 PHE 98 1.324 8.898 9.461 718 HE2 PHE 98 HE2 PHE 98 1.363 5.128 7.486 719 HZ PHE 98 HZ PHE 98 0.686 6.525 9.388 720 H ARG 99 H ARG 99 4.634 11.026 3.998 721 HA ARG 99 HA ARG 99 5.755 10.003 1.485 722 HB2 ARG 99 2HB ARG 99 4.964 12.945 1.867 723 HB3 ARG 99 1HB ARG 99 5.741 12.252 0.444 724 HG2 ARG 99 2HG ARG 99 3.749 11.025 -0.135 725 HG3 ARG 99 1HG ARG 99 2.996 11.420 1.404 726 HD2 ARG 99 2HD ARG 99 1.919 12.866 0.003 727 HD3 ARG 99 1HD ARG 99 3.229 13.888 0.582 728 HE ARG 99 HE ARG 99 4.223 12.798 -1.717 729 HH11 ARG 99 1HH1 ARG 99 1.259 14.554 -0.994 730 HH12 ARG 99 2HH1 ARG 99 1.127 15.224 -2.587 731 HH21 ARG 99 1HH2 ARG 99 4.044 13.686 -3.791 732 HH22 ARG 99 2HH2 ARG 99 2.706 14.729 -4.170 733 H GLN 100 H GLN 100 8.020 10.307 1.513 734 HA GLN 100 HA GLN 100 9.280 10.247 3.938 735 HB2 GLN 100 2HB GLN 100 10.271 10.819 1.153 736 HB3 GLN 100 1HB GLN 100 11.411 10.950 2.479 737 HG2 GLN 100 2HG GLN 100 9.789 8.433 2.167 738 HG3 GLN 100 1HG GLN 100 11.184 8.705 1.133 739 HE21 GLN 100 1HE2 GLN 100 11.083 9.760 4.535 740 HE22 GLN 100 2HE2 GLN 100 12.268 8.649 5.082 741 H ALA 101 H ALA 101 10.127 13.050 1.840 742 HA ALA 101 HA ALA 101 9.901 14.814 4.225 743 HB1 ALA 101 3HB ALA 101 11.886 15.073 1.932 744 HB2 ALA 101 1HB ALA 101 12.254 14.474 3.551 745 HB3 ALA 101 2HB ALA 101 11.758 16.150 3.326 746 H ALA 102 H ALA 102 10.311 15.414 0.730 747 HA ALA 102 HA ALA 102 7.897 17.116 0.675 748 HB1 ALA 102 3HB ALA 102 10.631 17.776 -0.499 749 HB2 ALA 102 1HB ALA 102 9.952 18.488 0.967 750 HB3 ALA 102 2HB ALA 102 9.187 18.790 -0.593 751 H ASP 103 H ASP 103 7.780 14.484 -0.197 752 HA ASP 103 HA ASP 103 8.633 13.702 -2.673 753 HB2 ASP 103 2HB ASP 103 7.535 12.139 -1.205 754 HB3 ASP 103 1HB ASP 103 6.033 13.050 -1.244 755 H GLU 104 H GLU 104 8.419 14.466 -4.605 756 HA GLU 104 HA GLU 104 6.117 16.068 -5.507 757 HB2 GLU 104 2HB GLU 104 8.842 15.559 -6.781 758 HB3 GLU 104 1HB GLU 104 7.649 16.734 -7.330 759 HG2 GLU 104 2HG GLU 104 7.951 18.071 -5.335 760 HG3 GLU 104 1HG GLU 104 8.973 16.840 -4.600 761 H SER 105 H SER 105 7.192 12.862 -5.543 762 HA SER 105 HA SER 105 6.519 12.154 -8.283 763 HB2 SER 105 2HB SER 105 7.424 10.445 -5.931 764 HB3 SER 105 1HB SER 105 7.273 9.877 -7.596 765 HG SER 105 HG SER 105 9.136 10.726 -8.010 766 H ARG 106 H ARG 106 4.409 12.898 -6.030 767 HA ARG 106 HA ARG 106 2.179 12.519 -5.671 768 HB2 ARG 106 2HB ARG 106 2.270 10.558 -7.999 769 HB3 ARG 106 1HB ARG 106 0.842 11.352 -7.355 770 HG2 ARG 106 2HG ARG 106 3.122 12.796 -8.743 771 HG3 ARG 106 1HG ARG 106 1.664 12.244 -9.560 772 HD2 ARG 106 2HD ARG 106 1.337 14.557 -9.158 773 HD3 ARG 106 1HD ARG 106 0.362 13.735 -7.944 774 HE ARG 106 HE ARG 106 1.961 14.344 -6.275 775 HH11 ARG 106 1HH1 ARG 106 2.479 15.974 -9.348 776 HH12 ARG 106 2HH1 ARG 106 3.433 17.237 -8.646 777 HH21 ARG 106 1HH2 ARG 106 3.201 16.029 -5.380 778 HH22 ARG 106 2HH2 ARG 106 3.839 17.267 -6.402 779 H THR 107 H THR 107 4.373 10.590 -4.634 780 HA THR 107 HA THR 107 3.118 7.980 -4.583 781 HB THR 107 HB THR 107 5.759 8.947 -3.400 782 HG1 THR 107 HG1 THR 107 5.012 8.611 -5.938 783 HG21 THR 107 3HG2 THR 107 6.416 6.572 -3.399 784 HG22 THR 107 1HG2 THR 107 4.821 6.115 -3.998 785 HG23 THR 107 2HG2 THR 107 4.992 6.809 -2.387 786 H LEU 108 H LEU 108 1.373 8.088 -3.271 787 HA LEU 108 HA LEU 108 1.553 8.978 -0.477 788 HB2 LEU 108 2HB LEU 108 -0.807 7.898 -2.079 789 HB3 LEU 108 1HB LEU 108 -0.894 8.540 -0.444 790 HG LEU 108 HG LEU 108 -0.198 10.128 -2.946 791 HD11 LEU 108 1HD1 LEU 108 -2.701 10.190 -1.233 792 HD12 LEU 108 2HD1 LEU 108 -2.565 9.522 -2.861 793 HD13 LEU 108 3HD1 LEU 108 -2.357 11.252 -2.604 794 HD21 LEU 108 3HD2 LEU 108 1.027 11.016 -1.012 795 HD22 LEU 108 1HD2 LEU 108 -0.470 11.109 -0.078 796 HD23 LEU 108 2HD2 LEU 108 -0.244 12.130 -1.501 797 H PHE 109 H PHE 109 2.382 7.490 0.878 798 HA PHE 109 HA PHE 109 2.207 4.611 0.268 799 HB2 PHE 109 2HB PHE 109 4.442 5.612 0.738 800 HB3 PHE 109 1HB PHE 109 3.877 6.145 2.316 801 HD1 PHE 109 HD1 PHE 109 4.380 3.042 0.266 802 HD2 PHE 109 HD2 PHE 109 4.193 4.717 4.197 803 HE1 PHE 109 HE1 PHE 109 5.107 0.902 1.219 804 HE2 PHE 109 HE2 PHE 109 4.924 2.569 5.144 805 HZ PHE 109 HZ PHE 109 5.382 0.656 3.657 806 H VAL 110 H VAL 110 0.398 3.649 1.119 807 HA VAL 110 HA VAL 110 -0.560 4.510 3.794 808 HB VAL 110 HB VAL 110 -2.831 3.625 3.192 809 HG11 VAL 110 1HG1 VAL 110 -2.386 6.030 3.062 810 HG12 VAL 110 2HG1 VAL 110 -3.533 5.542 1.818 811 HG13 VAL 110 3HG1 VAL 110 -1.853 5.868 1.385 812 HG21 VAL 110 3HG2 VAL 110 -1.754 3.420 0.345 813 HG22 VAL 110 1HG2 VAL 110 -3.449 3.248 0.819 814 HG23 VAL 110 2HG2 VAL 110 -2.255 2.071 1.365 815 HA PRO 111 HA PRO 111 0.507 0.179 4.895 816 HB2 PRO 111 2HB PRO 111 0.401 1.397 7.637 817 HB3 PRO 111 1HB PRO 111 1.681 0.418 6.894 818 HG2 PRO 111 2HG PRO 111 2.014 3.045 7.328 819 HG3 PRO 111 1HG PRO 111 2.713 2.230 5.907 820 HD2 PRO 111 2HD PRO 111 0.232 3.937 6.068 821 HD3 PRO 111 1HD PRO 111 1.507 3.909 4.826 822 H PHE 112 H PHE 112 -1.156 -1.238 5.393 823 HA PHE 112 HA PHE 112 -3.320 -0.366 7.149 824 HB2 PHE 112 2HB PHE 112 -5.130 -1.054 5.774 825 HB3 PHE 112 1HB PHE 112 -4.111 -0.094 4.726 826 HD1 PHE 112 HD1 PHE 112 -2.809 -1.200 2.884 827 HD2 PHE 112 HD2 PHE 112 -5.554 -3.399 5.317 828 HE1 PHE 112 HE1 PHE 112 -2.865 -3.004 1.225 829 HE2 PHE 112 HE2 PHE 112 -5.600 -5.198 3.650 830 HZ PHE 112 HZ PHE 112 -4.254 -5.003 1.598 831 H ARG 113 H ARG 113 -3.582 -1.904 8.713 832 HA ARG 113 HA ARG 113 -2.622 -4.644 8.107 833 HB2 ARG 113 2HB ARG 113 -1.426 -3.512 9.978 834 HB3 ARG 113 1HB ARG 113 -2.958 -3.334 10.839 835 HG2 ARG 113 2HG ARG 113 -3.213 -5.780 10.925 836 HG3 ARG 113 1HG ARG 113 -1.715 -5.982 10.015 837 HD2 ARG 113 2HD ARG 113 -0.492 -4.865 11.887 838 HD3 ARG 113 1HD ARG 113 -2.005 -4.831 12.804 839 HE ARG 113 HE ARG 113 -1.856 -7.417 12.237 840 HH11 ARG 113 1HH1 ARG 113 0.678 -5.297 13.374 841 HH12 ARG 113 2HH1 ARG 113 1.533 -6.558 14.199 842 HH21 ARG 113 1HH2 ARG 113 -0.719 -9.082 13.313 843 HH22 ARG 113 2HH2 ARG 113 0.740 -8.706 14.166 844 H ASP 114 H ASP 114 -4.156 -6.248 8.033 845 HA ASP 114 HA ASP 114 -6.876 -5.622 8.970 846 HB2 ASP 114 2HB ASP 114 -7.825 -6.573 6.983 847 HB3 ASP 114 1HB ASP 114 -6.570 -5.470 6.432 848 H LYS 115 H LYS 115 -8.020 -8.114 8.561 849 HA LYS 115 HA LYS 115 -6.846 -9.421 10.904 850 HB2 LYS 115 2HB LYS 115 -9.543 -9.923 9.603 851 HB3 LYS 115 1HB LYS 115 -9.007 -10.543 11.163 852 HG2 LYS 115 2HG LYS 115 -9.582 -7.660 10.428 853 HG3 LYS 115 1HG LYS 115 -10.502 -8.685 11.526 854 HD2 LYS 115 2HD LYS 115 -7.659 -7.712 11.987 855 HD3 LYS 115 1HD LYS 115 -9.114 -7.021 12.705 856 HE2 LYS 115 2HE LYS 115 -9.555 -9.073 13.917 857 HE3 LYS 115 1HE LYS 115 -8.215 -9.883 13.106 858 HZ1 LYS 115 3HZ LYS 115 -6.708 -8.267 14.173 859 HZ2 LYS 115 1HZ LYS 115 -7.546 -9.227 15.285 860 HZ3 LYS 115 2HZ LYS 115 -8.022 -7.631 15.022 861 H THR 116 H THR 116 -6.907 -10.083 7.497 862 HA THR 116 HA THR 116 -6.592 -12.907 7.627 863 HB THR 116 HB THR 116 -5.363 -12.794 5.483 864 HG1 THR 116 HG1 THR 116 -5.627 -10.081 5.139 865 HG21 THR 116 3HG2 THR 116 -7.817 -12.698 5.384 866 HG22 THR 116 1HG2 THR 116 -7.092 -11.743 4.087 867 HG23 THR 116 2HG2 THR 116 -7.761 -10.935 5.506 868 H THR 117 H THR 117 -4.469 -10.220 8.294 869 HA THR 117 HA THR 117 -1.951 -11.544 8.266 870 HB THR 117 HB THR 117 -2.794 -8.997 9.742 871 HG1 THR 117 HG1 THR 117 -3.082 -8.792 7.505 872 HG21 THR 117 3HG2 THR 117 -0.004 -9.965 8.994 873 HG22 THR 117 1HG2 THR 117 -0.658 -9.862 10.631 874 HG23 THR 117 2HG2 THR 117 -0.392 -8.391 9.693 875 H GLY 118 H GLY 118 -1.041 -12.781 9.808 876 HA2 GLY 118 2HA GLY 118 -0.775 -14.132 11.629 877 HA3 GLY 118 1HA GLY 118 -1.529 -12.855 12.560 878 H GLN 119 H GLN 119 -3.502 -14.264 10.086 879 HA GLN 119 HA GLN 119 -4.634 -16.264 11.958 880 HB2 GLN 119 2HB GLN 119 -6.248 -14.398 10.158 881 HB3 GLN 119 1HB GLN 119 -6.924 -15.753 11.052 882 HG2 GLN 119 2HG GLN 119 -5.642 -13.283 12.261 883 HG3 GLN 119 1HG GLN 119 -7.371 -13.602 12.165 884 HE21 GLN 119 1HE2 GLN 119 -5.770 -13.075 14.520 885 HE22 GLN 119 2HE2 GLN 119 -5.938 -14.444 15.554 886 H GLN 120 H GLN 120 -5.596 -15.437 8.614 887 HA GLN 120 HA GLN 120 -4.804 -18.153 7.759 888 HB2 GLN 120 2HB GLN 120 -6.274 -17.855 5.814 889 HB3 GLN 120 1HB GLN 120 -7.155 -17.617 7.308 890 HG2 GLN 120 2HG GLN 120 -6.119 -15.190 5.872 891 HG3 GLN 120 1HG GLN 120 -7.500 -16.040 5.189 892 HE21 GLN 120 1HE2 GLN 120 -8.972 -14.374 5.569 893 HE22 GLN 120 2HE2 GLN 120 -9.478 -13.915 7.156 894 H SER 121 H SER 121 -3.099 -15.674 8.087 895 HA SER 121 HA SER 121 -1.546 -15.890 5.642 896 HB2 SER 121 2HB SER 121 -2.427 -13.121 6.598 897 HB3 SER 121 1HB SER 121 -1.404 -13.476 5.205 898 HG SER 121 HG SER 121 -3.470 -14.798 4.625 899 H TYR 122 H TYR 122 0.567 -14.787 5.897 900 HA TYR 122 HA TYR 122 1.974 -15.222 8.219 901 HB2 TYR 122 2HB TYR 122 3.647 -13.494 7.289 902 HB3 TYR 122 1HB TYR 122 3.226 -14.827 6.224 903 HD1 TYR 122 HD2 TYR 122 2.407 -11.214 6.891 904 HD2 TYR 122 HD1 TYR 122 2.425 -14.369 4.006 905 HE1 TYR 122 HE2 TYR 122 1.747 -9.632 5.148 906 HE2 TYR 122 HE1 TYR 122 1.768 -12.774 2.261 907 HH TYR 122 HH TYR 122 0.690 -10.610 2.044 908 H ASP 123 H ASP 123 2.624 -14.006 9.968 909 HA ASP 123 HA ASP 123 0.762 -11.917 10.864 910 HB2 ASP 123 2HB ASP 123 1.210 -13.936 12.275 911 HB3 ASP 123 1HB ASP 123 2.897 -13.453 12.417 912 H GLY 124 H GLY 124 3.089 -11.536 8.913 913 HA2 GLY 124 2HA GLY 124 4.921 -9.734 10.190 914 HA3 GLY 124 1HA GLY 124 4.776 -10.064 8.470 915 H GLY 125 H GLY 125 4.673 -8.108 7.629 916 HA2 GLY 125 2HA GLY 125 2.937 -6.015 8.751 917 HA3 GLY 125 1HA GLY 125 4.142 -5.816 7.482 918 H ARG 126 H ARG 126 1.592 -4.765 7.224 919 HA ARG 126 HA ARG 126 0.974 -5.968 4.634 920 HB2 ARG 126 2HB ARG 126 -0.671 -6.911 6.338 921 HB3 ARG 126 1HB ARG 126 -1.220 -5.270 6.645 922 HG2 ARG 126 2HG ARG 126 -2.762 -6.419 5.137 923 HG3 ARG 126 1HG ARG 126 -1.981 -5.074 4.297 924 HD2 ARG 126 2HD ARG 126 -2.154 -7.180 2.928 925 HD3 ARG 126 1HD ARG 126 -0.501 -6.585 3.122 926 HE ARG 126 HE ARG 126 0.037 -8.444 4.336 927 HH11 ARG 126 1HH1 ARG 126 -3.468 -8.311 4.094 928 HH12 ARG 126 2HH1 ARG 126 -3.698 -9.885 4.757 929 HH21 ARG 126 1HH2 ARG 126 -0.346 -10.548 5.272 930 HH22 ARG 126 2HH2 ARG 126 -1.965 -11.136 5.416 931 H TYR 127 H TYR 127 0.622 -4.376 3.103 932 HA TYR 127 HA TYR 127 -0.113 -1.675 3.808 933 HB2 TYR 127 2HB TYR 127 1.986 -0.577 3.263 934 HB3 TYR 127 1HB TYR 127 2.281 -1.778 4.515 935 HD1 TYR 127 HD2 TYR 127 3.166 -4.137 3.672 936 HD2 TYR 127 HD1 TYR 127 3.445 -0.540 1.369 937 HE1 TYR 127 HE2 TYR 127 4.986 -5.091 2.357 938 HE2 TYR 127 HE1 TYR 127 5.272 -1.522 0.060 939 HH TYR 127 HH TYR 127 6.049 -4.829 0.168 940 H MET 128 H MET 128 0.292 -0.181 1.903 941 HA MET 128 HA MET 128 0.033 -1.302 -0.752 942 HB2 MET 128 2HB MET 128 -2.310 -1.343 0.650 943 HB3 MET 128 1HB MET 128 -2.356 0.337 0.157 944 HG2 MET 128 2HG MET 128 -1.999 -1.862 -1.879 945 HG3 MET 128 1HG MET 128 -3.594 -1.404 -1.287 946 HE1 MET 128 3HE MET 128 -3.720 1.649 -1.034 947 HE2 MET 128 1HE MET 128 -4.880 0.670 -1.936 948 HE3 MET 128 2HE MET 128 -4.177 2.110 -2.674 949 H GLU 129 H GLU 129 -0.313 0.656 -2.319 950 HA GLU 129 HA GLU 129 0.344 3.289 -1.278 951 HB2 GLU 129 2HB GLU 129 2.551 2.192 -1.333 952 HB3 GLU 129 1HB GLU 129 2.303 1.725 -3.007 953 HG2 GLU 129 2HG GLU 129 2.359 4.109 -3.670 954 HG3 GLU 129 1HG GLU 129 2.637 4.560 -1.983 955 H LEU 130 H LEU 130 -0.042 4.936 -2.778 956 HA LEU 130 HA LEU 130 -1.319 4.187 -5.340 957 HB2 LEU 130 2HB LEU 130 -2.301 6.617 -3.809 958 HB3 LEU 130 1HB LEU 130 -3.115 5.665 -5.036 959 HG LEU 130 HG LEU 130 -3.128 3.790 -3.156 960 HD11 LEU 130 1HD1 LEU 130 -2.858 6.285 -1.459 961 HD12 LEU 130 2HD1 LEU 130 -1.730 4.928 -1.536 962 HD13 LEU 130 3HD1 LEU 130 -3.346 4.689 -0.876 963 HD21 LEU 130 3HD2 LEU 130 -5.328 4.521 -2.401 964 HD22 LEU 130 1HD2 LEU 130 -5.147 4.799 -4.131 965 HD23 LEU 130 2HD2 LEU 130 -5.022 6.151 -3.003 966 H GLU 131 H GLU 131 -1.049 5.663 -7.019 967 HA GLU 131 HA GLU 131 0.498 8.134 -6.554 968 HB2 GLU 131 2HB GLU 131 0.971 6.066 -8.747 969 HB3 GLU 131 1HB GLU 131 1.563 7.720 -8.862 970 HG2 GLU 131 2HG GLU 131 2.993 7.407 -6.919 971 HG3 GLU 131 1HG GLU 131 2.310 5.806 -6.628 972 HA PRO 132 HA PRO 132 -3.579 9.159 -8.566 973 HB2 PRO 132 2HB PRO 132 -3.581 11.780 -7.645 974 HB3 PRO 132 1HB PRO 132 -4.183 10.413 -6.689 975 HG2 PRO 132 2HG PRO 132 -1.475 11.719 -6.598 976 HG3 PRO 132 1HG PRO 132 -2.554 11.278 -5.252 977 HD2 PRO 132 2HD PRO 132 -0.509 9.695 -5.882 978 HD3 PRO 132 1HD PRO 132 -2.070 8.985 -5.439 979 H ASP 133 H ASP 133 -4.110 10.810 -10.173 980 HA ASP 133 HA ASP 133 -2.190 10.966 -12.238 981 HB2 ASP 133 2HB ASP 133 -4.548 10.885 -12.768 982 HB3 ASP 133 1HB ASP 133 -4.884 12.315 -11.801 983 H ARG 134 H ARG 134 -3.629 13.472 -10.198 984 HA ARG 134 HA ARG 134 -1.203 15.143 -10.479 985 HB2 ARG 134 2HB ARG 134 -2.866 17.051 -9.913 986 HB3 ARG 134 1HB ARG 134 -2.941 16.366 -11.527 987 HG2 ARG 134 2HG ARG 134 -5.199 16.654 -10.848 988 HG3 ARG 134 1HG ARG 134 -4.890 14.928 -10.726 989 HD2 ARG 134 2HD ARG 134 -4.608 15.130 -8.304 990 HD3 ARG 134 1HD ARG 134 -4.826 16.880 -8.407 991 HE ARG 134 HE ARG 134 -7.012 15.188 -9.360 992 HH11 ARG 134 1HH1 ARG 134 -5.714 17.193 -6.797 993 HH12 ARG 134 2HH1 ARG 134 -7.248 17.399 -6.019 994 HH21 ARG 134 1HH2 ARG 134 -9.016 15.447 -8.326 995 HH22 ARG 134 2HH2 ARG 134 -9.133 16.406 -6.884 996 H ASP 135 H ASP 135 -1.642 16.855 -8.304 997 HA ASP 135 HA ASP 135 -1.194 14.976 -6.078 998 HB2 ASP 135 2HB ASP 135 0.369 16.986 -6.684 999 HB3 ASP 135 1HB ASP 135 -0.840 17.985 -5.884 1000 H LEU 136 H LEU 136 -2.253 15.229 -4.039 1001 HA LEU 136 HA LEU 136 -5.053 16.150 -4.337 1002 HB2 LEU 136 2HB LEU 136 -3.897 13.976 -2.543 1003 HB3 LEU 136 1HB LEU 136 -5.600 14.403 -2.656 1004 HG LEU 136 HG LEU 136 -3.938 13.235 -4.930 1005 HD11 LEU 136 1HD1 LEU 136 -4.301 11.604 -3.127 1006 HD12 LEU 136 2HD1 LEU 136 -5.144 11.153 -4.604 1007 HD13 LEU 136 3HD1 LEU 136 -6.045 11.846 -3.254 1008 HD21 LEU 136 3HD2 LEU 136 -6.079 12.956 -6.137 1009 HD22 LEU 136 1HD2 LEU 136 -5.745 14.655 -5.805 1010 HD23 LEU 136 2HD2 LEU 136 -6.934 13.783 -4.832 1011 H SER 137 H SER 137 -6.062 17.239 -2.704 1012 HA SER 137 HA SER 137 -4.596 18.079 -0.285 1013 HB2 SER 137 2HB SER 137 -5.519 20.389 -0.523 1014 HB3 SER 137 1HB SER 137 -4.455 19.980 -1.865 1015 HG SER 137 HG SER 137 -6.578 19.296 -2.870 1016 H ASP 138 H ASP 138 -6.354 19.220 1.246 1017 HA ASP 138 HA ASP 138 -8.071 17.087 1.992 1018 HB2 ASP 138 2HB ASP 138 -8.737 18.467 3.877 1019 HB3 ASP 138 1HB ASP 138 -7.011 18.663 3.614 1020 H GLY 139 H GLY 139 -9.936 16.544 1.102 1021 HA2 GLY 139 2HA GLY 139 -12.304 17.071 0.801 1022 HA3 GLY 139 1HA GLY 139 -11.835 18.625 0.131 1023 H ASP 140 H ASP 140 -9.575 16.818 -1.242 1024 HA ASP 140 HA ASP 140 -11.013 16.164 -3.668 1025 HB2 ASP 140 2HB ASP 140 -8.129 15.703 -2.806 1026 HB3 ASP 140 1HB ASP 140 -8.762 15.081 -4.328 1027 H GLU 141 H GLU 141 -10.788 13.945 -4.636 1028 HA GLU 141 HA GLU 141 -11.262 11.838 -2.614 1029 HB2 GLU 141 2HB GLU 141 -12.268 12.064 -5.483 1030 HB3 GLU 141 1HB GLU 141 -12.708 10.809 -4.325 1031 HG2 GLU 141 2HG GLU 141 -13.803 12.470 -2.893 1032 HG3 GLU 141 1HG GLU 141 -13.295 13.765 -3.975 1033 H ILE 142 H ILE 142 -10.840 9.584 -3.512 1034 HA ILE 142 HA ILE 142 -8.741 9.145 -5.402 1035 HB ILE 142 HB ILE 142 -7.409 10.093 -3.499 1036 HG12 ILE 142 2HG1 ILE 142 -5.720 8.237 -3.306 1037 HG13 ILE 142 1HG1 ILE 142 -6.885 7.119 -3.998 1038 HG21 ILE 142 1HG2 ILE 142 -8.441 7.727 -1.893 1039 HG22 ILE 142 2HG2 ILE 142 -8.835 9.425 -1.628 1040 HG23 ILE 142 3HG2 ILE 142 -7.188 8.854 -1.370 1041 HD11 ILE 142 3HD1 ILE 142 -6.814 8.338 -6.113 1042 HD12 ILE 142 1HD1 ILE 142 -5.201 7.825 -5.614 1043 HD13 ILE 142 2HD1 ILE 142 -5.690 9.508 -5.415 1044 H THR 143 H THR 143 -8.381 6.853 -5.733 1045 HA THR 143 HA THR 143 -10.530 5.133 -4.634 1046 HB THR 143 HB THR 143 -8.910 4.707 -7.188 1047 HG1 THR 143 HG1 THR 143 -10.353 6.642 -7.029 1048 HG21 THR 143 3HG2 THR 143 -11.512 3.456 -6.220 1049 HG22 THR 143 1HG2 THR 143 -9.950 2.641 -6.337 1050 HG23 THR 143 2HG2 THR 143 -10.770 3.187 -7.799 1051 H LEU 144 H LEU 144 -10.017 3.304 -3.512 1052 HA LEU 144 HA LEU 144 -7.200 2.799 -2.805 1053 HB2 LEU 144 2HB LEU 144 -9.760 2.879 -1.198 1054 HB3 LEU 144 1HB LEU 144 -8.518 1.761 -0.689 1055 HG LEU 144 HG LEU 144 -8.497 3.903 0.579 1056 HD11 LEU 144 1HD1 LEU 144 -6.075 4.258 0.528 1057 HD12 LEU 144 2HD1 LEU 144 -5.960 3.411 -1.015 1058 HD13 LEU 144 3HD1 LEU 144 -6.460 2.540 0.436 1059 HD21 LEU 144 3HD2 LEU 144 -7.617 5.198 -2.024 1060 HD22 LEU 144 1HD2 LEU 144 -7.716 5.973 -0.442 1061 HD23 LEU 144 2HD2 LEU 144 -9.184 5.425 -1.244 1062 H ASP 145 H ASP 145 -6.683 1.093 -4.124 1063 HA ASP 145 HA ASP 145 -8.364 -1.323 -4.188 1064 HB2 ASP 145 2HB ASP 145 -5.903 -0.431 -5.734 1065 HB3 ASP 145 1HB ASP 145 -6.497 -2.089 -5.813 1066 H PHE 146 H PHE 146 -8.148 -2.224 -2.176 1067 HA PHE 146 HA PHE 146 -5.610 -2.764 -0.883 1068 HB2 PHE 146 2HB PHE 146 -8.222 -4.209 -0.277 1069 HB3 PHE 146 1HB PHE 146 -6.875 -3.881 0.814 1070 HD1 PHE 146 HD2 PHE 146 -6.322 -1.145 0.799 1071 HD2 PHE 146 HD1 PHE 146 -10.137 -3.004 0.277 1072 HE1 PHE 146 HE2 PHE 146 -7.430 0.907 1.530 1073 HE2 PHE 146 HE1 PHE 146 -11.241 -0.940 1.016 1074 HZ PHE 146 HZ PHE 146 -9.888 1.017 1.645 1075 H ASN 147 H ASN 147 -7.429 -4.179 -3.336 1076 HA ASN 147 HA ASN 147 -6.518 -6.895 -3.207 1077 HB2 ASN 147 2HB ASN 147 -7.570 -7.088 -5.426 1078 HB3 ASN 147 1HB ASN 147 -8.637 -6.293 -4.279 1079 HD21 ASN 147 1HD2 ASN 147 -9.055 -4.057 -4.527 1080 HD22 ASN 147 2HD2 ASN 147 -8.765 -3.243 -6.017 1081 H LEU 148 H LEU 148 -4.987 -4.018 -4.123 1082 HA LEU 148 HA LEU 148 -2.951 -5.407 -5.769 1083 HB2 LEU 148 2HB LEU 148 -3.494 -2.422 -5.448 1084 HB3 LEU 148 1HB LEU 148 -2.266 -3.131 -6.486 1085 HG LEU 148 HG LEU 148 -5.281 -3.334 -6.831 1086 HD11 LEU 148 1HD1 LEU 148 -4.926 -2.105 -8.929 1087 HD12 LEU 148 2HD1 LEU 148 -3.200 -1.980 -8.578 1088 HD13 LEU 148 3HD1 LEU 148 -4.376 -1.176 -7.536 1089 HD21 LEU 148 3HD2 LEU 148 -4.308 -5.481 -7.435 1090 HD22 LEU 148 1HD2 LEU 148 -3.117 -4.690 -8.473 1091 HD23 LEU 148 2HD2 LEU 148 -4.832 -4.632 -8.883 1092 H ALA 149 H ALA 149 -3.363 -5.366 -2.747 1093 HA ALA 149 HA ALA 149 -1.432 -3.756 -1.474 1094 HB1 ALA 149 3HB ALA 149 -3.273 -4.807 -0.260 1095 HB2 ALA 149 1HB ALA 149 -1.722 -5.237 0.465 1096 HB3 ALA 149 2HB ALA 149 -2.583 -6.403 -0.546 1097 H TYR 150 H TYR 150 0.678 -4.055 -0.925 1098 HA TYR 150 HA TYR 150 2.189 -5.972 -2.538 1099 HB2 TYR 150 2HB TYR 150 3.345 -3.826 -0.700 1100 HB3 TYR 150 1HB TYR 150 4.129 -4.617 -2.057 1101 HD1 TYR 150 HD1 TYR 150 1.040 -3.788 -3.446 1102 HD2 TYR 150 HD2 TYR 150 4.557 -1.871 -1.963 1103 HE1 TYR 150 HE1 TYR 150 0.531 -1.813 -4.799 1104 HE2 TYR 150 HE2 TYR 150 4.049 0.100 -3.325 1105 HH TYR 150 HH TYR 150 2.776 0.839 -5.126 1106 H SER 151 H SER 151 3.225 -7.760 -1.610 1107 HA SER 151 HA SER 151 2.921 -8.441 1.107 1108 HB2 SER 151 2HB SER 151 4.547 -10.263 0.542 1109 HB3 SER 151 1HB SER 151 3.203 -10.154 -0.592 1110 HG SER 151 HG SER 151 5.005 -10.315 -1.826 1111 HA PRO 152 HA PRO 152 6.305 -6.066 2.860 1112 HB2 PRO 152 2HB PRO 152 6.543 -7.277 5.296 1113 HB3 PRO 152 1HB PRO 152 5.131 -6.275 4.879 1114 HG2 PRO 152 2HG PRO 152 5.401 -9.265 4.793 1115 HG3 PRO 152 1HG PRO 152 4.095 -8.273 5.480 1116 HD2 PRO 152 2HD PRO 152 3.886 -9.391 3.018 1117 HD3 PRO 152 1HD PRO 152 3.153 -7.815 3.398 1118 H PHE 153 H PHE 153 8.370 -6.224 2.276 1119 HA PHE 153 HA PHE 153 10.015 -8.265 1.692 1120 HB2 PHE 153 2HB PHE 153 10.738 -5.774 3.282 1121 HB3 PHE 153 1HB PHE 153 11.883 -6.781 2.406 1122 HD1 PHE 153 HD1 PHE 153 9.155 -4.278 2.026 1123 HD2 PHE 153 HD2 PHE 153 12.132 -6.581 -0.017 1124 HE1 PHE 153 HE1 PHE 153 8.879 -2.876 0.022 1125 HE2 PHE 153 HE2 PHE 153 11.840 -5.175 -2.013 1126 HZ PHE 153 HZ PHE 153 10.222 -3.319 -1.999 1127 H CYS 154 H CYS 154 9.130 -7.204 4.908 1128 HA CYS 154 HA CYS 154 11.101 -8.374 6.495 1129 HB2 CYS 154 2HB CYS 154 8.274 -7.988 7.486 1130 HB3 CYS 154 1HB CYS 154 9.797 -7.599 8.288 1131 HG CYS 154 HG CYS 154 10.298 -5.369 6.626 1132 H ALA 155 H ALA 155 7.833 -9.590 5.662 1133 HA ALA 155 HA ALA 155 7.773 -11.883 7.282 1134 HB1 ALA 155 3HB ALA 155 6.288 -11.420 4.671 1135 HB2 ALA 155 1HB ALA 155 5.758 -10.890 6.271 1136 HB3 ALA 155 2HB ALA 155 5.868 -12.610 5.908 1137 H TYR 156 H TYR 156 9.139 -11.390 4.121 1138 HA TYR 156 HA TYR 156 9.661 -14.251 3.689 1139 HB2 TYR 156 2HB TYR 156 9.931 -11.837 1.851 1140 HB3 TYR 156 1HB TYR 156 10.316 -13.494 1.381 1141 HD1 TYR 156 HD2 TYR 156 8.496 -15.191 1.136 1142 HD2 TYR 156 HD1 TYR 156 7.576 -11.117 2.055 1143 HE1 TYR 156 HE2 TYR 156 6.143 -15.593 0.563 1144 HE2 TYR 156 HE1 TYR 156 5.224 -11.527 1.497 1145 HH TYR 156 HH TYR 156 3.929 -14.632 1.081 1146 H SER 157 H SER 157 11.327 -11.276 4.536 1147 HA SER 157 HA SER 157 13.785 -12.756 5.061 1148 HB2 SER 157 2HB SER 157 13.716 -10.363 3.183 1149 HB3 SER 157 1HB SER 157 15.194 -10.938 3.953 1150 HG SER 157 HG SER 157 13.630 -12.793 2.556 1151 H ASP 158 H ASP 158 14.291 -12.299 7.107 1152 HA ASP 158 HA ASP 158 13.140 -10.059 8.542 1153 HB2 ASP 158 2HB ASP 158 15.036 -12.269 9.440 1154 HB3 ASP 158 1HB ASP 158 14.361 -11.057 10.521 1155 H THR 159 H THR 159 15.867 -10.302 6.634 1156 HA THR 159 HA THR 159 17.693 -8.597 8.005 1157 HB THR 159 HB THR 159 18.377 -10.115 6.147 1158 HG1 THR 159 HG1 THR 159 19.337 -7.811 6.698 1159 HG21 THR 159 3HG2 THR 159 18.015 -9.480 3.797 1160 HG22 THR 159 1HG2 THR 159 17.016 -8.112 4.301 1161 HG23 THR 159 2HG2 THR 159 16.471 -9.763 4.602 1162 H PHE 160 H PHE 160 14.696 -7.993 6.519 1163 HA PHE 160 HA PHE 160 15.148 -5.092 6.237 1164 HB2 PHE 160 2HB PHE 160 12.708 -6.805 5.553 1165 HB3 PHE 160 1HB PHE 160 12.848 -5.071 5.276 1166 HD1 PHE 160 HD1 PHE 160 14.251 -4.197 3.426 1167 HD2 PHE 160 HD2 PHE 160 13.888 -8.410 4.083 1168 HE1 PHE 160 HE1 PHE 160 15.176 -4.634 1.192 1169 HE2 PHE 160 HE2 PHE 160 14.815 -8.831 1.842 1170 HZ PHE 160 HZ PHE 160 15.460 -6.947 0.392 1171 H SER 161 H SER 161 13.170 -3.824 7.148 1172 HA SER 161 HA SER 161 12.639 -4.716 9.929 1173 HB2 SER 161 2HB SER 161 12.577 -1.834 8.944 1174 HB3 SER 161 1HB SER 161 12.711 -2.417 10.604 1175 HG SER 161 HG SER 161 14.650 -2.554 8.538 1176 H CYS 162 H CYS 162 10.447 -4.729 10.645 1177 HA CYS 162 HA CYS 162 8.357 -4.288 8.686 1178 HB2 CYS 162 2HB CYS 162 6.848 -4.955 10.586 1179 HB3 CYS 162 1HB CYS 162 8.095 -6.146 10.237 1180 HG CYS 162 HG CYS 162 9.114 -4.025 12.566 1181 HA PRO 163 HA PRO 163 8.256 0.131 9.902 1182 HB2 PRO 163 2HB PRO 163 5.955 0.399 8.029 1183 HB3 PRO 163 1HB PRO 163 7.557 1.150 7.932 1184 HG2 PRO 163 2HG PRO 163 6.744 -0.785 6.217 1185 HG3 PRO 163 1HG PRO 163 8.443 -0.560 6.687 1186 HD2 PRO 163 2HD PRO 163 6.470 -2.603 7.671 1187 HD3 PRO 163 1HD PRO 163 8.201 -2.787 7.312 1188 H LEU 164 H LEU 164 7.287 0.634 11.829 1189 HA LEU 164 HA LEU 164 5.027 -0.669 12.870 1190 HB2 LEU 164 2HB LEU 164 6.739 0.400 14.307 1191 HB3 LEU 164 1HB LEU 164 6.258 1.982 13.712 1192 HG LEU 164 HG LEU 164 3.981 1.631 14.728 1193 HD11 LEU 164 1HD1 LEU 164 3.890 -0.805 14.800 1194 HD12 LEU 164 2HD1 LEU 164 3.623 -0.133 16.405 1195 HD13 LEU 164 3HD1 LEU 164 5.186 -0.850 16.002 1196 HD21 LEU 164 3HD2 LEU 164 6.290 1.532 16.703 1197 HD22 LEU 164 1HD2 LEU 164 4.652 2.096 17.049 1198 HD23 LEU 164 2HD2 LEU 164 5.660 2.974 15.904 1199 HA PRO 165 HA PRO 165 2.121 1.844 10.436 1200 HB2 PRO 165 2HB PRO 165 -0.095 0.296 10.738 1201 HB3 PRO 165 1HB PRO 165 1.264 -0.220 9.716 1202 HG2 PRO 165 2HG PRO 165 0.544 -1.096 12.482 1203 HG3 PRO 165 1HG PRO 165 1.152 -2.056 11.113 1204 HD2 PRO 165 2HD PRO 165 2.736 -1.120 13.199 1205 HD3 PRO 165 1HD PRO 165 3.348 -1.576 11.596 1206 HA PRO 166 HA PRO 166 -0.070 4.274 13.639 1207 HB2 PRO 166 2HB PRO 166 -2.138 5.270 12.073 1208 HB3 PRO 166 1HB PRO 166 -0.492 5.934 12.052 1209 HG2 PRO 166 2HG PRO 166 -1.760 3.986 10.155 1210 HG3 PRO 166 1HG PRO 166 -0.745 5.405 9.804 1211 HD2 PRO 166 2HD PRO 166 0.279 2.917 9.755 1212 HD3 PRO 166 1HD PRO 166 1.236 4.296 10.349 1213 H GLU 167 H GLU 167 -1.736 3.773 15.083 1214 HA GLU 167 HA GLU 167 -2.824 1.145 14.984 1215 HB2 GLU 167 2HB GLU 167 -3.643 3.424 16.833 1216 HB3 GLU 167 1HB GLU 167 -3.900 1.700 17.119 1217 HG2 GLU 167 2HG GLU 167 -1.476 1.337 17.226 1218 HG3 GLU 167 1HG GLU 167 -1.186 3.044 16.900 1219 H SER 168 H SER 168 -4.084 4.181 13.927 1220 HA SER 168 HA SER 168 -6.877 3.481 13.848 1221 HB2 SER 168 2HB SER 168 -5.437 5.798 12.499 1222 HB3 SER 168 1HB SER 168 -7.167 5.680 12.818 1223 HG SER 168 HG SER 168 -6.631 6.710 14.582 1224 H ASN 169 H ASN 169 -4.333 2.522 11.827 1225 HA ASN 169 HA ASN 169 -5.818 2.697 9.291 1226 HB2 ASN 169 2HB ASN 169 -3.792 2.255 8.168 1227 HB3 ASN 169 1HB ASN 169 -3.285 3.210 9.550 1228 HD21 ASN 169 1HD2 ASN 169 -1.500 1.725 8.141 1229 HD22 ASN 169 2HD2 ASN 169 -0.923 0.408 9.079 1230 H TRP 170 H TRP 170 -5.904 0.699 11.842 1231 HA TRP 170 HA TRP 170 -5.634 -1.898 10.721 1232 HB2 TRP 170 2HB TRP 170 -6.972 -0.957 13.296 1233 HB3 TRP 170 1HB TRP 170 -6.795 -2.650 12.850 1234 HD1 TRP 170 HD1 TRP 170 -3.599 -1.474 11.766 1235 HE1 TRP 170 HE1 TRP 170 -1.808 -1.626 13.596 1236 HE3 TRP 170 HE3 TRP 170 -6.637 -2.034 15.854 1237 HZ2 TRP 170 HZ2 TRP 170 -1.675 -1.945 16.392 1238 HZ3 TRP 170 HZ3 TRP 170 -5.591 -2.260 18.074 1239 HH2 TRP 170 HH2 TRP 170 -3.157 -2.217 18.337 1240 H LEU 171 H LEU 171 -6.960 -2.611 9.190 1241 HA LEU 171 HA LEU 171 -9.780 -1.853 9.063 1242 HB2 LEU 171 2HB LEU 171 -8.225 -3.766 7.256 1243 HB3 LEU 171 1HB LEU 171 -9.813 -3.080 6.945 1244 HG LEU 171 HG LEU 171 -7.160 -1.585 6.937 1245 HD11 LEU 171 1HD1 LEU 171 -9.064 -2.139 4.641 1246 HD12 LEU 171 2HD1 LEU 171 -7.549 -2.985 4.941 1247 HD13 LEU 171 3HD1 LEU 171 -7.529 -1.268 4.552 1248 HD21 LEU 171 3HD2 LEU 171 -8.436 0.412 6.241 1249 HD22 LEU 171 1HD2 LEU 171 -8.869 -0.116 7.865 1250 HD23 LEU 171 2HD2 LEU 171 -9.947 -0.458 6.510 1251 H GLU 172 H GLU 172 -10.839 -2.914 10.751 1252 HA GLU 172 HA GLU 172 -10.034 -5.564 11.585 1253 HB2 GLU 172 2HB GLU 172 -10.836 -3.731 13.151 1254 HB3 GLU 172 1HB GLU 172 -12.467 -3.981 12.532 1255 HG2 GLU 172 2HG GLU 172 -12.513 -6.246 13.395 1256 HG3 GLU 172 1HG GLU 172 -10.805 -6.175 13.826 1257 H THR 173 H THR 173 -10.366 -6.253 9.340 1258 HA THR 173 HA THR 173 -12.620 -7.970 9.117 1259 HB THR 173 HB THR 173 -13.646 -6.004 8.073 1260 HG1 THR 173 HG1 THR 173 -14.338 -7.632 6.873 1261 HG21 THR 173 3HG2 THR 173 -11.256 -5.893 6.193 1262 HG22 THR 173 1HG2 THR 173 -11.609 -4.723 7.470 1263 HG23 THR 173 2HG2 THR 173 -12.702 -4.889 6.094 1264 H ALA 174 H ALA 174 -12.270 -9.567 7.467 1265 HA ALA 174 HA ALA 174 -9.460 -10.133 6.935 1266 HB1 ALA 174 3HB ALA 174 -11.958 -11.727 6.214 1267 HB2 ALA 174 1HB ALA 174 -10.936 -11.980 7.633 1268 HB3 ALA 174 2HB ALA 174 -10.290 -12.278 6.016 1269 H VAL 175 H VAL 175 -8.879 -8.488 5.475 1270 HA VAL 175 HA VAL 175 -10.184 -8.123 2.925 1271 HB VAL 175 HB VAL 175 -7.413 -7.204 3.848 1272 HG11 VAL 175 1HG1 VAL 175 -8.939 -6.386 1.342 1273 HG12 VAL 175 2HG1 VAL 175 -7.464 -7.351 1.398 1274 HG13 VAL 175 3HG1 VAL 175 -7.427 -5.662 1.903 1275 HG21 VAL 175 3HG2 VAL 175 -8.459 -4.972 4.139 1276 HG22 VAL 175 1HG2 VAL 175 -9.240 -6.183 5.158 1277 HG23 VAL 175 2HG2 VAL 175 -10.028 -5.637 3.676 1278 H THR 176 H THR 176 -10.346 -10.089 2.001 1279 HA THR 176 HA THR 176 -7.896 -11.668 1.457 1280 HB THR 176 HB THR 176 -10.535 -13.089 1.222 1281 HG1 THR 176 HG1 THR 176 -11.220 -12.208 3.065 1282 HG21 THR 176 3HG2 THR 176 -9.342 -14.844 2.473 1283 HG22 THR 176 1HG2 THR 176 -8.011 -13.732 2.803 1284 HG23 THR 176 2HG2 THR 176 -8.331 -14.266 1.149 1285 H ALA 177 H ALA 177 -7.292 -11.390 -0.599 1286 HA ALA 177 HA ALA 177 -9.255 -10.994 -2.758 1287 HB1 ALA 177 3HB ALA 177 -7.031 -9.013 -2.120 1288 HB2 ALA 177 1HB ALA 177 -8.761 -8.727 -1.927 1289 HB3 ALA 177 2HB ALA 177 -8.081 -8.954 -3.537 1290 H GLY 178 H GLY 178 -8.458 -11.565 -4.804 1291 HA2 GLY 178 2HA GLY 178 -7.244 -12.816 -6.282 1292 HA3 GLY 178 1HA GLY 178 -5.825 -12.130 -5.511 1293 H GLU 179 H GLU 179 -4.599 -14.000 -5.687 1294 HA GLU 179 HA GLU 179 -5.345 -16.574 -4.818 1295 HB2 GLU 179 2HB GLU 179 -3.373 -16.100 -6.278 1296 HB3 GLU 179 1HB GLU 179 -2.557 -15.335 -4.921 1297 HG2 GLU 179 2HG GLU 179 -1.735 -17.624 -5.344 1298 HG3 GLU 179 1HG GLU 179 -2.433 -17.456 -3.733 1299 H ARG 180 H ARG 180 -5.049 -17.646 -2.868 1300 HA ARG 180 HA ARG 180 -4.973 -16.010 -0.476 1301 HB2 ARG 180 2HB ARG 180 -5.370 -19.001 -0.915 1302 HB3 ARG 180 1HB ARG 180 -5.330 -18.253 0.682 1303 HG2 ARG 180 2HG ARG 180 -7.255 -16.828 0.071 1304 HG3 ARG 180 1HG ARG 180 -7.315 -17.592 -1.519 1305 HD2 ARG 180 2HD ARG 180 -7.829 -19.769 -0.442 1306 HD3 ARG 180 1HD ARG 180 -7.744 -18.992 1.142 1307 HE ARG 180 HE ARG 180 -9.795 -18.008 0.793 1308 HH11 ARG 180 1HH1 ARG 180 -8.797 -19.498 -2.233 1309 HH12 ARG 180 2HH1 ARG 180 -10.351 -19.318 -2.968 1310 HH21 ARG 180 1HH2 ARG 180 -11.824 -17.787 -0.194 1311 HH22 ARG 180 2HH2 ARG 180 -12.075 -18.349 -1.812 1312 H THR 181 H THR 181 -3.604 -16.973 1.395 1313 HA THR 181 HA THR 181 -0.919 -16.323 0.411 1314 HB THR 181 HB THR 181 -0.560 -15.617 2.843 1315 HG1 THR 181 HG1 THR 181 -2.145 -16.780 3.869 1316 HG21 THR 181 3HG2 THR 181 -1.904 -13.553 2.681 1317 HG22 THR 181 1HG2 THR 181 -2.877 -14.274 1.390 1318 HG23 THR 181 2HG2 THR 181 -1.167 -13.934 1.125 1319 H ASP 182 H ASP 182 0.693 -16.945 2.312 1320 HA ASP 182 HA ASP 182 1.578 -19.527 1.846 1321 HB2 ASP 182 2HB ASP 182 3.196 -19.062 3.685 1322 HB3 ASP 182 1HB ASP 182 3.043 -17.699 2.583 1323 H LEU 183 H LEU 183 0.750 -21.445 2.513 1324 HA LEU 183 HA LEU 183 -0.597 -21.693 5.115 1325 HB2 LEU 183 2HB LEU 183 -1.335 -23.880 4.500 1326 HB3 LEU 183 1HB LEU 183 -1.649 -22.841 3.129 1327 HG LEU 183 HG LEU 183 0.745 -24.713 3.257 1328 HD11 LEU 183 1HD1 LEU 183 -1.266 -26.081 3.469 1329 HD12 LEU 183 2HD1 LEU 183 -0.509 -26.328 1.900 1330 HD13 LEU 183 3HD1 LEU 183 -1.960 -25.329 2.029 1331 HD21 LEU 183 3HD2 LEU 183 0.788 -24.500 0.808 1332 HD22 LEU 183 1HD2 LEU 183 0.976 -22.935 1.590 1333 HD23 LEU 183 2HD2 LEU 183 -0.572 -23.374 0.866 1334 H GLU 184 H GLU 184 2.263 -22.882 3.333 1335 HA GLU 184 HA GLU 184 3.547 -23.688 5.879 1336 HB2 GLU 184 2HB GLU 184 4.440 -24.348 3.034 1337 HB3 GLU 184 1HB GLU 184 5.155 -24.966 4.520 1338 HG2 GLU 184 2HG GLU 184 2.378 -25.570 3.459 1339 HG3 GLU 184 1HG GLU 184 3.758 -26.663 3.464 1340 H HIS 185 H HIS 185 5.319 -22.612 6.553 1341 HA HIS 185 HA HIS 185 6.791 -20.658 5.045 1342 HB2 HIS 185 2HB HIS 185 6.063 -18.696 6.504 1343 HB3 HIS 185 1HB HIS 185 4.795 -19.281 5.433 1344 HD1 HIS 185 HD1 HIS 185 5.715 -19.025 9.047 1345 HD2 HIS 185 HD2 HIS 185 2.617 -20.538 6.727 1346 HE1 HIS 185 HE1 HIS 185 3.867 -19.566 10.659 1347 HE2 HIS 185 HE2 HIS 185 1.924 -20.219 9.196 Start of MODEL 16 1 H1 MET 1 1H MET 1 -20.597 4.814 -17.637 2 H2 MET 1 2H MET 1 -21.427 3.345 -17.692 3 H3 MET 1 3H MET 1 -21.771 4.548 -18.825 4 HA MET 1 HA MET 1 -20.460 2.845 -19.835 5 HB2 MET 1 2HB MET 1 -18.828 5.376 -19.331 6 HB3 MET 1 1HB MET 1 -18.577 4.253 -20.661 7 HG2 MET 1 2HG MET 1 -20.741 4.833 -21.609 8 HG3 MET 1 1HG MET 1 -21.104 5.863 -20.224 9 HE1 MET 1 3HE MET 1 -20.605 8.504 -23.100 10 HE2 MET 1 1HE MET 1 -21.717 7.875 -21.887 11 HE3 MET 1 2HE MET 1 -21.321 6.906 -23.310 12 H ASP 2 H ASP 2 -19.474 1.073 -19.157 13 HA ASP 2 HA ASP 2 -17.975 0.760 -16.758 14 HB2 ASP 2 2HB ASP 2 -18.165 -1.109 -19.164 15 HB3 ASP 2 1HB ASP 2 -17.544 -1.551 -17.577 16 H GLU 3 H GLU 3 -17.038 1.767 -19.906 17 HA GLU 3 HA GLU 3 -14.359 1.342 -20.175 18 HB2 GLU 3 2HB GLU 3 -15.823 3.982 -20.602 19 HB3 GLU 3 1HB GLU 3 -14.228 3.610 -21.257 20 HG2 GLU 3 2HG GLU 3 -15.148 1.839 -22.641 21 HG3 GLU 3 1HG GLU 3 -16.736 2.036 -21.907 22 H ASP 4 H ASP 4 -15.869 3.497 -17.860 23 HA ASP 4 HA ASP 4 -13.564 4.817 -16.844 24 HB2 ASP 4 2HB ASP 4 -15.816 5.738 -16.547 25 HB3 ASP 4 1HB ASP 4 -16.326 4.326 -15.633 26 H THR 5 H THR 5 -15.257 1.835 -15.912 27 HA THR 5 HA THR 5 -13.730 1.371 -13.528 28 HB THR 5 HB THR 5 -15.561 -0.535 -15.062 29 HG1 THR 5 HG1 THR 5 -16.020 1.443 -13.070 30 HG21 THR 5 3HG2 THR 5 -14.112 -1.718 -13.417 31 HG22 THR 5 1HG2 THR 5 -15.802 -1.716 -12.904 32 HG23 THR 5 2HG2 THR 5 -14.649 -0.612 -12.151 33 H GLU 6 H GLU 6 -13.678 0.036 -16.865 34 HA GLU 6 HA GLU 6 -11.591 -1.853 -16.369 35 HB2 GLU 6 2HB GLU 6 -11.563 -2.297 -18.721 36 HB3 GLU 6 1HB GLU 6 -13.243 -2.025 -18.278 37 HG2 GLU 6 2HG GLU 6 -13.134 0.255 -19.189 38 HG3 GLU 6 1HG GLU 6 -11.437 0.025 -19.594 39 H ASP 7 H ASP 7 -11.551 1.531 -16.891 40 HA ASP 7 HA ASP 7 -9.079 2.066 -18.092 41 HB2 ASP 7 2HB ASP 7 -10.752 3.808 -17.445 42 HB3 ASP 7 1HB ASP 7 -10.356 3.544 -15.754 43 H TRP 8 H TRP 8 -9.852 1.436 -14.728 44 HA TRP 8 HA TRP 8 -7.439 1.360 -13.456 45 HB2 TRP 8 2HB TRP 8 -9.470 1.148 -12.226 46 HB3 TRP 8 1HB TRP 8 -9.967 -0.277 -13.122 47 HD1 TRP 8 HD1 TRP 8 -7.378 0.732 -10.380 48 HE1 TRP 8 HE1 TRP 8 -6.915 -1.367 -8.957 49 HE3 TRP 8 HE3 TRP 8 -10.051 -2.666 -13.090 50 HZ2 TRP 8 HZ2 TRP 8 -7.622 -4.108 -8.992 51 HZ3 TRP 8 HZ3 TRP 8 -10.107 -5.004 -12.343 52 HH2 TRP 8 HH2 TRP 8 -8.912 -5.701 -10.340 53 H GLU 9 H GLU 9 -8.955 -1.547 -15.087 54 HA GLU 9 HA GLU 9 -6.634 -3.176 -14.601 55 HB2 GLU 9 2HB GLU 9 -7.698 -4.911 -15.965 56 HB3 GLU 9 1HB GLU 9 -8.872 -4.207 -14.861 57 HG2 GLU 9 2HG GLU 9 -9.851 -2.902 -16.667 58 HG3 GLU 9 1HG GLU 9 -8.617 -3.462 -17.786 59 H THR 10 H THR 10 -7.508 -0.995 -17.129 60 HA THR 10 HA THR 10 -5.874 -1.901 -19.261 61 HB THR 10 HB THR 10 -7.027 0.874 -18.650 62 HG1 THR 10 HG1 THR 10 -8.366 -1.142 -19.144 63 HG21 THR 10 3HG2 THR 10 -5.841 -0.144 -21.284 64 HG22 THR 10 1HG2 THR 10 -5.126 1.095 -20.250 65 HG23 THR 10 2HG2 THR 10 -6.666 1.399 -21.053 66 H GLN 11 H GLN 11 -5.368 0.774 -16.888 67 HA GLN 11 HA GLN 11 -2.615 1.142 -17.494 68 HB2 GLN 11 2HB GLN 11 -2.532 2.527 -15.449 69 HB3 GLN 11 1HB GLN 11 -3.930 2.923 -16.438 70 HG2 GLN 11 2HG GLN 11 -5.353 1.557 -14.922 71 HG3 GLN 11 1HG GLN 11 -3.951 1.260 -13.904 72 HE21 GLN 11 1HE2 GLN 11 -6.290 3.631 -14.954 73 HE22 GLN 11 2HE2 GLN 11 -5.947 4.797 -13.723 74 H LEU 12 H LEU 12 -4.328 -0.987 -15.258 75 HA LEU 12 HA LEU 12 -2.269 -1.393 -13.370 76 HB2 LEU 12 2HB LEU 12 -4.629 -1.805 -12.849 77 HB3 LEU 12 1HB LEU 12 -4.671 -3.135 -13.994 78 HG LEU 12 HG LEU 12 -3.066 -4.410 -12.570 79 HD11 LEU 12 1HD1 LEU 12 -2.510 -3.672 -10.300 80 HD12 LEU 12 2HD1 LEU 12 -3.300 -2.121 -10.590 81 HD13 LEU 12 3HD1 LEU 12 -1.860 -2.567 -11.509 82 HD21 LEU 12 3HD2 LEU 12 -5.469 -4.769 -12.303 83 HD22 LEU 12 1HD2 LEU 12 -5.550 -3.487 -11.090 84 HD23 LEU 12 2HD2 LEU 12 -4.632 -4.961 -10.765 85 H GLN 13 H GLN 13 -3.105 -3.231 -16.321 86 HA GLN 13 HA GLN 13 -1.484 -5.481 -15.809 87 HB2 GLN 13 2HB GLN 13 -1.684 -5.964 -18.221 88 HB3 GLN 13 1HB GLN 13 -3.224 -5.509 -17.517 89 HG2 GLN 13 2HG GLN 13 -3.293 -4.375 -19.530 90 HG3 GLN 13 1HG GLN 13 -2.672 -3.126 -18.461 91 HE21 GLN 13 1HE2 GLN 13 -0.754 -5.810 -19.748 92 HE22 GLN 13 2HE2 GLN 13 0.253 -4.835 -20.752 93 H ALA 14 H ALA 14 -0.653 -2.286 -16.968 94 HA ALA 14 HA ALA 14 2.096 -2.968 -17.693 95 HB1 ALA 14 3HB ALA 14 0.666 -0.287 -17.570 96 HB2 ALA 14 1HB ALA 14 0.862 -1.297 -19.004 97 HB3 ALA 14 2HB ALA 14 2.276 -0.565 -18.244 98 H ASN 15 H ASN 15 0.383 -1.110 -15.187 99 HA ASN 15 HA ASN 15 2.499 -0.161 -13.629 100 HB2 ASN 15 2HB ASN 15 -0.367 -0.885 -12.888 101 HB3 ASN 15 1HB ASN 15 0.744 -0.166 -11.726 102 HD21 ASN 15 1HD2 ASN 15 -0.625 1.627 -11.504 103 HD22 ASN 15 2HD2 ASN 15 -0.738 2.851 -12.723 104 H ARG 16 H ARG 16 0.858 -3.239 -13.602 105 HA ARG 16 HA ARG 16 1.754 -4.369 -11.190 106 HB2 ARG 16 2HB ARG 16 -0.137 -5.261 -12.513 107 HB3 ARG 16 1HB ARG 16 0.956 -5.701 -13.818 108 HG2 ARG 16 2HG ARG 16 2.096 -7.274 -12.140 109 HG3 ARG 16 1HG ARG 16 0.720 -6.974 -11.073 110 HD2 ARG 16 2HD ARG 16 0.679 -8.235 -13.834 111 HD3 ARG 16 1HD ARG 16 0.283 -9.008 -12.297 112 HE ARG 16 HE ARG 16 -1.368 -6.738 -13.132 113 HH11 ARG 16 1HH1 ARG 16 -1.126 -10.233 -12.858 114 HH12 ARG 16 2HH1 ARG 16 -2.834 -10.477 -13.045 115 HH21 ARG 16 1HH2 ARG 16 -3.575 -7.069 -13.436 116 HH22 ARG 16 2HH2 ARG 16 -4.221 -8.676 -13.378 117 H ASP 17 H ASP 17 2.999 -4.524 -14.496 118 HA ASP 17 HA ASP 17 4.984 -6.514 -14.058 119 HB2 ASP 17 2HB ASP 17 3.978 -6.085 -16.278 120 HB3 ASP 17 1HB ASP 17 4.695 -4.477 -16.315 121 H GLU 18 H GLU 18 5.101 -2.958 -14.277 122 HA GLU 18 HA GLU 18 7.942 -2.769 -13.915 123 HB2 GLU 18 2HB GLU 18 7.589 -0.344 -13.801 124 HB3 GLU 18 1HB GLU 18 6.737 -1.048 -15.168 125 HG2 GLU 18 2HG GLU 18 4.606 -0.864 -14.023 126 HG3 GLU 18 1HG GLU 18 5.398 -0.341 -12.539 127 H LYS 19 H LYS 19 5.246 -2.989 -11.734 128 HA LYS 19 HA LYS 19 6.708 -1.969 -9.422 129 HB2 LYS 19 2HB LYS 19 4.200 -1.696 -9.750 130 HB3 LYS 19 1HB LYS 19 4.029 -3.424 -9.487 131 HG2 LYS 19 2HG LYS 19 3.560 -2.690 -7.365 132 HG3 LYS 19 1HG LYS 19 5.304 -2.841 -7.194 133 HD2 LYS 19 2HD LYS 19 3.849 -0.251 -7.862 134 HD3 LYS 19 1HD LYS 19 4.326 -0.727 -6.237 135 HE2 LYS 19 2HE LYS 19 6.699 -0.650 -6.907 136 HE3 LYS 19 1HE LYS 19 6.224 -0.201 -8.548 137 HZ1 LYS 19 3HZ LYS 19 6.876 1.723 -7.204 138 HZ2 LYS 19 1HZ LYS 19 5.631 1.395 -6.107 139 HZ3 LYS 19 2HZ LYS 19 5.263 1.830 -7.700 140 H ASP 20 H ASP 20 5.936 -5.021 -10.919 141 HA ASP 20 HA ASP 20 6.627 -6.779 -8.774 142 HB2 ASP 20 2HB ASP 20 5.102 -7.427 -10.615 143 HB3 ASP 20 1HB ASP 20 6.420 -7.288 -11.774 144 H ARG 21 H ARG 21 8.335 -5.368 -11.472 145 HA ARG 21 HA ARG 21 10.706 -7.005 -11.302 146 HB2 ARG 21 2HB ARG 21 11.647 -5.560 -13.002 147 HB3 ARG 21 1HB ARG 21 9.983 -5.936 -13.431 148 HG2 ARG 21 2HG ARG 21 9.243 -3.739 -12.718 149 HG3 ARG 21 1HG ARG 21 10.849 -3.344 -12.105 150 HD2 ARG 21 2HD ARG 21 10.373 -2.285 -14.291 151 HD3 ARG 21 1HD ARG 21 11.762 -3.375 -14.357 152 HE ARG 21 HE ARG 21 9.120 -4.367 -15.211 153 HH11 ARG 21 1HH1 ARG 21 12.411 -3.494 -16.105 154 HH12 ARG 21 2HH1 ARG 21 12.294 -4.209 -17.680 155 HH21 ARG 21 1HH2 ARG 21 8.979 -5.262 -17.292 156 HH22 ARG 21 2HH2 ARG 21 10.355 -5.210 -18.354 157 H PHE 22 H PHE 22 9.561 -4.292 -9.585 158 HA PHE 22 HA PHE 22 11.853 -2.932 -8.761 159 HB2 PHE 22 2HB PHE 22 9.417 -2.335 -8.350 160 HB3 PHE 22 1HB PHE 22 9.374 -3.552 -7.086 161 HD1 PHE 22 HD2 PHE 22 10.522 -3.151 -4.922 162 HD2 PHE 22 HD1 PHE 22 10.563 -0.210 -8.033 163 HE1 PHE 22 HE2 PHE 22 11.238 -1.438 -3.306 164 HE2 PHE 22 HE1 PHE 22 11.275 1.489 -6.409 165 HZ PHE 22 HZ PHE 22 11.604 0.878 -4.056 166 H PHE 23 H PHE 23 10.362 -5.885 -7.514 167 HA PHE 23 HA PHE 23 12.232 -6.311 -5.355 168 HB2 PHE 23 2HB PHE 23 9.899 -7.871 -6.495 169 HB3 PHE 23 1HB PHE 23 10.998 -8.650 -5.363 170 HD1 PHE 23 HD2 PHE 23 9.341 -5.244 -5.517 171 HD2 PHE 23 HD1 PHE 23 10.086 -8.784 -3.231 172 HE1 PHE 23 HE2 PHE 23 8.149 -4.272 -3.592 173 HE2 PHE 23 HE1 PHE 23 8.908 -7.800 -1.315 174 HZ PHE 23 HZ PHE 23 7.967 -5.541 -1.487 175 H SER 24 H SER 24 12.503 -6.792 -8.680 176 HA SER 24 HA SER 24 14.416 -9.022 -8.392 177 HB2 SER 24 2HB SER 24 12.641 -9.325 -10.092 178 HB3 SER 24 1HB SER 24 13.163 -7.857 -10.919 179 HG SER 24 HG SER 24 14.213 -9.429 -11.978 180 H GLU 25 H GLU 25 14.173 -5.643 -9.642 181 HA GLU 25 HA GLU 25 16.918 -5.860 -10.704 182 HB2 GLU 25 2HB GLU 25 14.605 -4.124 -11.695 183 HB3 GLU 25 1HB GLU 25 16.222 -4.175 -12.390 184 HG2 GLU 25 2HG GLU 25 15.838 -6.613 -12.924 185 HG3 GLU 25 1HG GLU 25 14.180 -6.417 -12.362 186 H HIS 26 H HIS 26 14.594 -3.637 -9.109 187 HA HIS 26 HA HIS 26 16.439 -1.476 -8.744 188 HB2 HIS 26 2HB HIS 26 14.009 -1.061 -8.666 189 HB3 HIS 26 1HB HIS 26 13.840 -2.110 -7.261 190 HD2 HIS 26 HD2 HIS 26 15.184 1.463 -8.155 191 HE1 HIS 26 HE1 HIS 26 15.019 1.076 -3.948 192 HE2 HIS 26 HE2 HIS 26 15.448 2.660 -5.871 193 H ARG 27 H ARG 27 15.131 -3.923 -6.595 194 HA ARG 27 HA ARG 27 17.596 -3.957 -4.968 195 HB2 ARG 27 2HB ARG 27 14.698 -3.851 -4.043 196 HB3 ARG 27 1HB ARG 27 15.903 -4.645 -3.036 197 HG2 ARG 27 2HG ARG 27 16.069 -1.766 -3.974 198 HG3 ARG 27 1HG ARG 27 15.486 -2.276 -2.388 199 HD2 ARG 27 2HD ARG 27 17.602 -2.543 -1.581 200 HD3 ARG 27 1HD ARG 27 18.135 -3.428 -3.009 201 HE ARG 27 HE ARG 27 17.892 -0.605 -3.459 202 HH11 ARG 27 1HH1 ARG 27 20.039 -3.103 -2.232 203 HH12 ARG 27 2HH1 ARG 27 21.473 -2.166 -2.503 204 HH21 ARG 27 1HH2 ARG 27 19.768 0.609 -3.799 205 HH22 ARG 27 2HH2 ARG 27 21.322 -0.059 -3.393 206 H GLN 28 H GLN 28 18.208 -6.000 -4.237 207 HA GLN 28 HA GLN 28 17.408 -8.282 -5.720 208 HB2 GLN 28 2HB GLN 28 18.822 -9.578 -4.097 209 HB3 GLN 28 1HB GLN 28 19.650 -8.196 -4.788 210 HG2 GLN 28 2HG GLN 28 20.300 -8.145 -2.544 211 HG3 GLN 28 1HG GLN 28 19.013 -6.942 -2.626 212 HE21 GLN 28 1HE2 GLN 28 18.473 -7.060 -0.453 213 HE22 GLN 28 2HE2 GLN 28 17.750 -8.452 0.270 214 H SER 29 H SER 29 16.112 -10.034 -5.124 215 HA SER 29 HA SER 29 13.703 -9.450 -3.883 216 HB2 SER 29 2HB SER 29 14.026 -11.287 -5.540 217 HB3 SER 29 1HB SER 29 14.888 -12.227 -4.321 218 HG SER 29 HG SER 29 12.194 -11.839 -4.669 219 HA PRO 30 HA PRO 30 14.879 -10.014 0.513 220 HB2 PRO 30 2HB PRO 30 12.504 -9.287 1.619 221 HB3 PRO 30 1HB PRO 30 13.570 -8.077 0.874 222 HG2 PRO 30 2HG PRO 30 11.188 -9.458 -0.348 223 HG3 PRO 30 1HG PRO 30 11.566 -7.719 -0.294 224 HD2 PRO 30 2HD PRO 30 12.128 -9.192 -2.481 225 HD3 PRO 30 1HD PRO 30 13.206 -7.877 -1.953 226 H ILE 31 H ILE 31 12.332 -11.483 -1.291 227 HA ILE 31 HA ILE 31 11.326 -13.358 0.565 228 HB ILE 31 HB ILE 31 11.376 -13.718 -2.472 229 HG12 ILE 31 2HG1 ILE 31 10.651 -11.385 -2.065 230 HG13 ILE 31 1HG1 ILE 31 9.314 -12.349 -2.670 231 HG21 ILE 31 1HG2 ILE 31 9.184 -14.812 -2.136 232 HG22 ILE 31 2HG2 ILE 31 9.321 -14.548 -0.397 233 HG23 ILE 31 3HG2 ILE 31 10.466 -15.607 -1.220 234 HD11 ILE 31 3HD1 ILE 31 9.741 -11.441 0.178 235 HD12 ILE 31 1HD1 ILE 31 8.415 -12.475 -0.364 236 HD13 ILE 31 2HD1 ILE 31 8.556 -10.826 -0.972 237 HA PRO 32 HA PRO 32 15.317 -15.639 0.679 238 HB2 PRO 32 2HB PRO 32 14.444 -17.691 2.389 239 HB3 PRO 32 1HB PRO 32 15.020 -16.104 2.927 240 HG2 PRO 32 2HG PRO 32 12.222 -17.084 2.596 241 HG3 PRO 32 1HG PRO 32 12.912 -16.040 3.857 242 HD2 PRO 32 2HD PRO 32 11.430 -15.029 1.847 243 HD3 PRO 32 1HD PRO 32 12.795 -14.134 2.544 244 HA PRO 33 HA PRO 33 15.752 -18.423 -2.518 245 HB2 PRO 33 2HB PRO 33 16.622 -20.929 -1.482 246 HB3 PRO 33 1HB PRO 33 17.654 -19.536 -1.853 247 HG2 PRO 33 2HG PRO 33 16.458 -20.335 0.782 248 HG3 PRO 33 1HG PRO 33 18.098 -19.737 0.421 249 HD2 PRO 33 2HD PRO 33 16.341 -18.077 1.475 250 HD3 PRO 33 1HD PRO 33 17.352 -17.508 0.127 251 H GLU 34 H GLU 34 14.490 -20.790 -0.151 252 HA GLU 34 HA GLU 34 13.058 -22.373 -1.968 253 HB2 GLU 34 2HB GLU 34 12.076 -23.485 -0.020 254 HB3 GLU 34 1HB GLU 34 13.776 -23.176 0.258 255 HG2 GLU 34 2HG GLU 34 11.492 -21.572 1.436 256 HG3 GLU 34 1HG GLU 34 12.398 -22.823 2.273 257 H GLU 35 H GLU 35 12.004 -19.601 -0.041 258 HA GLU 35 HA GLU 35 9.238 -19.753 -0.490 259 HB2 GLU 35 2HB GLU 35 11.013 -17.351 0.069 260 HB3 GLU 35 1HB GLU 35 9.257 -17.281 0.081 261 HG2 GLU 35 2HG GLU 35 10.833 -19.142 1.867 262 HG3 GLU 35 1HG GLU 35 10.410 -17.494 2.328 263 H ARG 36 H ARG 36 11.617 -17.567 -2.202 264 HA ARG 36 HA ARG 36 9.737 -16.801 -4.166 265 HB2 ARG 36 2HB ARG 36 11.629 -15.711 -5.293 266 HB3 ARG 36 1HB ARG 36 11.626 -15.373 -3.566 267 HG2 ARG 36 2HG ARG 36 13.411 -16.995 -3.199 268 HG3 ARG 36 1HG ARG 36 13.379 -17.457 -4.902 269 HD2 ARG 36 2HD ARG 36 14.108 -14.709 -3.836 270 HD3 ARG 36 1HD ARG 36 15.250 -15.936 -4.389 271 HE ARG 36 HE ARG 36 13.251 -15.109 -6.341 272 HH11 ARG 36 1HH1 ARG 36 16.524 -14.583 -5.139 273 HH12 ARG 36 2HH1 ARG 36 17.059 -13.819 -6.605 274 HH21 ARG 36 1HH2 ARG 36 13.967 -14.095 -8.247 275 HH22 ARG 36 2HH2 ARG 36 15.610 -13.541 -8.371 276 H ASP 37 H ASP 37 11.734 -19.587 -3.914 277 HA ASP 37 HA ASP 37 12.026 -20.289 -6.647 278 HB2 ASP 37 2HB ASP 37 13.349 -21.293 -4.774 279 HB3 ASP 37 1HB ASP 37 11.904 -22.115 -4.198 280 H ASP 38 H ASP 38 9.442 -20.762 -4.293 281 HA ASP 38 HA ASP 38 7.738 -22.218 -6.211 282 HB2 ASP 38 2HB ASP 38 7.934 -22.983 -3.830 283 HB3 ASP 38 1HB ASP 38 7.222 -21.464 -3.302 284 H PHE 39 H PHE 39 7.874 -19.131 -4.472 285 HA PHE 39 HA PHE 39 5.531 -18.104 -5.991 286 HB2 PHE 39 2HB PHE 39 6.776 -16.913 -3.451 287 HB3 PHE 39 1HB PHE 39 5.274 -16.421 -4.217 288 HD1 PHE 39 HD2 PHE 39 3.257 -17.914 -4.056 289 HD2 PHE 39 HD1 PHE 39 6.828 -18.725 -1.847 290 HE1 PHE 39 HE2 PHE 39 1.995 -19.393 -2.540 291 HE2 PHE 39 HE1 PHE 39 5.563 -20.205 -0.339 292 HZ PHE 39 HZ PHE 39 3.146 -20.538 -0.684 293 H ASP 40 H ASP 40 6.513 -17.266 -7.846 294 HA ASP 40 HA ASP 40 9.050 -15.738 -7.495 295 HB2 ASP 40 2HB ASP 40 9.211 -17.755 -8.964 296 HB3 ASP 40 1HB ASP 40 7.993 -17.063 -10.032 297 H GLY 41 H GLY 41 7.897 -13.948 -6.809 298 HA2 GLY 41 2HA GLY 41 7.704 -11.787 -8.317 299 HA3 GLY 41 1HA GLY 41 6.138 -12.525 -8.659 300 H LEU 42 H LEU 42 5.707 -10.268 -7.638 301 HA LEU 42 HA LEU 42 5.362 -10.237 -4.801 302 HB2 LEU 42 2HB LEU 42 4.184 -8.602 -7.077 303 HB3 LEU 42 1HB LEU 42 3.598 -8.404 -5.432 304 HG LEU 42 HG LEU 42 6.499 -8.002 -6.259 305 HD11 LEU 42 1HD1 LEU 42 5.113 -6.268 -7.289 306 HD12 LEU 42 2HD1 LEU 42 6.113 -5.599 -6.002 307 HD13 LEU 42 3HD1 LEU 42 4.391 -5.884 -5.723 308 HD21 LEU 42 3HD2 LEU 42 6.728 -7.002 -4.017 309 HD22 LEU 42 1HD2 LEU 42 6.256 -8.697 -3.939 310 HD23 LEU 42 2HD2 LEU 42 5.058 -7.433 -3.650 311 H SER 43 H SER 43 4.316 -12.047 -4.061 312 HA SER 43 HA SER 43 1.787 -12.971 -4.975 313 HB2 SER 43 2HB SER 43 2.990 -13.153 -2.171 314 HB3 SER 43 1HB SER 43 1.708 -14.173 -2.832 315 HG SER 43 HG SER 43 3.140 -15.189 -4.094 316 H TYR 44 H TYR 44 -0.021 -11.803 -4.930 317 HA TYR 44 HA TYR 44 -0.780 -10.245 -2.576 318 HB2 TYR 44 2HB TYR 44 -1.357 -8.208 -3.829 319 HB3 TYR 44 1HB TYR 44 0.355 -8.554 -3.991 320 HD1 TYR 44 HD1 TYR 44 -2.866 -8.355 -5.784 321 HD2 TYR 44 HD2 TYR 44 1.311 -9.113 -6.220 322 HE1 TYR 44 HE1 TYR 44 -3.090 -8.120 -8.210 323 HE2 TYR 44 HE2 TYR 44 1.081 -8.879 -8.658 324 HH TYR 44 HH TYR 44 -0.696 -9.100 -10.364 325 H PHE 45 H PHE 45 -3.071 -9.184 -3.277 326 HA PHE 45 HA PHE 45 -4.786 -11.539 -3.559 327 HB2 PHE 45 2HB PHE 45 -5.654 -8.650 -3.102 328 HB3 PHE 45 1HB PHE 45 -6.590 -10.104 -2.789 329 HD1 PHE 45 HD1 PHE 45 -5.616 -11.741 -0.984 330 HD2 PHE 45 HD2 PHE 45 -4.470 -7.637 -1.327 331 HE1 PHE 45 HE1 PHE 45 -4.826 -11.756 1.341 332 HE2 PHE 45 HE2 PHE 45 -3.680 -7.663 1.001 333 HZ PHE 45 HZ PHE 45 -3.854 -9.723 2.337 334 H ASP 46 H ASP 46 -6.108 -11.920 -5.399 335 HA ASP 46 HA ASP 46 -5.004 -11.015 -7.849 336 HB2 ASP 46 2HB ASP 46 -6.005 -13.261 -7.651 337 HB3 ASP 46 1HB ASP 46 -7.584 -12.563 -7.327 338 HA PRO 47 HA PRO 47 -6.880 -7.015 -8.294 339 HB2 PRO 47 2HB PRO 47 -7.076 -6.953 -11.118 340 HB3 PRO 47 1HB PRO 47 -5.630 -6.553 -10.176 341 HG2 PRO 47 2HG PRO 47 -6.347 -9.154 -11.492 342 HG3 PRO 47 1HG PRO 47 -4.786 -8.298 -11.461 343 HD2 PRO 47 2HD PRO 47 -5.153 -10.361 -9.845 344 HD3 PRO 47 1HD PRO 47 -4.351 -8.900 -9.222 345 H ASP 48 H ASP 48 -8.927 -6.796 -7.591 346 HA ASP 48 HA ASP 48 -11.177 -7.813 -9.252 347 HB2 ASP 48 2HB ASP 48 -11.043 -9.048 -7.111 348 HB3 ASP 48 1HB ASP 48 -11.093 -7.531 -6.216 349 HA PRO 49 HA PRO 49 -12.018 -3.347 -9.448 350 HB2 PRO 49 2HB PRO 49 -14.518 -4.027 -10.895 351 HB3 PRO 49 1HB PRO 49 -13.078 -3.167 -11.477 352 HG2 PRO 49 2HG PRO 49 -13.734 -5.664 -12.319 353 HG3 PRO 49 1HG PRO 49 -12.058 -5.076 -12.236 354 HD2 PRO 49 2HD PRO 49 -13.529 -6.882 -10.328 355 HD3 PRO 49 1HD PRO 49 -11.844 -6.967 -10.896 356 H ASP 50 H ASP 50 -14.402 -5.783 -8.418 357 HA ASP 50 HA ASP 50 -16.342 -3.937 -7.417 358 HB2 ASP 50 2HB ASP 50 -16.865 -6.243 -8.227 359 HB3 ASP 50 1HB ASP 50 -16.051 -6.911 -6.820 360 H TYR 51 H TYR 51 -13.441 -5.255 -6.059 361 HA TYR 51 HA TYR 51 -14.246 -4.735 -3.279 362 HB2 TYR 51 2HB TYR 51 -12.877 -6.789 -3.897 363 HB3 TYR 51 1HB TYR 51 -11.535 -5.719 -4.289 364 HD1 TYR 51 HD2 TYR 51 -13.842 -5.251 -1.385 365 HD2 TYR 51 HD1 TYR 51 -9.971 -6.557 -2.649 366 HE1 TYR 51 HE2 TYR 51 -13.119 -5.357 0.949 367 HE2 TYR 51 HE1 TYR 51 -9.255 -6.668 -0.306 368 HH TYR 51 HH TYR 51 -11.474 -6.432 2.299 369 H ARG 52 H ARG 52 -13.160 -2.920 -5.826 370 HA ARG 52 HA ARG 52 -11.380 -1.144 -4.380 371 HB2 ARG 52 2HB ARG 52 -11.206 -1.611 -6.878 372 HB3 ARG 52 1HB ARG 52 -12.687 -0.684 -7.105 373 HG2 ARG 52 2HG ARG 52 -11.647 1.347 -6.438 374 HG3 ARG 52 1HG ARG 52 -10.273 0.504 -5.720 375 HD2 ARG 52 2HD ARG 52 -9.440 1.436 -7.722 376 HD3 ARG 52 1HD ARG 52 -9.689 -0.267 -8.100 377 HE ARG 52 HE ARG 52 -11.927 0.611 -9.068 378 HH11 ARG 52 1HH1 ARG 52 -8.856 2.339 -9.208 379 HH12 ARG 52 2HH1 ARG 52 -9.263 3.185 -10.670 380 HH21 ARG 52 1HH2 ARG 52 -12.431 1.706 -11.015 381 HH22 ARG 52 2HH2 ARG 52 -11.285 2.824 -11.690 382 H VAL 53 H VAL 53 -12.015 0.617 -3.236 383 HA VAL 53 HA VAL 53 -14.859 1.473 -3.253 384 HB VAL 53 HB VAL 53 -14.619 2.083 -0.865 385 HG11 VAL 53 1HG1 VAL 53 -13.859 -0.823 -1.341 386 HG12 VAL 53 2HG1 VAL 53 -15.492 -0.152 -1.356 387 HG13 VAL 53 3HG1 VAL 53 -14.565 -0.173 0.145 388 HG21 VAL 53 3HG2 VAL 53 -11.823 0.879 -0.991 389 HG22 VAL 53 1HG2 VAL 53 -12.642 1.410 0.482 390 HG23 VAL 53 2HG2 VAL 53 -12.216 2.583 -0.764 391 H GLU 54 H GLU 54 -15.044 3.804 -2.374 392 HA GLU 54 HA GLU 54 -12.831 5.512 -3.370 393 HB2 GLU 54 2HB GLU 54 -14.507 7.302 -3.610 394 HB3 GLU 54 1HB GLU 54 -14.991 5.877 -4.519 395 HG2 GLU 54 2HG GLU 54 -16.534 5.273 -2.607 396 HG3 GLU 54 1HG GLU 54 -16.128 6.818 -1.867 397 H ALA 55 H ALA 55 -12.278 7.391 -2.081 398 HA ALA 55 HA ALA 55 -13.017 7.410 0.750 399 HB1 ALA 55 3HB ALA 55 -11.202 5.742 0.648 400 HB2 ALA 55 1HB ALA 55 -10.684 7.184 1.524 401 HB3 ALA 55 2HB ALA 55 -10.152 6.920 -0.140 402 H THR 56 H THR 56 -12.506 9.329 1.789 403 HA THR 56 HA THR 56 -11.846 11.647 0.129 404 HB THR 56 HB THR 56 -12.902 11.527 2.995 405 HG1 THR 56 HG1 THR 56 -14.199 11.575 0.479 406 HG21 THR 56 3HG2 THR 56 -13.564 13.882 2.611 407 HG22 THR 56 1HG2 THR 56 -12.812 13.839 1.012 408 HG23 THR 56 2HG2 THR 56 -11.817 13.689 2.466 409 H VAL 57 H VAL 57 -9.888 12.525 0.262 410 HA VAL 57 HA VAL 57 -7.784 11.648 1.996 411 HB VAL 57 HB VAL 57 -7.825 14.112 0.170 412 HG11 VAL 57 1HG1 VAL 57 -5.377 13.810 0.038 413 HG12 VAL 57 2HG1 VAL 57 -5.478 12.433 1.137 414 HG13 VAL 57 3HG1 VAL 57 -5.900 14.048 1.709 415 HG21 VAL 57 3HG2 VAL 57 -7.073 11.273 -0.605 416 HG22 VAL 57 1HG2 VAL 57 -6.964 12.702 -1.637 417 HG23 VAL 57 2HG2 VAL 57 -8.541 12.120 -1.099 418 H THR 58 H THR 58 -7.020 12.670 3.828 419 HA THR 58 HA THR 58 -8.057 15.330 4.583 420 HB THR 58 HB THR 58 -7.822 12.975 6.529 421 HG1 THR 58 HG1 THR 58 -9.926 13.921 4.942 422 HG21 THR 58 3HG2 THR 58 -7.499 15.162 7.621 423 HG22 THR 58 1HG2 THR 58 -9.059 14.475 8.077 424 HG23 THR 58 2HG2 THR 58 -8.982 15.772 6.882 425 H VAL 59 H VAL 59 -6.270 16.456 4.338 426 HA VAL 59 HA VAL 59 -3.600 15.347 4.713 427 HB VAL 59 HB VAL 59 -4.605 17.968 3.490 428 HG11 VAL 59 1HG1 VAL 59 -2.433 18.437 4.568 429 HG12 VAL 59 2HG1 VAL 59 -2.284 18.474 2.811 430 HG13 VAL 59 3HG1 VAL 59 -1.702 17.075 3.716 431 HG21 VAL 59 3HG2 VAL 59 -4.958 15.947 2.119 432 HG22 VAL 59 1HG2 VAL 59 -3.239 15.558 2.230 433 HG23 VAL 59 2HG2 VAL 59 -3.764 17.010 1.374 434 H HIS 60 H HIS 60 -2.185 16.014 6.279 435 HA HIS 60 HA HIS 60 -3.208 17.700 8.480 436 HB2 HIS 60 2HB HIS 60 -0.877 15.735 8.299 437 HB3 HIS 60 1HB HIS 60 -1.218 16.718 9.725 438 HD1 HIS 60 HD1 HIS 60 -3.433 14.478 7.535 439 HD2 HIS 60 HD2 HIS 60 -2.513 15.155 11.535 440 HE1 HIS 60 HE1 HIS 60 -4.906 12.926 8.833 441 HE2 HIS 60 HE2 HIS 60 -4.218 13.238 11.232 442 H GLU 61 H GLU 61 -2.448 19.712 8.764 443 HA GLU 61 HA GLU 61 -0.703 20.963 6.872 444 HB2 GLU 61 2HB GLU 61 -1.016 23.011 8.239 445 HB3 GLU 61 1HB GLU 61 -2.542 22.212 7.882 446 HG2 GLU 61 2HG GLU 61 -2.469 21.183 10.179 447 HG3 GLU 61 1HG GLU 61 -1.036 22.152 10.511 448 H THR 62 H THR 62 -0.207 19.559 10.029 449 HA THR 62 HA THR 62 2.677 20.227 9.966 450 HB THR 62 HB THR 62 2.639 19.754 12.457 451 HG1 THR 62 HG1 THR 62 0.796 18.576 12.745 452 HG21 THR 62 3HG2 THR 62 0.794 22.005 11.581 453 HG22 THR 62 1HG2 THR 62 2.554 22.100 11.701 454 HG23 THR 62 2HG2 THR 62 1.579 21.879 13.155 455 HA PRO 63 HA PRO 63 2.470 15.676 9.016 456 HB2 PRO 63 2HB PRO 63 4.934 15.542 7.795 457 HB3 PRO 63 1HB PRO 63 3.479 16.108 6.957 458 HG2 PRO 63 2HG PRO 63 5.666 17.727 8.229 459 HG3 PRO 63 1HG PRO 63 4.884 17.945 6.644 460 HD2 PRO 63 2HD PRO 63 4.168 19.436 8.786 461 HD3 PRO 63 1HD PRO 63 2.980 18.931 7.564 462 H GLU 64 H GLU 64 2.928 14.203 10.596 463 HA GLU 64 HA GLU 64 5.054 14.736 12.542 464 HB2 GLU 64 2HB GLU 64 3.931 13.042 13.938 465 HB3 GLU 64 1HB GLU 64 2.789 14.262 13.391 466 HG2 GLU 64 2HG GLU 64 2.169 12.591 11.521 467 HG3 GLU 64 1HG GLU 64 3.044 11.394 12.468 468 H SER 65 H SER 65 6.312 12.863 13.352 469 HA SER 65 HA SER 65 7.692 11.625 11.088 470 HB2 SER 65 2HB SER 65 8.461 11.776 14.033 471 HB3 SER 65 1HB SER 65 9.522 11.354 12.689 472 HG SER 65 HG SER 65 8.631 13.824 13.552 473 H VAL 66 H VAL 66 6.931 9.654 10.519 474 HA VAL 66 HA VAL 66 6.419 7.581 12.589 475 HB VAL 66 HB VAL 66 5.158 7.540 9.799 476 HG11 VAL 66 1HG1 VAL 66 3.511 6.024 10.822 477 HG12 VAL 66 2HG1 VAL 66 4.307 6.181 12.388 478 HG13 VAL 66 3HG1 VAL 66 5.153 5.412 11.042 479 HG21 VAL 66 3HG2 VAL 66 3.069 8.513 10.740 480 HG22 VAL 66 1HG2 VAL 66 4.414 9.657 10.758 481 HG23 VAL 66 2HG2 VAL 66 3.918 8.856 12.248 482 H ASP 67 H ASP 67 8.082 6.111 12.533 483 HA ASP 67 HA ASP 67 9.936 6.103 10.298 484 HB2 ASP 67 2HB ASP 67 11.369 4.659 11.691 485 HB3 ASP 67 1HB ASP 67 10.860 6.091 12.569 486 H LEU 68 H LEU 68 9.612 4.928 8.571 487 HA LEU 68 HA LEU 68 8.468 2.193 8.744 488 HB2 LEU 68 2HB LEU 68 8.086 3.954 6.295 489 HB3 LEU 68 1HB LEU 68 7.197 2.514 6.745 490 HG LEU 68 HG LEU 68 6.917 5.265 8.033 491 HD11 LEU 68 1HD1 LEU 68 4.722 5.361 6.997 492 HD12 LEU 68 2HD1 LEU 68 4.969 3.778 6.255 493 HD13 LEU 68 3HD1 LEU 68 5.971 5.147 5.772 494 HD21 LEU 68 3HD2 LEU 68 6.477 3.518 9.702 495 HD22 LEU 68 1HD2 LEU 68 5.290 2.775 8.627 496 HD23 LEU 68 2HD2 LEU 68 5.009 4.391 9.278 497 H GLU 69 H GLU 69 9.320 0.750 7.043 498 HA GLU 69 HA GLU 69 12.081 1.020 6.430 499 HB2 GLU 69 2HB GLU 69 11.698 -0.981 4.929 500 HB3 GLU 69 1HB GLU 69 11.142 -1.208 6.583 501 HG2 GLU 69 2HG GLU 69 8.824 -0.775 5.883 502 HG3 GLU 69 1HG GLU 69 9.363 -0.486 4.232 503 H THR 70 H THR 70 13.129 1.788 4.627 504 HA THR 70 HA THR 70 11.619 3.021 2.440 505 HB THR 70 HB THR 70 13.655 4.169 3.420 506 HG1 THR 70 HG1 THR 70 12.989 4.734 1.324 507 HG21 THR 70 3HG2 THR 70 15.236 1.994 2.002 508 HG22 THR 70 1HG2 THR 70 15.103 2.181 3.752 509 HG23 THR 70 2HG2 THR 70 15.910 3.422 2.790 510 H SER 71 H SER 71 12.830 2.622 0.219 511 HA SER 71 HA SER 71 12.261 -0.003 -0.641 512 HB2 SER 71 2HB SER 71 13.325 0.853 -2.803 513 HB3 SER 71 1HB SER 71 11.988 1.822 -2.185 514 HG SER 71 HG SER 71 14.680 2.437 -2.414 515 H ASP 72 H ASP 72 15.418 1.764 -0.443 516 HA ASP 72 HA ASP 72 16.971 -0.587 -0.887 517 HB2 ASP 72 2HB ASP 72 17.959 2.143 0.040 518 HB3 ASP 72 1HB ASP 72 18.873 0.914 -0.824 519 H ASP 73 H ASP 73 15.573 -1.304 1.297 520 HA ASP 73 HA ASP 73 15.748 -2.433 3.188 521 HB2 ASP 73 2HB ASP 73 17.794 -3.782 3.531 522 HB3 ASP 73 1HB ASP 73 17.230 -3.780 1.871 523 H ARG 74 H ARG 74 16.499 0.533 3.554 524 HA ARG 74 HA ARG 74 17.787 0.290 6.220 525 HB2 ARG 74 2HB ARG 74 18.797 1.803 4.391 526 HB3 ARG 74 1HB ARG 74 17.393 2.841 4.573 527 HG2 ARG 74 2HG ARG 74 18.026 3.387 6.850 528 HG3 ARG 74 1HG ARG 74 19.322 2.192 6.831 529 HD2 ARG 74 2HD ARG 74 19.245 4.597 4.980 530 HD3 ARG 74 1HD ARG 74 20.032 4.619 6.558 531 HE ARG 74 HE ARG 74 21.274 2.548 5.506 532 HH11 ARG 74 1HH1 ARG 74 20.514 5.575 3.861 533 HH12 ARG 74 2HH1 ARG 74 21.894 5.480 2.816 534 HH21 ARG 74 1HH2 ARG 74 23.101 2.484 4.175 535 HH22 ARG 74 2HH2 ARG 74 23.358 3.731 2.994 536 H THR 75 H THR 75 16.814 2.423 7.551 537 HA THR 75 HA THR 75 13.872 2.187 7.634 538 HB THR 75 HB THR 75 15.684 2.432 10.100 539 HG1 THR 75 HG1 THR 75 15.049 0.223 10.472 540 HG21 THR 75 3HG2 THR 75 13.409 3.398 10.397 541 HG22 THR 75 1HG2 THR 75 13.607 1.936 11.368 542 HG23 THR 75 2HG2 THR 75 12.693 1.877 9.860 543 H VAL 76 H VAL 76 12.918 4.217 7.726 544 HA VAL 76 HA VAL 76 14.569 6.613 8.087 545 HB VAL 76 HB VAL 76 13.761 7.652 5.928 546 HG11 VAL 76 1HG1 VAL 76 16.072 6.840 6.093 547 HG12 VAL 76 2HG1 VAL 76 15.446 6.627 4.457 548 HG13 VAL 76 3HG1 VAL 76 15.568 5.239 5.543 549 HG21 VAL 76 3HG2 VAL 76 12.987 6.213 4.087 550 HG22 VAL 76 1HG2 VAL 76 11.874 6.181 5.457 551 HG23 VAL 76 2HG2 VAL 76 12.966 4.824 5.179 552 H ARG 77 H ARG 77 13.406 8.489 8.383 553 HA ARG 77 HA ARG 77 10.826 8.249 9.601 554 HB2 ARG 77 2HB ARG 77 12.457 9.753 10.554 555 HB3 ARG 77 1HB ARG 77 12.697 10.589 9.032 556 HG2 ARG 77 2HG ARG 77 9.966 10.703 10.298 557 HG3 ARG 77 1HG ARG 77 11.263 11.650 11.022 558 HD2 ARG 77 2HD ARG 77 10.230 11.860 8.173 559 HD3 ARG 77 1HD ARG 77 10.036 13.046 9.473 560 HE ARG 77 HE ARG 77 12.547 13.221 9.440 561 HH11 ARG 77 1HH1 ARG 77 10.823 12.330 6.513 562 HH12 ARG 77 2HH1 ARG 77 12.076 12.924 5.466 563 HH21 ARG 77 1HH2 ARG 77 14.198 13.926 8.045 564 HH22 ARG 77 2HH2 ARG 77 13.975 13.824 6.322 565 H TYR 78 H TYR 78 8.969 8.274 8.526 566 HA TYR 78 HA TYR 78 8.670 9.710 5.953 567 HB2 TYR 78 2HB TYR 78 6.985 7.571 7.314 568 HB3 TYR 78 1HB TYR 78 6.321 8.568 6.025 569 HD1 TYR 78 HD2 TYR 78 9.522 6.623 6.558 570 HD2 TYR 78 HD1 TYR 78 6.230 7.472 3.968 571 HE1 TYR 78 HE2 TYR 78 10.405 5.043 4.907 572 HE2 TYR 78 HE1 TYR 78 7.111 5.886 2.317 573 HH TYR 78 HH TYR 78 9.546 3.657 3.030 574 H LEU 79 H LEU 79 7.104 11.266 5.721 575 HA LEU 79 HA LEU 79 6.139 12.563 8.190 576 HB2 LEU 79 2HB LEU 79 6.567 13.603 5.364 577 HB3 LEU 79 1HB LEU 79 5.677 14.508 6.573 578 HG LEU 79 HG LEU 79 8.613 13.715 6.751 579 HD11 LEU 79 1HD1 LEU 79 7.349 16.456 6.412 580 HD12 LEU 79 2HD1 LEU 79 8.197 15.540 5.164 581 HD13 LEU 79 3HD1 LEU 79 9.075 16.115 6.579 582 HD21 LEU 79 3HD2 LEU 79 8.688 15.045 8.840 583 HD22 LEU 79 1HD2 LEU 79 7.614 13.655 8.996 584 HD23 LEU 79 2HD2 LEU 79 6.939 15.270 8.767 585 H HIS 80 H HIS 80 4.052 12.563 8.675 586 HA HIS 80 HA HIS 80 2.184 11.033 7.106 587 HB2 HIS 80 2HB HIS 80 2.184 10.909 9.573 588 HB3 HIS 80 1HB HIS 80 1.801 12.623 9.677 589 HD2 HIS 80 HD2 HIS 80 -0.215 10.353 7.204 590 HE1 HIS 80 HE1 HIS 80 -2.660 11.344 10.498 591 HE2 HIS 80 HE2 HIS 80 -2.530 10.087 8.310 592 H VAL 81 H VAL 81 1.611 11.989 5.281 593 HA VAL 81 HA VAL 81 1.088 14.862 5.163 594 HB VAL 81 HB VAL 81 1.164 14.621 2.721 595 HG11 VAL 81 1HG1 VAL 81 3.557 14.001 2.528 596 HG12 VAL 81 2HG1 VAL 81 3.502 13.270 4.134 597 HG13 VAL 81 3HG1 VAL 81 3.256 15.008 3.946 598 HG21 VAL 81 3HG2 VAL 81 1.715 12.475 1.636 599 HG22 VAL 81 1HG2 VAL 81 0.178 12.358 2.496 600 HG23 VAL 81 2HG2 VAL 81 1.634 11.646 3.192 601 H ALA 82 H ALA 82 -0.724 11.824 4.865 602 HA ALA 82 HA ALA 82 -3.240 13.343 4.760 603 HB1 ALA 82 3HB ALA 82 -2.628 13.143 2.379 604 HB2 ALA 82 1HB ALA 82 -4.069 12.190 2.737 605 HB3 ALA 82 2HB ALA 82 -2.506 11.391 2.540 606 H THR 83 H THR 83 -5.141 11.981 4.986 607 HA THR 83 HA THR 83 -4.774 9.179 5.822 608 HB THR 83 HB THR 83 -6.493 11.218 7.354 609 HG1 THR 83 HG1 THR 83 -4.447 9.937 8.695 610 HG21 THR 83 3HG2 THR 83 -7.430 8.908 7.387 611 HG22 THR 83 1HG2 THR 83 -6.848 9.400 8.979 612 HG23 THR 83 2HG2 THR 83 -5.887 8.300 7.992 613 H LEU 84 H LEU 84 -6.341 7.898 4.872 614 HA LEU 84 HA LEU 84 -8.208 9.254 3.007 615 HB2 LEU 84 2HB LEU 84 -7.161 6.397 2.783 616 HB3 LEU 84 1HB LEU 84 -7.994 7.331 1.553 617 HG LEU 84 HG LEU 84 -5.142 7.716 2.534 618 HD11 LEU 84 1HD1 LEU 84 -4.502 7.195 0.224 619 HD12 LEU 84 2HD1 LEU 84 -6.198 6.939 -0.196 620 HD13 LEU 84 3HD1 LEU 84 -5.406 5.875 0.968 621 HD21 LEU 84 3HD2 LEU 84 -6.626 9.490 0.564 622 HD22 LEU 84 1HD2 LEU 84 -4.897 9.563 0.919 623 HD23 LEU 84 2HD2 LEU 84 -6.071 9.947 2.174 624 H SER 85 H SER 85 -10.086 9.367 4.116 625 HA SER 85 HA SER 85 -11.034 7.261 5.889 626 HB2 SER 85 2HB SER 85 -12.171 10.010 5.217 627 HB3 SER 85 1HB SER 85 -12.759 8.939 6.494 628 HG SER 85 HG SER 85 -10.459 9.027 7.239 629 H PHE 86 H PHE 86 -12.601 5.850 5.380 630 HA PHE 86 HA PHE 86 -14.580 6.233 3.303 631 HB2 PHE 86 2HB PHE 86 -13.974 4.078 2.122 632 HB3 PHE 86 1HB PHE 86 -12.801 5.357 1.892 633 HD1 PHE 86 HD1 PHE 86 -10.574 5.241 3.056 634 HD2 PHE 86 HD2 PHE 86 -13.330 1.971 3.197 635 HE1 PHE 86 HE1 PHE 86 -8.758 3.738 3.753 636 HE2 PHE 86 HE2 PHE 86 -11.498 0.482 3.898 637 HZ PHE 86 HZ PHE 86 -9.221 1.359 4.175 638 H ASP 87 H ASP 87 -15.749 3.894 3.155 639 HA ASP 87 HA ASP 87 -16.086 2.814 5.901 640 HB2 ASP 87 2HB ASP 87 -18.122 3.988 5.187 641 HB3 ASP 87 1HB ASP 87 -18.162 3.087 3.675 642 H LEU 88 H LEU 88 -15.509 0.741 6.109 643 HA LEU 88 HA LEU 88 -15.731 -1.160 3.895 644 HB2 LEU 88 2HB LEU 88 -13.395 -0.272 3.769 645 HB3 LEU 88 1HB LEU 88 -13.140 -0.724 5.443 646 HG LEU 88 HG LEU 88 -13.473 -3.142 4.784 647 HD11 LEU 88 1HD1 LEU 88 -14.791 -2.839 2.748 648 HD12 LEU 88 2HD1 LEU 88 -13.340 -3.781 2.413 649 HD13 LEU 88 3HD1 LEU 88 -13.415 -2.081 1.940 650 HD21 LEU 88 3HD2 LEU 88 -11.248 -3.427 3.787 651 HD22 LEU 88 1HD2 LEU 88 -11.218 -2.209 5.064 652 HD23 LEU 88 2HD2 LEU 88 -11.197 -1.712 3.370 653 H ASP 89 H ASP 89 -16.182 -3.167 4.622 654 HA ASP 89 HA ASP 89 -16.849 -4.889 5.920 655 HB2 ASP 89 2HB ASP 89 -14.753 -4.675 7.207 656 HB3 ASP 89 1HB ASP 89 -15.483 -3.448 8.225 657 H GLY 90 H GLY 90 -17.118 -2.242 8.286 658 HA2 GLY 90 2HA GLY 90 -19.861 -1.649 7.745 659 HA3 GLY 90 1HA GLY 90 -19.706 -2.680 9.165 660 H GLU 91 H GLU 91 -17.236 -0.365 8.313 661 HA GLU 91 HA GLU 91 -18.061 1.572 10.356 662 HB2 GLU 91 2HB GLU 91 -15.936 1.299 11.623 663 HB3 GLU 91 1HB GLU 91 -16.895 -0.177 11.651 664 HG2 GLU 91 2HG GLU 91 -15.478 -1.196 9.958 665 HG3 GLU 91 1HG GLU 91 -14.564 0.297 9.766 666 H SER 92 H SER 92 -16.700 3.459 10.413 667 HA SER 92 HA SER 92 -15.768 4.288 7.813 668 HB2 SER 92 2HB SER 92 -17.025 5.836 9.323 669 HB3 SER 92 1HB SER 92 -15.664 5.826 10.446 670 HG SER 92 HG SER 92 -15.451 6.601 7.720 671 H ARG 93 H ARG 93 -14.070 2.915 7.433 672 HA ARG 93 HA ARG 93 -11.705 2.739 9.084 673 HB2 ARG 93 2HB ARG 93 -12.333 1.720 6.290 674 HB3 ARG 93 1HB ARG 93 -10.807 1.412 7.098 675 HG2 ARG 93 2HG ARG 93 -13.454 0.568 8.294 676 HG3 ARG 93 1HG ARG 93 -12.562 -0.446 7.159 677 HD2 ARG 93 2HD ARG 93 -12.036 -1.157 9.399 678 HD3 ARG 93 1HD ARG 93 -10.608 -0.394 8.709 679 HE ARG 93 HE ARG 93 -12.407 0.869 10.704 680 HH11 ARG 93 1HH1 ARG 93 -9.175 0.496 9.342 681 HH12 ARG 93 2HH1 ARG 93 -8.427 1.512 10.530 682 HH21 ARG 93 1HH2 ARG 93 -11.375 2.138 12.297 683 HH22 ARG 93 2HH2 ARG 93 -9.670 2.436 12.196 684 H ASP 94 H ASP 94 -9.734 3.691 8.768 685 HA ASP 94 HA ASP 94 -9.370 5.543 6.494 686 HB2 ASP 94 2HB ASP 94 -8.405 7.251 7.959 687 HB3 ASP 94 1HB ASP 94 -10.048 6.891 8.452 688 H LEU 95 H LEU 95 -7.459 5.417 5.519 689 HA LEU 95 HA LEU 95 -5.229 3.911 6.779 690 HB2 LEU 95 2HB LEU 95 -6.033 3.996 3.838 691 HB3 LEU 95 1HB LEU 95 -4.534 3.290 4.425 692 HG LEU 95 HG LEU 95 -7.354 2.294 4.973 693 HD11 LEU 95 1HD1 LEU 95 -6.490 1.681 2.766 694 HD12 LEU 95 2HD1 LEU 95 -6.623 0.264 3.804 695 HD13 LEU 95 3HD1 LEU 95 -5.041 0.988 3.504 696 HD21 LEU 95 3HD2 LEU 95 -6.072 2.053 7.029 697 HD22 LEU 95 1HD2 LEU 95 -4.748 1.277 6.152 698 HD23 LEU 95 2HD2 LEU 95 -6.313 0.474 6.290 699 H HIS 96 H HIS 96 -3.318 4.974 6.909 700 HA HIS 96 HA HIS 96 -3.436 7.832 6.278 701 HB2 HIS 96 2HB HIS 96 -1.491 6.228 8.005 702 HB3 HIS 96 1HB HIS 96 -1.471 7.980 7.819 703 HD2 HIS 96 HD2 HIS 96 -4.084 5.308 9.161 704 HE1 HIS 96 HE1 HIS 96 -4.390 8.909 11.339 705 HE2 HIS 96 HE2 HIS 96 -5.450 6.675 10.870 706 H ALA 97 H ALA 97 -2.215 8.747 4.770 707 HA ALA 97 HA ALA 97 -0.429 7.102 3.102 708 HB1 ALA 97 3HB ALA 97 -2.290 8.215 1.931 709 HB2 ALA 97 1HB ALA 97 -0.751 8.900 1.414 710 HB3 ALA 97 2HB ALA 97 -1.777 9.786 2.549 711 H PHE 98 H PHE 98 1.687 7.433 3.258 712 HA PHE 98 HA PHE 98 2.765 9.936 4.411 713 HB2 PHE 98 2HB PHE 98 4.121 7.218 4.721 714 HB3 PHE 98 1HB PHE 98 4.446 8.707 5.590 715 HD1 PHE 98 HD1 PHE 98 2.916 9.419 7.449 716 HD2 PHE 98 HD2 PHE 98 2.474 5.645 5.512 717 HE1 PHE 98 HE1 PHE 98 1.580 8.596 9.342 718 HE2 PHE 98 HE2 PHE 98 1.139 4.832 7.409 719 HZ PHE 98 HZ PHE 98 0.688 6.301 9.317 720 H ARG 99 H ARG 99 5.023 10.224 3.824 721 HA ARG 99 HA ARG 99 6.366 8.710 1.827 722 HB2 ARG 99 2HB ARG 99 6.591 10.470 0.113 723 HB3 ARG 99 1HB ARG 99 4.923 9.961 0.291 724 HG2 ARG 99 2HG ARG 99 5.103 12.173 2.011 725 HG3 ARG 99 1HG ARG 99 6.110 12.632 0.640 726 HD2 ARG 99 2HD ARG 99 3.218 11.722 0.500 727 HD3 ARG 99 1HD ARG 99 3.790 13.380 0.347 728 HE ARG 99 HE ARG 99 4.993 11.638 -1.592 729 HH11 ARG 99 1HH1 ARG 99 2.055 13.483 -0.948 730 HH12 ARG 99 2HH1 ARG 99 1.643 13.611 -2.629 731 HH21 ARG 99 1HH2 ARG 99 4.444 11.821 -3.756 732 HH22 ARG 99 2HH2 ARG 99 2.994 12.675 -4.221 733 H GLN 100 H GLN 100 8.622 9.434 1.699 734 HA GLN 100 HA GLN 100 9.548 9.514 4.273 735 HB2 GLN 100 2HB GLN 100 11.111 10.251 1.773 736 HB3 GLN 100 1HB GLN 100 11.836 9.864 3.334 737 HG2 GLN 100 2HG GLN 100 10.774 7.600 3.218 738 HG3 GLN 100 1HG GLN 100 10.180 8.000 1.609 739 HE21 GLN 100 1HE2 GLN 100 13.386 8.848 2.885 740 HE22 GLN 100 2HE2 GLN 100 14.268 7.843 1.796 741 H ALA 101 H ALA 101 10.497 12.270 2.126 742 HA ALA 101 HA ALA 101 9.873 14.084 4.397 743 HB1 ALA 101 3HB ALA 101 11.991 14.470 2.251 744 HB2 ALA 101 1HB ALA 101 12.277 14.011 3.930 745 HB3 ALA 101 2HB ALA 101 11.615 15.602 3.554 746 H ALA 102 H ALA 102 10.451 14.639 0.914 747 HA ALA 102 HA ALA 102 7.838 15.995 0.669 748 HB1 ALA 102 3HB ALA 102 9.564 17.696 1.167 749 HB2 ALA 102 1HB ALA 102 8.916 17.891 -0.462 750 HB3 ALA 102 2HB ALA 102 10.502 17.155 -0.226 751 H ASP 103 H ASP 103 8.221 13.427 -0.265 752 HA ASP 103 HA ASP 103 9.130 13.131 -2.913 753 HB2 ASP 103 2HB ASP 103 8.620 11.150 -1.605 754 HB3 ASP 103 1HB ASP 103 6.954 11.661 -1.367 755 H GLU 104 H GLU 104 8.222 13.621 -4.870 756 HA GLU 104 HA GLU 104 5.441 14.651 -4.994 757 HB2 GLU 104 2HB GLU 104 6.190 16.334 -6.658 758 HB3 GLU 104 1HB GLU 104 6.950 16.568 -5.087 759 HG2 GLU 104 2HG GLU 104 9.036 15.610 -5.884 760 HG3 GLU 104 1HG GLU 104 8.299 15.186 -7.430 761 H SER 105 H SER 105 6.994 12.038 -5.681 762 HA SER 105 HA SER 105 6.420 11.636 -8.486 763 HB2 SER 105 2HB SER 105 7.006 9.547 -6.343 764 HB3 SER 105 1HB SER 105 7.221 9.380 -8.088 765 HG SER 105 HG SER 105 8.904 10.396 -6.231 766 H ARG 106 H ARG 106 4.269 12.247 -6.230 767 HA ARG 106 HA ARG 106 2.122 11.847 -5.747 768 HB2 ARG 106 2HB ARG 106 2.076 10.075 -8.236 769 HB3 ARG 106 1HB ARG 106 0.658 10.639 -7.365 770 HG2 ARG 106 2HG ARG 106 2.621 12.376 -8.899 771 HG3 ARG 106 1HG ARG 106 0.990 11.943 -9.403 772 HD2 ARG 106 2HD ARG 106 0.036 13.225 -7.556 773 HD3 ARG 106 1HD ARG 106 1.648 13.580 -6.929 774 HE ARG 106 HE ARG 106 0.363 14.758 -9.290 775 HH11 ARG 106 1HH1 ARG 106 3.292 14.565 -7.343 776 HH12 ARG 106 2HH1 ARG 106 3.962 16.022 -8.001 777 HH21 ARG 106 1HH2 ARG 106 1.279 16.672 -10.129 778 HH22 ARG 106 2HH2 ARG 106 2.833 17.202 -9.561 779 H THR 107 H THR 107 4.407 9.928 -4.927 780 HA THR 107 HA THR 107 3.145 7.324 -4.775 781 HB THR 107 HB THR 107 5.826 8.239 -3.628 782 HG1 THR 107 HG1 THR 107 5.003 7.794 -6.205 783 HG21 THR 107 3HG2 THR 107 6.429 5.840 -3.742 784 HG22 THR 107 1HG2 THR 107 4.813 5.449 -4.336 785 HG23 THR 107 2HG2 THR 107 5.025 6.072 -2.698 786 H LEU 108 H LEU 108 1.386 7.636 -3.407 787 HA LEU 108 HA LEU 108 1.811 8.449 -0.621 788 HB2 LEU 108 2HB LEU 108 -0.735 7.484 -1.973 789 HB3 LEU 108 1HB LEU 108 -0.613 8.161 -0.358 790 HG LEU 108 HG LEU 108 -0.279 9.616 -3.001 791 HD11 LEU 108 1HD1 LEU 108 -2.593 9.214 -2.303 792 HD12 LEU 108 2HD1 LEU 108 -2.198 10.929 -2.246 793 HD13 LEU 108 3HD1 LEU 108 -2.278 9.995 -0.750 794 HD21 LEU 108 3HD2 LEU 108 0.166 11.672 -1.707 795 HD22 LEU 108 1HD2 LEU 108 1.433 10.471 -1.459 796 HD23 LEU 108 2HD2 LEU 108 0.210 10.734 -0.213 797 H PHE 109 H PHE 109 2.398 7.007 0.800 798 HA PHE 109 HA PHE 109 2.303 4.121 0.204 799 HB2 PHE 109 2HB PHE 109 4.513 5.281 0.676 800 HB3 PHE 109 1HB PHE 109 3.923 5.676 2.283 801 HD1 PHE 109 HD1 PHE 109 4.525 2.705 0.047 802 HD2 PHE 109 HD2 PHE 109 4.439 4.202 4.056 803 HE1 PHE 109 HE1 PHE 109 5.473 0.585 0.870 804 HE2 PHE 109 HE2 PHE 109 5.385 2.079 4.866 805 HZ PHE 109 HZ PHE 109 5.905 0.273 3.276 806 H VAL 110 H VAL 110 0.410 3.287 1.026 807 HA VAL 110 HA VAL 110 -0.598 4.274 3.648 808 HB VAL 110 HB VAL 110 -2.880 3.319 2.902 809 HG11 VAL 110 1HG1 VAL 110 -3.510 5.331 1.634 810 HG12 VAL 110 2HG1 VAL 110 -1.807 5.698 1.347 811 HG13 VAL 110 3HG1 VAL 110 -2.453 5.732 2.988 812 HG21 VAL 110 3HG2 VAL 110 -3.334 3.130 0.480 813 HG22 VAL 110 1HG2 VAL 110 -2.133 1.941 0.988 814 HG23 VAL 110 2HG2 VAL 110 -1.624 3.393 0.126 815 HA PRO 111 HA PRO 111 0.516 -0.064 4.813 816 HB2 PRO 111 2HB PRO 111 0.761 1.243 7.505 817 HB3 PRO 111 1HB PRO 111 1.922 0.203 6.652 818 HG2 PRO 111 2HG PRO 111 2.373 2.830 6.930 819 HG3 PRO 111 1HG PRO 111 2.842 1.958 5.450 820 HD2 PRO 111 2HD PRO 111 0.417 3.697 5.919 821 HD3 PRO 111 1HD PRO 111 1.524 3.658 4.528 822 H PHE 112 H PHE 112 -0.855 -1.459 5.872 823 HA PHE 112 HA PHE 112 -2.919 -0.485 7.662 824 HB2 PHE 112 2HB PHE 112 -4.755 -1.664 6.615 825 HB3 PHE 112 1HB PHE 112 -4.064 -0.541 5.464 826 HD1 PHE 112 HD1 PHE 112 -2.913 -1.369 3.433 827 HD2 PHE 112 HD2 PHE 112 -4.667 -4.098 6.230 828 HE1 PHE 112 HE1 PHE 112 -2.856 -3.158 1.745 829 HE2 PHE 112 HE2 PHE 112 -4.593 -5.879 4.534 830 HZ PHE 112 HZ PHE 112 -3.692 -5.408 2.291 831 H ARG 113 H ARG 113 -4.027 -2.356 8.717 832 HA ARG 113 HA ARG 113 -2.645 -4.946 8.568 833 HB2 ARG 113 2HB ARG 113 -1.690 -3.833 10.566 834 HB3 ARG 113 1HB ARG 113 -3.309 -3.487 11.177 835 HG2 ARG 113 2HG ARG 113 -3.705 -6.019 11.208 836 HG3 ARG 113 1HG ARG 113 -1.984 -6.206 10.876 837 HD2 ARG 113 2HD ARG 113 -3.207 -4.859 13.301 838 HD3 ARG 113 1HD ARG 113 -2.446 -6.455 13.256 839 HE ARG 113 HE ARG 113 -0.559 -4.641 12.320 840 HH11 ARG 113 1HH1 ARG 113 -2.266 -5.249 15.327 841 HH12 ARG 113 2HH1 ARG 113 -0.990 -4.610 16.315 842 HH21 ARG 113 1HH2 ARG 113 1.076 -3.773 13.630 843 HH22 ARG 113 2HH2 ARG 113 0.893 -3.778 15.356 844 H ASP 114 H ASP 114 -4.194 -6.520 8.329 845 HA ASP 114 HA ASP 114 -7.003 -5.811 8.953 846 HB2 ASP 114 2HB ASP 114 -7.723 -6.814 6.914 847 HB3 ASP 114 1HB ASP 114 -6.376 -5.776 6.459 848 H LYS 115 H LYS 115 -8.037 -8.420 8.416 849 HA LYS 115 HA LYS 115 -7.188 -9.603 10.944 850 HB2 LYS 115 2HB LYS 115 -9.561 -10.329 9.191 851 HB3 LYS 115 1HB LYS 115 -9.253 -10.940 10.812 852 HG2 LYS 115 2HG LYS 115 -9.974 -8.109 10.013 853 HG3 LYS 115 1HG LYS 115 -10.940 -9.233 10.957 854 HD2 LYS 115 2HD LYS 115 -8.319 -7.981 11.862 855 HD3 LYS 115 1HD LYS 115 -9.928 -7.446 12.340 856 HE2 LYS 115 2HE LYS 115 -10.346 -9.496 13.519 857 HE3 LYS 115 1HE LYS 115 -8.873 -10.229 12.883 858 HZ1 LYS 115 3HZ LYS 115 -8.386 -9.553 15.059 859 HZ2 LYS 115 1HZ LYS 115 -9.105 -8.036 14.853 860 HZ3 LYS 115 2HZ LYS 115 -7.658 -8.397 14.067 861 H THR 116 H THR 116 -6.691 -10.253 7.565 862 HA THR 116 HA THR 116 -6.086 -13.061 7.865 863 HB THR 116 HB THR 116 -5.086 -13.000 5.648 864 HG1 THR 116 HG1 THR 116 -5.460 -10.329 5.098 865 HG21 THR 116 3HG2 THR 116 -7.543 -12.999 5.706 866 HG22 THR 116 1HG2 THR 116 -6.951 -12.104 4.305 867 HG23 THR 116 2HG2 THR 116 -7.553 -11.233 5.714 868 H THR 117 H THR 117 -4.386 -10.113 8.471 869 HA THR 117 HA THR 117 -1.698 -10.759 8.229 870 HB THR 117 HB THR 117 -3.110 -8.914 10.203 871 HG1 THR 117 HG1 THR 117 -3.165 -8.567 7.783 872 HG21 THR 117 3HG2 THR 117 -0.936 -7.748 10.488 873 HG22 THR 117 1HG2 THR 117 -0.144 -8.997 9.524 874 HG23 THR 117 2HG2 THR 117 -0.859 -9.406 11.085 875 H GLY 118 H GLY 118 -0.552 -12.347 9.173 876 HA2 GLY 118 2HA GLY 118 0.364 -13.741 10.745 877 HA3 GLY 118 1HA GLY 118 -0.483 -12.839 11.991 878 H GLN 119 H GLN 119 -2.277 -14.296 9.369 879 HA GLN 119 HA GLN 119 -3.174 -16.555 11.067 880 HB2 GLN 119 2HB GLN 119 -5.032 -14.779 9.394 881 HB3 GLN 119 1HB GLN 119 -5.522 -16.192 10.315 882 HG2 GLN 119 2HG GLN 119 -4.400 -13.648 11.523 883 HG3 GLN 119 1HG GLN 119 -6.114 -14.038 11.420 884 HE21 GLN 119 1HE2 GLN 119 -4.620 -13.488 13.807 885 HE22 GLN 119 2HE2 GLN 119 -4.697 -14.899 14.801 886 H GLN 120 H GLN 120 -4.536 -15.752 7.891 887 HA GLN 120 HA GLN 120 -3.293 -18.082 6.646 888 HB2 GLN 120 2HB GLN 120 -4.741 -17.599 4.728 889 HB3 GLN 120 1HB GLN 120 -5.685 -17.615 6.212 890 HG2 GLN 120 2HG GLN 120 -5.681 -15.151 6.242 891 HG3 GLN 120 1HG GLN 120 -4.732 -15.135 4.756 892 HE21 GLN 120 1HE2 GLN 120 -7.858 -15.764 6.152 893 HE22 GLN 120 2HE2 GLN 120 -8.735 -15.799 4.667 894 H SER 121 H SER 121 -2.660 -14.853 7.066 895 HA SER 121 HA SER 121 -0.647 -14.658 4.878 896 HB2 SER 121 2HB SER 121 -1.660 -12.385 6.674 897 HB3 SER 121 1HB SER 121 -0.593 -12.228 5.274 898 HG SER 121 HG SER 121 -2.943 -11.759 5.019 899 H TYR 122 H TYR 122 1.520 -14.385 5.531 900 HA TYR 122 HA TYR 122 2.348 -15.282 8.079 901 HB2 TYR 122 2HB TYR 122 3.694 -15.385 5.927 902 HB3 TYR 122 1HB TYR 122 3.989 -13.657 6.079 903 HD1 TYR 122 HD2 TYR 122 4.317 -16.790 8.139 904 HD2 TYR 122 HD1 TYR 122 6.042 -13.033 7.080 905 HE1 TYR 122 HE2 TYR 122 6.269 -17.299 9.517 906 HE2 TYR 122 HE1 TYR 122 7.998 -13.552 8.475 907 HH TYR 122 HH TYR 122 8.661 -14.964 10.276 908 H ASP 123 H ASP 123 3.717 -13.957 9.642 909 HA ASP 123 HA ASP 123 1.947 -11.925 10.626 910 HB2 ASP 123 2HB ASP 123 3.316 -11.890 12.644 911 HB3 ASP 123 1HB ASP 123 3.022 -13.550 12.155 912 H GLY 124 H GLY 124 2.426 -9.768 11.170 913 HA2 GLY 124 2HA GLY 124 3.667 -7.719 10.848 914 HA3 GLY 124 1HA GLY 124 4.434 -8.438 9.435 915 H GLY 125 H GLY 125 2.308 -6.121 10.167 916 HA2 GLY 125 2HA GLY 125 -0.009 -6.660 8.632 917 HA3 GLY 125 1HA GLY 125 0.534 -5.079 9.183 918 H ARG 126 H ARG 126 -0.561 -4.888 6.750 919 HA ARG 126 HA ARG 126 1.511 -5.550 4.751 920 HB2 ARG 126 2HB ARG 126 -1.499 -5.956 4.488 921 HB3 ARG 126 1HB ARG 126 -0.425 -5.892 3.096 922 HG2 ARG 126 2HG ARG 126 -0.584 -8.004 5.243 923 HG3 ARG 126 1HG ARG 126 -0.735 -8.188 3.497 924 HD2 ARG 126 2HD ARG 126 1.768 -7.798 5.154 925 HD3 ARG 126 1HD ARG 126 1.398 -9.092 4.018 926 HE ARG 126 HE ARG 126 1.671 -7.367 2.213 927 HH11 ARG 126 1HH1 ARG 126 3.230 -6.848 5.307 928 HH12 ARG 126 2HH1 ARG 126 4.478 -5.842 4.652 929 HH21 ARG 126 1HH2 ARG 126 3.318 -6.047 1.342 930 HH22 ARG 126 2HH2 ARG 126 4.532 -5.382 2.395 931 H TYR 127 H TYR 127 2.096 -3.961 3.454 932 HA TYR 127 HA TYR 127 0.640 -1.420 3.663 933 HB2 TYR 127 2HB TYR 127 2.853 -0.536 2.539 934 HB3 TYR 127 1HB TYR 127 2.807 -0.887 4.256 935 HD1 TYR 127 HD2 TYR 127 3.790 -3.141 5.056 936 HD2 TYR 127 HD1 TYR 127 4.515 -1.583 1.147 937 HE1 TYR 127 HE2 TYR 127 5.821 -4.496 4.900 938 HE2 TYR 127 HE1 TYR 127 6.551 -2.970 0.987 939 HH TYR 127 HH TYR 127 8.212 -4.034 2.902 940 H MET 128 H MET 128 -0.524 -0.754 2.136 941 HA MET 128 HA MET 128 -0.369 -1.757 -0.627 942 HB2 MET 128 2HB MET 128 -2.559 -1.490 1.041 943 HB3 MET 128 1HB MET 128 -2.589 0.087 0.272 944 HG2 MET 128 2HG MET 128 -2.545 -2.480 -1.325 945 HG3 MET 128 1HG MET 128 -4.037 -1.718 -0.785 946 HE1 MET 128 3HE MET 128 -3.697 1.364 -1.196 947 HE2 MET 128 1HE MET 128 -5.069 0.426 -1.792 948 HE3 MET 128 2HE MET 128 -4.216 1.531 -2.872 949 H GLU 129 H GLU 129 -0.533 -0.028 -2.362 950 HA GLU 129 HA GLU 129 0.303 2.682 -1.534 951 HB2 GLU 129 2HB GLU 129 2.349 1.391 -2.011 952 HB3 GLU 129 1HB GLU 129 1.718 0.927 -3.584 953 HG2 GLU 129 2HG GLU 129 1.784 3.320 -4.283 954 HG3 GLU 129 1HG GLU 129 2.498 3.738 -2.723 955 H LEU 130 H LEU 130 -0.571 4.262 -2.751 956 HA LEU 130 HA LEU 130 -1.611 3.684 -5.438 957 HB2 LEU 130 2HB LEU 130 -3.451 5.561 -4.676 958 HB3 LEU 130 1HB LEU 130 -3.737 3.830 -4.660 959 HG LEU 130 HG LEU 130 -3.192 3.810 -2.200 960 HD11 LEU 130 1HD1 LEU 130 -3.186 5.907 -0.932 961 HD12 LEU 130 2HD1 LEU 130 -3.183 6.831 -2.436 962 HD13 LEU 130 3HD1 LEU 130 -1.803 5.810 -2.022 963 HD21 LEU 130 3HD2 LEU 130 -5.461 5.617 -3.063 964 HD22 LEU 130 1HD2 LEU 130 -5.329 4.806 -1.500 965 HD23 LEU 130 2HD2 LEU 130 -5.496 3.855 -2.973 966 H GLU 131 H GLU 131 -1.547 5.366 -6.846 967 HA GLU 131 HA GLU 131 -0.079 7.803 -6.073 968 HB2 GLU 131 2HB GLU 131 0.391 6.175 -8.614 969 HB3 GLU 131 1HB GLU 131 1.161 7.710 -8.214 970 HG2 GLU 131 2HG GLU 131 2.151 6.571 -6.163 971 HG3 GLU 131 1HG GLU 131 1.528 5.051 -6.801 972 HA PRO 132 HA PRO 132 -4.061 9.263 -7.928 973 HB2 PRO 132 2HB PRO 132 -3.758 11.868 -7.049 974 HB3 PRO 132 1HB PRO 132 -4.352 10.565 -6.000 975 HG2 PRO 132 2HG PRO 132 -1.539 11.617 -6.259 976 HG3 PRO 132 1HG PRO 132 -2.501 11.359 -4.781 977 HD2 PRO 132 2HD PRO 132 -0.719 9.535 -5.508 978 HD3 PRO 132 1HD PRO 132 -2.312 9.010 -4.915 979 H ASP 133 H ASP 133 -4.570 10.850 -9.558 980 HA ASP 133 HA ASP 133 -2.710 11.135 -11.660 981 HB2 ASP 133 2HB ASP 133 -5.149 11.109 -12.069 982 HB3 ASP 133 1HB ASP 133 -5.342 12.615 -11.177 983 H ARG 134 H ARG 134 -4.149 13.608 -9.537 984 HA ARG 134 HA ARG 134 -1.826 15.388 -9.953 985 HB2 ARG 134 2HB ARG 134 -3.468 17.235 -9.400 986 HB3 ARG 134 1HB ARG 134 -3.810 16.375 -10.890 987 HG2 ARG 134 2HG ARG 134 -5.950 16.501 -10.045 988 HG3 ARG 134 1HG ARG 134 -5.458 14.973 -9.323 989 HD2 ARG 134 2HD ARG 134 -4.894 16.188 -7.218 990 HD3 ARG 134 1HD ARG 134 -5.457 17.690 -7.949 991 HE ARG 134 HE ARG 134 -7.053 15.587 -6.801 992 HH11 ARG 134 1HH1 ARG 134 -7.186 18.258 -9.109 993 HH12 ARG 134 2HH1 ARG 134 -8.909 18.409 -8.981 994 HH21 ARG 134 1HH2 ARG 134 -9.283 15.812 -6.662 995 HH22 ARG 134 2HH2 ARG 134 -10.099 17.029 -7.599 996 H ASP 135 H ASP 135 -1.925 17.084 -7.942 997 HA ASP 135 HA ASP 135 -1.138 15.488 -5.642 998 HB2 ASP 135 2HB ASP 135 0.297 17.367 -6.255 999 HB3 ASP 135 1HB ASP 135 -1.051 18.493 -6.159 1000 H LEU 136 H LEU 136 -2.247 15.374 -3.688 1001 HA LEU 136 HA LEU 136 -5.104 16.041 -3.878 1002 HB2 LEU 136 2HB LEU 136 -3.649 14.163 -1.978 1003 HB3 LEU 136 1HB LEU 136 -5.392 14.364 -2.078 1004 HG LEU 136 HG LEU 136 -3.597 13.198 -4.244 1005 HD11 LEU 136 1HD1 LEU 136 -5.724 11.824 -2.584 1006 HD12 LEU 136 2HD1 LEU 136 -3.990 11.709 -2.303 1007 HD13 LEU 136 3HD1 LEU 136 -4.679 11.083 -3.797 1008 HD21 LEU 136 3HD2 LEU 136 -5.412 14.427 -5.309 1009 HD22 LEU 136 1HD2 LEU 136 -6.605 13.609 -4.296 1010 HD23 LEU 136 2HD2 LEU 136 -5.677 12.694 -5.488 1011 H SER 137 H SER 137 -6.249 17.022 -2.253 1012 HA SER 137 HA SER 137 -4.806 18.410 -0.060 1013 HB2 SER 137 2HB SER 137 -6.584 20.211 -0.340 1014 HB3 SER 137 1HB SER 137 -5.489 20.064 -1.715 1015 HG SER 137 HG SER 137 -7.140 19.625 -2.915 1016 H ASP 138 H ASP 138 -6.572 19.142 1.663 1017 HA ASP 138 HA ASP 138 -7.940 16.770 2.581 1018 HB2 ASP 138 2HB ASP 138 -8.613 18.180 4.549 1019 HB3 ASP 138 1HB ASP 138 -6.881 18.112 4.286 1020 H GLY 139 H GLY 139 -9.881 16.193 1.987 1021 HA2 GLY 139 2HA GLY 139 -12.220 16.465 1.602 1022 HA3 GLY 139 1HA GLY 139 -11.942 18.129 1.098 1023 H ASP 140 H ASP 140 -9.537 16.192 -0.202 1024 HA ASP 140 HA ASP 140 -10.682 16.172 -2.886 1025 HB2 ASP 140 2HB ASP 140 -8.181 16.651 -2.083 1026 HB3 ASP 140 1HB ASP 140 -8.016 14.906 -2.139 1027 H GLU 141 H GLU 141 -10.776 14.102 -4.168 1028 HA GLU 141 HA GLU 141 -11.479 11.772 -2.503 1029 HB2 GLU 141 2HB GLU 141 -12.015 12.388 -5.443 1030 HB3 GLU 141 1HB GLU 141 -12.639 10.993 -4.561 1031 HG2 GLU 141 2HG GLU 141 -13.984 12.391 -3.128 1032 HG3 GLU 141 1HG GLU 141 -13.230 13.856 -3.739 1033 H ILE 142 H ILE 142 -10.810 9.631 -3.102 1034 HA ILE 142 HA ILE 142 -8.558 9.173 -4.881 1035 HB ILE 142 HB ILE 142 -7.459 10.018 -2.798 1036 HG12 ILE 142 2HG1 ILE 142 -5.871 8.092 -2.414 1037 HG13 ILE 142 1HG1 ILE 142 -6.948 7.054 -3.340 1038 HG21 ILE 142 1HG2 ILE 142 -9.124 9.358 -1.143 1039 HG22 ILE 142 2HG2 ILE 142 -7.538 8.733 -0.694 1040 HG23 ILE 142 3HG2 ILE 142 -8.742 7.652 -1.395 1041 HD11 ILE 142 3HD1 ILE 142 -5.033 7.786 -4.652 1042 HD12 ILE 142 1HD1 ILE 142 -5.477 9.473 -4.398 1043 HD13 ILE 142 2HD1 ILE 142 -6.531 8.414 -5.339 1044 H THR 143 H THR 143 -8.244 6.855 -5.246 1045 HA THR 143 HA THR 143 -10.637 5.238 -4.531 1046 HB THR 143 HB THR 143 -8.980 4.690 -7.026 1047 HG1 THR 143 HG1 THR 143 -10.849 6.813 -6.665 1048 HG21 THR 143 3HG2 THR 143 -11.150 3.984 -7.941 1049 HG22 THR 143 1HG2 THR 143 -11.968 4.510 -6.467 1050 HG23 THR 143 2HG2 THR 143 -10.842 3.154 -6.416 1051 H LEU 144 H LEU 144 -10.298 3.158 -3.649 1052 HA LEU 144 HA LEU 144 -7.530 2.442 -2.867 1053 HB2 LEU 144 2HB LEU 144 -10.085 2.721 -1.249 1054 HB3 LEU 144 1HB LEU 144 -8.953 1.482 -0.772 1055 HG LEU 144 HG LEU 144 -8.812 3.549 0.595 1056 HD11 LEU 144 1HD1 LEU 144 -6.272 2.886 -0.922 1057 HD12 LEU 144 2HD1 LEU 144 -6.901 2.047 0.498 1058 HD13 LEU 144 3HD1 LEU 144 -6.361 3.719 0.633 1059 HD21 LEU 144 3HD2 LEU 144 -7.770 4.896 -1.918 1060 HD22 LEU 144 1HD2 LEU 144 -7.785 5.593 -0.295 1061 HD23 LEU 144 2HD2 LEU 144 -9.303 5.234 -1.113 1062 H ASP 145 H ASP 145 -7.288 0.579 -4.328 1063 HA ASP 145 HA ASP 145 -9.111 -1.625 -3.514 1064 HB2 ASP 145 2HB ASP 145 -8.651 -2.866 -5.505 1065 HB3 ASP 145 1HB ASP 145 -9.225 -1.284 -5.936 1066 H PHE 146 H PHE 146 -8.367 -2.713 -2.046 1067 HA PHE 146 HA PHE 146 -5.674 -2.806 -1.121 1068 HB2 PHE 146 2HB PHE 146 -7.929 -4.628 -0.193 1069 HB3 PHE 146 1HB PHE 146 -6.565 -4.011 0.753 1070 HD1 PHE 146 HD2 PHE 146 -6.431 -1.325 0.848 1071 HD2 PHE 146 HD1 PHE 146 -10.016 -3.551 0.117 1072 HE1 PHE 146 HE2 PHE 146 -7.778 0.620 1.486 1073 HE2 PHE 146 HE1 PHE 146 -11.358 -1.587 0.757 1074 HZ PHE 146 HZ PHE 146 -10.239 0.496 1.443 1075 H ASN 147 H ASN 147 -7.088 -4.478 -3.562 1076 HA ASN 147 HA ASN 147 -6.185 -7.084 -3.593 1077 HB2 ASN 147 2HB ASN 147 -6.081 -5.228 -6.018 1078 HB3 ASN 147 1HB ASN 147 -6.355 -6.970 -6.012 1079 HD21 ASN 147 1HD2 ASN 147 -7.905 -4.613 -7.027 1080 HD22 ASN 147 2HD2 ASN 147 -9.492 -4.822 -6.377 1081 H LEU 148 H LEU 148 -4.484 -4.093 -4.307 1082 HA LEU 148 HA LEU 148 -2.138 -5.417 -5.430 1083 HB2 LEU 148 2HB LEU 148 -2.492 -2.423 -5.064 1084 HB3 LEU 148 1HB LEU 148 -1.575 -3.270 -6.300 1085 HG LEU 148 HG LEU 148 -4.607 -3.195 -6.120 1086 HD11 LEU 148 1HD1 LEU 148 -4.715 -1.634 -7.852 1087 HD12 LEU 148 2HD1 LEU 148 -2.977 -1.747 -8.205 1088 HD13 LEU 148 3HD1 LEU 148 -3.534 -0.995 -6.705 1089 HD21 LEU 148 3HD2 LEU 148 -2.875 -4.381 -8.312 1090 HD22 LEU 148 1HD2 LEU 148 -4.635 -4.211 -8.366 1091 HD23 LEU 148 2HD2 LEU 148 -3.891 -5.268 -7.171 1092 H ALA 149 H ALA 149 -2.785 -5.546 -2.457 1093 HA ALA 149 HA ALA 149 -0.677 -4.141 -1.094 1094 HB1 ALA 149 3HB ALA 149 -2.344 -6.517 -0.180 1095 HB2 ALA 149 1HB ALA 149 -2.731 -4.817 0.094 1096 HB3 ALA 149 2HB ALA 149 -1.307 -5.531 0.852 1097 H TYR 150 H TYR 150 1.414 -4.724 -1.063 1098 HA TYR 150 HA TYR 150 2.237 -6.837 -2.910 1099 HB2 TYR 150 2HB TYR 150 4.073 -4.936 -1.393 1100 HB3 TYR 150 1HB TYR 150 4.408 -5.770 -2.908 1101 HD1 TYR 150 HD1 TYR 150 2.584 -5.174 -4.854 1102 HD2 TYR 150 HD2 TYR 150 3.587 -2.646 -1.553 1103 HE1 TYR 150 HE1 TYR 150 1.789 -3.216 -6.105 1104 HE2 TYR 150 HE2 TYR 150 2.797 -0.693 -2.811 1105 HH TYR 150 HH TYR 150 2.418 -0.004 -5.126 1106 H SER 151 H SER 151 3.852 -8.518 -2.398 1107 HA SER 151 HA SER 151 4.007 -9.748 0.035 1108 HB2 SER 151 2HB SER 151 6.261 -9.521 -2.018 1109 HB3 SER 151 1HB SER 151 6.116 -10.766 -0.774 1110 HG SER 151 HG SER 151 3.892 -10.993 -1.898 1111 HA PRO 152 HA PRO 152 6.336 -6.862 2.589 1112 HB2 PRO 152 2HB PRO 152 6.936 -8.929 4.572 1113 HB3 PRO 152 1HB PRO 152 5.704 -7.659 4.647 1114 HG2 PRO 152 2HG PRO 152 5.164 -10.370 4.413 1115 HG3 PRO 152 1HG PRO 152 4.037 -9.063 3.996 1116 HD2 PRO 152 2HD PRO 152 5.729 -10.744 2.187 1117 HD3 PRO 152 1HD PRO 152 4.112 -10.056 1.916 1118 H PHE 153 H PHE 153 8.448 -6.304 1.738 1119 HA PHE 153 HA PHE 153 10.719 -7.739 1.736 1120 HB2 PHE 153 2HB PHE 153 10.433 -5.023 3.069 1121 HB3 PHE 153 1HB PHE 153 11.926 -5.722 2.493 1122 HD1 PHE 153 HD2 PHE 153 12.265 -5.952 -0.043 1123 HD2 PHE 153 HD1 PHE 153 9.094 -3.639 1.649 1124 HE1 PHE 153 HE2 PHE 153 12.087 -4.642 -2.118 1125 HE2 PHE 153 HE1 PHE 153 8.954 -2.317 -0.420 1126 HZ PHE 153 HZ PHE 153 10.458 -2.813 -2.301 1127 H CYS 154 H CYS 154 9.280 -6.220 4.644 1128 HA CYS 154 HA CYS 154 11.309 -6.805 6.471 1129 HB2 CYS 154 2HB CYS 154 9.563 -6.152 8.182 1130 HB3 CYS 154 1HB CYS 154 9.778 -5.002 6.868 1131 HG CYS 154 HG CYS 154 7.302 -4.848 6.349 1132 H ALA 155 H ALA 155 8.138 -8.450 6.131 1133 HA ALA 155 HA ALA 155 8.566 -10.294 8.236 1134 HB1 ALA 155 3HB ALA 155 6.670 -10.582 5.890 1135 HB2 ALA 155 1HB ALA 155 6.340 -9.673 7.362 1136 HB3 ALA 155 2HB ALA 155 6.567 -11.421 7.442 1137 H TYR 156 H TYR 156 9.562 -10.358 4.892 1138 HA TYR 156 HA TYR 156 10.367 -13.192 5.040 1139 HB2 TYR 156 2HB TYR 156 10.054 -11.232 2.747 1140 HB3 TYR 156 1HB TYR 156 10.974 -12.719 2.536 1141 HD1 TYR 156 HD1 TYR 156 7.576 -11.524 3.678 1142 HD2 TYR 156 HD2 TYR 156 9.829 -14.714 1.931 1143 HE1 TYR 156 HE1 TYR 156 5.500 -12.779 3.258 1144 HE2 TYR 156 HE2 TYR 156 7.753 -15.949 1.510 1145 HH TYR 156 HH TYR 156 5.478 -16.065 2.359 1146 H SER 157 H SER 157 11.737 -10.084 5.484 1147 HA SER 157 HA SER 157 14.346 -11.301 5.971 1148 HB2 SER 157 2HB SER 157 13.940 -8.981 4.040 1149 HB3 SER 157 1HB SER 157 15.495 -9.322 4.803 1150 HG SER 157 HG SER 157 14.143 -11.374 3.447 1151 H ASP 158 H ASP 158 14.775 -10.776 7.996 1152 HA ASP 158 HA ASP 158 13.314 -8.844 9.499 1153 HB2 ASP 158 2HB ASP 158 14.230 -11.058 10.342 1154 HB3 ASP 158 1HB ASP 158 15.834 -10.341 10.342 1155 H THR 159 H THR 159 16.054 -8.514 7.559 1156 HA THR 159 HA THR 159 17.449 -6.415 8.917 1157 HB THR 159 HB THR 159 18.566 -7.908 7.268 1158 HG1 THR 159 HG1 THR 159 18.718 -5.284 6.207 1159 HG21 THR 159 3HG2 THR 159 18.242 -7.577 4.848 1160 HG22 THR 159 1HG2 THR 159 16.950 -6.417 5.168 1161 HG23 THR 159 2HG2 THR 159 16.743 -8.113 5.609 1162 H PHE 160 H PHE 160 14.441 -6.392 7.341 1163 HA PHE 160 HA PHE 160 14.546 -3.454 6.896 1164 HB2 PHE 160 2HB PHE 160 12.370 -5.440 6.089 1165 HB3 PHE 160 1HB PHE 160 12.320 -3.711 5.799 1166 HD1 PHE 160 HD2 PHE 160 14.293 -6.793 4.940 1167 HD2 PHE 160 HD1 PHE 160 13.087 -2.867 3.732 1168 HE1 PHE 160 HE2 PHE 160 15.243 -7.185 2.704 1169 HE2 PHE 160 HE1 PHE 160 14.033 -3.276 1.496 1170 HZ PHE 160 HZ PHE 160 15.110 -5.433 0.978 1171 H SER 161 H SER 161 13.165 -2.163 8.189 1172 HA SER 161 HA SER 161 11.934 -3.439 10.549 1173 HB2 SER 161 2HB SER 161 12.455 -0.497 9.917 1174 HB3 SER 161 1HB SER 161 11.781 -1.108 11.426 1175 HG SER 161 HG SER 161 13.719 -2.220 11.786 1176 H CYS 162 H CYS 162 9.738 -3.818 10.554 1177 HA CYS 162 HA CYS 162 8.148 -3.419 8.263 1178 HB2 CYS 162 2HB CYS 162 7.769 -5.281 9.849 1179 HB3 CYS 162 1HB CYS 162 7.341 -4.144 11.121 1180 HG CYS 162 HG CYS 162 5.074 -3.200 9.552 1181 HA PRO 163 HA PRO 163 6.902 0.826 8.790 1182 HB2 PRO 163 2HB PRO 163 4.252 0.072 7.547 1183 HB3 PRO 163 1HB PRO 163 5.440 1.291 7.022 1184 HG2 PRO 163 2HG PRO 163 5.199 -0.979 5.677 1185 HG3 PRO 163 1HG PRO 163 6.816 -0.295 5.985 1186 HD2 PRO 163 2HD PRO 163 5.413 -2.545 7.440 1187 HD3 PRO 163 1HD PRO 163 7.092 -2.459 6.861 1188 H LEU 164 H LEU 164 6.508 1.411 10.828 1189 HA LEU 164 HA LEU 164 4.883 0.476 12.756 1190 HB2 LEU 164 2HB LEU 164 6.618 2.299 12.947 1191 HB3 LEU 164 1HB LEU 164 5.459 3.423 12.258 1192 HG LEU 164 HG LEU 164 3.955 3.012 14.241 1193 HD11 LEU 164 1HD1 LEU 164 4.845 1.934 16.253 1194 HD12 LEU 164 2HD1 LEU 164 6.312 1.483 15.381 1195 HD13 LEU 164 3HD1 LEU 164 4.756 0.798 14.907 1196 HD21 LEU 164 3HD2 LEU 164 5.398 4.987 14.161 1197 HD22 LEU 164 1HD2 LEU 164 6.723 4.080 14.893 1198 HD23 LEU 164 2HD2 LEU 164 5.251 4.401 15.816 1199 HA PRO 165 HA PRO 165 0.845 1.636 10.896 1200 HB2 PRO 165 2HB PRO 165 -0.586 -0.525 11.736 1201 HB3 PRO 165 1HB PRO 165 0.583 -0.638 10.408 1202 HG2 PRO 165 2HG PRO 165 0.794 -1.686 13.162 1203 HG3 PRO 165 1HG PRO 165 1.617 -2.222 11.685 1204 HD2 PRO 165 2HD PRO 165 2.662 -0.490 13.760 1205 HD3 PRO 165 1HD PRO 165 3.483 -1.048 12.287 1206 HA PRO 166 HA PRO 166 -0.793 3.509 14.792 1207 HB2 PRO 166 2HB PRO 166 -2.767 5.008 13.541 1208 HB3 PRO 166 1HB PRO 166 -1.078 5.541 13.681 1209 HG2 PRO 166 2HG PRO 166 -2.458 4.259 11.349 1210 HG3 PRO 166 1HG PRO 166 -1.317 5.624 11.371 1211 HD2 PRO 166 2HD PRO 166 -0.529 3.122 10.690 1212 HD3 PRO 166 1HD PRO 166 0.549 4.236 11.560 1213 H GLU 167 H GLU 167 -2.693 3.011 16.017 1214 HA GLU 167 HA GLU 167 -4.115 0.647 15.416 1215 HB2 GLU 167 2HB GLU 167 -4.887 2.846 17.379 1216 HB3 GLU 167 1HB GLU 167 -5.601 1.236 17.327 1217 HG2 GLU 167 2HG GLU 167 -3.325 0.275 17.802 1218 HG3 GLU 167 1HG GLU 167 -2.733 1.923 18.022 1219 H SER 168 H SER 168 -4.621 3.857 14.403 1220 HA SER 168 HA SER 168 -7.351 3.938 13.779 1221 HB2 SER 168 2HB SER 168 -5.028 5.391 12.454 1222 HB3 SER 168 1HB SER 168 -6.725 5.883 12.414 1223 HG SER 168 HG SER 168 -6.612 6.524 14.457 1224 H ASN 169 H ASN 169 -4.613 2.482 12.052 1225 HA ASN 169 HA ASN 169 -6.090 2.398 9.503 1226 HB2 ASN 169 2HB ASN 169 -4.036 2.137 8.381 1227 HB3 ASN 169 1HB ASN 169 -3.636 3.234 9.688 1228 HD21 ASN 169 1HD2 ASN 169 -1.703 1.844 8.294 1229 HD22 ASN 169 2HD2 ASN 169 -0.947 0.702 9.340 1230 H TRP 170 H TRP 170 -6.076 0.528 12.120 1231 HA TRP 170 HA TRP 170 -5.622 -2.106 11.029 1232 HB2 TRP 170 2HB TRP 170 -6.928 -1.215 13.637 1233 HB3 TRP 170 1HB TRP 170 -6.624 -2.895 13.211 1234 HD1 TRP 170 HD1 TRP 170 -3.628 -0.988 12.168 1235 HE1 TRP 170 HE1 TRP 170 -1.789 -1.124 13.956 1236 HE3 TRP 170 HE3 TRP 170 -6.380 -2.893 16.043 1237 HZ2 TRP 170 HZ2 TRP 170 -1.521 -1.938 16.638 1238 HZ3 TRP 170 HZ3 TRP 170 -5.251 -3.330 18.190 1239 HH2 TRP 170 HH2 TRP 170 -2.869 -2.859 18.482 1240 H LEU 171 H LEU 171 -6.988 -2.823 9.502 1241 HA LEU 171 HA LEU 171 -9.779 -2.038 9.307 1242 HB2 LEU 171 2HB LEU 171 -8.239 -4.072 7.625 1243 HB3 LEU 171 1HB LEU 171 -9.759 -3.300 7.208 1244 HG LEU 171 HG LEU 171 -7.055 -1.903 7.357 1245 HD11 LEU 171 1HD1 LEU 171 -7.190 -3.436 5.446 1246 HD12 LEU 171 2HD1 LEU 171 -7.167 -1.757 4.916 1247 HD13 LEU 171 3HD1 LEU 171 -8.684 -2.662 4.909 1248 HD21 LEU 171 3HD2 LEU 171 -9.743 -0.797 6.484 1249 HD22 LEU 171 1HD2 LEU 171 -8.192 0.037 6.344 1250 HD23 LEU 171 2HD2 LEU 171 -8.843 -0.350 7.936 1251 H GLU 172 H GLU 172 -11.243 -3.167 10.673 1252 HA GLU 172 HA GLU 172 -10.616 -5.903 11.477 1253 HB2 GLU 172 2HB GLU 172 -11.602 -4.291 13.128 1254 HB3 GLU 172 1HB GLU 172 -13.096 -4.273 12.193 1255 HG2 GLU 172 2HG GLU 172 -13.464 -6.644 12.639 1256 HG3 GLU 172 1HG GLU 172 -11.899 -6.782 13.434 1257 H THR 173 H THR 173 -10.611 -6.258 9.089 1258 HA THR 173 HA THR 173 -12.798 -8.039 8.495 1259 HB THR 173 HB THR 173 -13.637 -5.989 7.400 1260 HG1 THR 173 HG1 THR 173 -14.232 -7.645 6.182 1261 HG21 THR 173 3HG2 THR 173 -11.043 -5.955 5.809 1262 HG22 THR 173 1HG2 THR 173 -11.504 -4.780 7.045 1263 HG23 THR 173 2HG2 THR 173 -12.429 -4.896 5.548 1264 H ALA 174 H ALA 174 -12.125 -9.621 6.952 1265 HA ALA 174 HA ALA 174 -9.214 -9.962 6.821 1266 HB1 ALA 174 3HB ALA 174 -11.477 -11.842 6.037 1267 HB2 ALA 174 1HB ALA 174 -10.585 -11.866 7.561 1268 HB3 ALA 174 2HB ALA 174 -9.761 -12.247 6.050 1269 H VAL 175 H VAL 175 -8.691 -8.370 5.320 1270 HA VAL 175 HA VAL 175 -9.743 -8.033 2.734 1271 HB VAL 175 HB VAL 175 -6.910 -7.459 3.740 1272 HG11 VAL 175 1HG1 VAL 175 -6.842 -7.680 1.296 1273 HG12 VAL 175 2HG1 VAL 175 -6.664 -5.982 1.736 1274 HG13 VAL 175 3HG1 VAL 175 -8.209 -6.577 1.119 1275 HG21 VAL 175 3HG2 VAL 175 -8.661 -6.172 4.915 1276 HG22 VAL 175 1HG2 VAL 175 -9.286 -5.586 3.372 1277 HG23 VAL 175 2HG2 VAL 175 -7.674 -5.109 3.911 1278 H THR 176 H THR 176 -10.031 -9.898 1.601 1279 HA THR 176 HA THR 176 -7.612 -10.916 0.276 1280 HB THR 176 HB THR 176 -8.920 -13.176 0.034 1281 HG1 THR 176 HG1 THR 176 -10.750 -11.948 1.293 1282 HG21 THR 176 3HG2 THR 176 -7.748 -12.461 2.739 1283 HG22 THR 176 1HG2 THR 176 -6.841 -13.031 1.336 1284 HG23 THR 176 2HG2 THR 176 -8.005 -14.095 2.128 1285 H ALA 177 H ALA 177 -7.890 -11.224 -1.887 1286 HA ALA 177 HA ALA 177 -10.532 -10.960 -3.150 1287 HB1 ALA 177 3HB ALA 177 -9.712 -9.245 -4.716 1288 HB2 ALA 177 1HB ALA 177 -8.121 -9.255 -3.944 1289 HB3 ALA 177 2HB ALA 177 -9.521 -8.651 -3.058 1290 H GLY 178 H GLY 178 -10.658 -12.359 -4.907 1291 HA2 GLY 178 2HA GLY 178 -10.115 -14.204 -6.173 1292 HA3 GLY 178 1HA GLY 178 -8.520 -13.489 -6.336 1293 H GLU 179 H GLU 179 -7.377 -15.414 -6.166 1294 HA GLU 179 HA GLU 179 -7.604 -17.331 -4.124 1295 HB2 GLU 179 2HB GLU 179 -6.306 -17.647 -6.259 1296 HB3 GLU 179 1HB GLU 179 -5.065 -16.567 -5.640 1297 HG2 GLU 179 2HG GLU 179 -4.350 -18.879 -5.379 1298 HG3 GLU 179 1HG GLU 179 -4.620 -18.167 -3.790 1299 H ARG 180 H ARG 180 -6.116 -17.688 -2.326 1300 HA ARG 180 HA ARG 180 -6.170 -15.290 -0.676 1301 HB2 ARG 180 2HB ARG 180 -5.598 -18.175 0.122 1302 HB3 ARG 180 1HB ARG 180 -6.063 -16.859 1.191 1303 HG2 ARG 180 2HG ARG 180 -7.832 -18.063 -0.963 1304 HG3 ARG 180 1HG ARG 180 -7.913 -18.459 0.752 1305 HD2 ARG 180 2HD ARG 180 -8.613 -16.170 1.280 1306 HD3 ARG 180 1HD ARG 180 -8.426 -15.694 -0.413 1307 HE ARG 180 HE ARG 180 -10.192 -17.744 -0.566 1308 HH11 ARG 180 1HH1 ARG 180 -10.222 -14.795 1.359 1309 HH12 ARG 180 2HH1 ARG 180 -11.950 -14.708 1.403 1310 HH21 ARG 180 1HH2 ARG 180 -12.466 -17.609 -0.462 1311 HH22 ARG 180 2HH2 ARG 180 -13.215 -16.287 0.380 1312 H THR 181 H THR 181 -4.341 -15.828 1.244 1313 HA THR 181 HA THR 181 -1.792 -15.089 0.004 1314 HB THR 181 HB THR 181 -1.236 -14.719 2.587 1315 HG1 THR 181 HG1 THR 181 -3.152 -14.266 3.775 1316 HG21 THR 181 3HG2 THR 181 -3.188 -12.913 1.113 1317 HG22 THR 181 1HG2 THR 181 -1.431 -12.880 0.954 1318 HG23 THR 181 2HG2 THR 181 -2.187 -12.445 2.488 1319 H ASP 182 H ASP 182 0.070 -15.892 1.781 1320 HA ASP 182 HA ASP 182 0.795 -18.381 0.764 1321 HB2 ASP 182 2HB ASP 182 2.699 -18.264 2.420 1322 HB3 ASP 182 1HB ASP 182 2.492 -16.797 1.473 1323 H LEU 183 H LEU 183 -0.875 -19.820 1.134 1324 HA LEU 183 HA LEU 183 -1.778 -20.631 3.739 1325 HB2 LEU 183 2HB LEU 183 -3.166 -22.250 2.646 1326 HB3 LEU 183 1HB LEU 183 -3.239 -20.769 1.717 1327 HG LEU 183 HG LEU 183 -1.627 -23.233 0.920 1328 HD11 LEU 183 1HD1 LEU 183 -4.028 -23.705 0.835 1329 HD12 LEU 183 2HD1 LEU 183 -3.342 -23.642 -0.785 1330 HD13 LEU 183 3HD1 LEU 183 -4.292 -22.283 -0.177 1331 HD21 LEU 183 3HD2 LEU 183 -2.210 -20.722 -0.691 1332 HD22 LEU 183 1HD2 LEU 183 -1.386 -22.168 -1.284 1333 HD23 LEU 183 2HD2 LEU 183 -0.647 -21.193 -0.020 1334 H GLU 184 H GLU 184 0.605 -21.766 1.442 1335 HA GLU 184 HA GLU 184 1.663 -23.713 3.400 1336 HB2 GLU 184 2HB GLU 184 1.384 -24.120 0.388 1337 HB3 GLU 184 1HB GLU 184 2.341 -25.163 1.430 1338 HG2 GLU 184 2HG GLU 184 -0.653 -24.754 1.640 1339 HG3 GLU 184 1HG GLU 184 0.140 -26.131 0.872 1340 H HIS 185 H HIS 185 3.912 -24.057 3.270 1341 HA HIS 185 HA HIS 185 5.532 -22.289 1.548 1342 HB2 HIS 185 2HB HIS 185 6.110 -22.962 4.481 1343 HB3 HIS 185 1HB HIS 185 7.185 -22.064 3.417 1344 HD1 HIS 185 HD1 HIS 185 6.399 -19.661 2.718 1345 HD2 HIS 185 HD2 HIS 185 4.093 -21.457 5.657 1346 HE1 HIS 185 HE1 HIS 185 5.019 -17.820 3.700 1347 HE2 HIS 185 HE2 HIS 185 3.464 -18.981 5.286 Start of MODEL 17 1 H1 MET 1 1H MET 1 -19.712 4.348 -19.815 2 H2 MET 1 2H MET 1 -20.283 5.662 -18.924 3 H3 MET 1 3H MET 1 -19.938 4.204 -18.148 4 HA MET 1 HA MET 1 -17.911 5.805 -19.571 5 HB2 MET 1 2HB MET 1 -18.648 5.822 -16.613 6 HB3 MET 1 1HB MET 1 -17.156 6.513 -17.242 7 HG2 MET 1 2HG MET 1 -18.465 8.105 -18.592 8 HG3 MET 1 1HG MET 1 -19.959 7.416 -17.953 9 HE1 MET 1 3HE MET 1 -20.733 9.881 -17.271 10 HE2 MET 1 1HE MET 1 -19.217 10.571 -17.855 11 HE3 MET 1 2HE MET 1 -19.790 10.946 -16.230 12 H ASP 2 H ASP 2 -18.209 3.181 -20.021 13 HA ASP 2 HA ASP 2 -16.883 1.329 -18.390 14 HB2 ASP 2 2HB ASP 2 -17.053 1.365 -21.444 15 HB3 ASP 2 1HB ASP 2 -16.663 -0.041 -20.457 16 H GLU 3 H GLU 3 -15.684 3.298 -21.067 17 HA GLU 3 HA GLU 3 -13.046 2.665 -21.269 18 HB2 GLU 3 2HB GLU 3 -14.061 5.540 -21.260 19 HB3 GLU 3 1HB GLU 3 -12.561 4.974 -21.979 20 HG2 GLU 3 2HG GLU 3 -14.046 5.320 -23.776 21 HG3 GLU 3 1HG GLU 3 -13.967 3.575 -23.559 22 H ASP 4 H ASP 4 -14.469 4.866 -18.879 23 HA ASP 4 HA ASP 4 -12.019 5.569 -17.556 24 HB2 ASP 4 2HB ASP 4 -13.928 7.107 -17.562 25 HB3 ASP 4 1HB ASP 4 -14.941 5.924 -16.749 26 H THR 5 H THR 5 -14.495 3.083 -17.046 27 HA THR 5 HA THR 5 -13.741 2.476 -14.343 28 HB THR 5 HB THR 5 -15.418 0.796 -16.261 29 HG1 THR 5 HG1 THR 5 -15.930 3.214 -15.450 30 HG21 THR 5 3HG2 THR 5 -16.481 -0.075 -14.201 31 HG22 THR 5 1HG2 THR 5 -15.374 0.882 -13.212 32 HG23 THR 5 2HG2 THR 5 -14.755 -0.436 -14.210 33 H GLU 6 H GLU 6 -13.095 0.996 -17.529 34 HA GLU 6 HA GLU 6 -11.342 -1.063 -16.451 35 HB2 GLU 6 2HB GLU 6 -11.063 -1.795 -18.758 36 HB3 GLU 6 1HB GLU 6 -12.771 -1.512 -18.446 37 HG2 GLU 6 2HG GLU 6 -12.651 0.638 -19.629 38 HG3 GLU 6 1HG GLU 6 -10.927 0.412 -19.887 39 H ASP 7 H ASP 7 -11.042 2.194 -17.370 40 HA ASP 7 HA ASP 7 -8.388 2.447 -18.248 41 HB2 ASP 7 2HB ASP 7 -9.886 4.359 -18.244 42 HB3 ASP 7 1HB ASP 7 -10.059 4.286 -16.501 43 H TRP 8 H TRP 8 -9.683 2.192 -14.967 44 HA TRP 8 HA TRP 8 -7.568 2.143 -13.304 45 HB2 TRP 8 2HB TRP 8 -9.833 1.618 -12.561 46 HB3 TRP 8 1HB TRP 8 -9.830 0.111 -13.466 47 HD1 TRP 8 HD1 TRP 8 -7.994 1.676 -10.392 48 HE1 TRP 8 HE1 TRP 8 -7.417 -0.238 -8.770 49 HE3 TRP 8 HE3 TRP 8 -9.625 -2.308 -13.185 50 HZ2 TRP 8 HZ2 TRP 8 -7.621 -3.038 -8.684 51 HZ3 TRP 8 HZ3 TRP 8 -9.404 -4.576 -12.244 52 HH2 TRP 8 HH2 TRP 8 -8.422 -4.920 -10.029 53 H GLU 9 H GLU 9 -8.536 -0.783 -15.196 54 HA GLU 9 HA GLU 9 -6.090 -2.160 -14.469 55 HB2 GLU 9 2HB GLU 9 -6.980 -4.078 -15.737 56 HB3 GLU 9 1HB GLU 9 -8.137 -3.461 -14.565 57 HG2 GLU 9 2HG GLU 9 -9.325 -2.280 -16.414 58 HG3 GLU 9 1HG GLU 9 -8.195 -3.000 -17.557 59 H THR 10 H THR 10 -6.956 -0.044 -16.997 60 HA THR 10 HA THR 10 -5.146 -1.012 -19.010 61 HB THR 10 HB THR 10 -6.266 1.824 -18.709 62 HG1 THR 10 HG1 THR 10 -7.517 -0.503 -19.358 63 HG21 THR 10 3HG2 THR 10 -5.190 0.354 -21.157 64 HG22 THR 10 1HG2 THR 10 -4.378 1.675 -20.310 65 HG23 THR 10 2HG2 THR 10 -5.899 1.970 -21.155 66 H GLN 11 H GLN 11 -4.999 1.915 -16.870 67 HA GLN 11 HA GLN 11 -2.257 2.402 -17.215 68 HB2 GLN 11 2HB GLN 11 -2.439 3.928 -15.329 69 HB3 GLN 11 1HB GLN 11 -3.879 4.065 -16.326 70 HG2 GLN 11 2HG GLN 11 -5.094 2.615 -14.693 71 HG3 GLN 11 1HG GLN 11 -3.656 2.611 -13.671 72 HE21 GLN 11 1HE2 GLN 11 -6.324 4.535 -14.861 73 HE22 GLN 11 2HE2 GLN 11 -6.136 5.831 -13.736 74 H LEU 12 H LEU 12 -3.969 0.269 -15.037 75 HA LEU 12 HA LEU 12 -2.029 -0.339 -13.129 76 HB2 LEU 12 2HB LEU 12 -4.386 -1.052 -12.975 77 HB3 LEU 12 1HB LEU 12 -4.141 -2.178 -14.297 78 HG LEU 12 HG LEU 12 -2.591 -3.510 -12.874 79 HD11 LEU 12 1HD1 LEU 12 -3.306 -1.575 -10.652 80 HD12 LEU 12 2HD1 LEU 12 -1.726 -1.755 -11.422 81 HD13 LEU 12 3HD1 LEU 12 -2.394 -3.078 -10.472 82 HD21 LEU 12 3HD2 LEU 12 -5.318 -3.061 -11.602 83 HD22 LEU 12 1HD2 LEU 12 -4.285 -4.477 -11.374 84 HD23 LEU 12 2HD2 LEU 12 -4.965 -4.131 -12.962 85 H GLN 13 H GLN 13 -2.297 -1.522 -16.467 86 HA GLN 13 HA GLN 13 -0.551 -3.743 -16.218 87 HB2 GLN 13 2HB GLN 13 -0.620 -3.934 -18.568 88 HB3 GLN 13 1HB GLN 13 -2.165 -3.204 -18.164 89 HG2 GLN 13 2HG GLN 13 -1.102 -0.957 -18.744 90 HG3 GLN 13 1HG GLN 13 0.253 -1.865 -19.393 91 HE21 GLN 13 1HE2 GLN 13 -1.474 -4.013 -20.489 92 HE22 GLN 13 2HE2 GLN 13 -2.245 -3.320 -21.866 93 H ALA 14 H ALA 14 0.046 -0.306 -16.863 94 HA ALA 14 HA ALA 14 2.867 -0.575 -17.406 95 HB1 ALA 14 3HB ALA 14 1.569 1.315 -18.295 96 HB2 ALA 14 1HB ALA 14 2.889 1.893 -17.280 97 HB3 ALA 14 2HB ALA 14 1.235 1.881 -16.658 98 H ASN 15 H ASN 15 0.895 0.449 -14.649 99 HA ASN 15 HA ASN 15 2.790 1.044 -12.739 100 HB2 ASN 15 2HB ASN 15 0.048 -0.243 -12.401 101 HB3 ASN 15 1HB ASN 15 1.014 0.332 -11.044 102 HD21 ASN 15 1HD2 ASN 15 -0.794 1.732 -10.567 103 HD22 ASN 15 2HD2 ASN 15 -0.987 3.209 -11.424 104 H ARG 16 H ARG 16 1.388 -2.147 -13.453 105 HA ARG 16 HA ARG 16 2.754 -3.485 -11.300 106 HB2 ARG 16 2HB ARG 16 1.695 -5.518 -12.081 107 HB3 ARG 16 1HB ARG 16 0.514 -4.216 -12.123 108 HG2 ARG 16 2HG ARG 16 0.636 -4.061 -14.516 109 HG3 ARG 16 1HG ARG 16 2.037 -5.129 -14.584 110 HD2 ARG 16 2HD ARG 16 -0.053 -6.246 -15.286 111 HD3 ARG 16 1HD ARG 16 0.691 -7.019 -13.884 112 HE ARG 16 HE ARG 16 -1.266 -5.119 -13.075 113 HH11 ARG 16 1HH1 ARG 16 -1.025 -8.326 -14.505 114 HH12 ARG 16 2HH1 ARG 16 -2.547 -8.856 -13.864 115 HH21 ARG 16 1HH2 ARG 16 -3.191 -5.874 -12.128 116 HH22 ARG 16 2HH2 ARG 16 -3.777 -7.461 -12.513 117 H ASP 17 H ASP 17 3.453 -2.883 -14.680 118 HA ASP 17 HA ASP 17 4.804 -5.261 -15.315 119 HB2 ASP 17 2HB ASP 17 3.850 -3.592 -16.966 120 HB3 ASP 17 1HB ASP 17 5.229 -2.550 -16.639 121 H GLU 18 H GLU 18 6.322 -2.031 -14.971 122 HA GLU 18 HA GLU 18 8.913 -3.150 -14.507 123 HB2 GLU 18 2HB GLU 18 9.701 -0.891 -14.259 124 HB3 GLU 18 1HB GLU 18 8.568 -0.960 -15.600 125 HG2 GLU 18 2HG GLU 18 6.839 0.111 -14.293 126 HG3 GLU 18 1HG GLU 18 7.825 0.024 -12.830 127 H LYS 19 H LYS 19 6.290 -2.596 -12.393 128 HA LYS 19 HA LYS 19 7.726 -2.239 -9.941 129 HB2 LYS 19 2HB LYS 19 5.294 -1.689 -10.318 130 HB3 LYS 19 1HB LYS 19 4.944 -3.412 -10.366 131 HG2 LYS 19 2HG LYS 19 5.724 -3.617 -8.029 132 HG3 LYS 19 1HG LYS 19 6.057 -1.886 -7.986 133 HD2 LYS 19 2HD LYS 19 3.324 -3.178 -8.368 134 HD3 LYS 19 1HD LYS 19 3.914 -2.418 -6.890 135 HE2 LYS 19 2HE LYS 19 3.350 -1.035 -9.534 136 HE3 LYS 19 1HE LYS 19 2.418 -0.891 -8.044 137 HZ1 LYS 19 3HZ LYS 19 4.388 0.079 -6.990 138 HZ2 LYS 19 1HZ LYS 19 3.840 1.004 -8.292 139 HZ3 LYS 19 2HZ LYS 19 5.205 0.026 -8.464 140 H ASP 20 H ASP 20 6.601 -5.025 -11.811 141 HA ASP 20 HA ASP 20 7.201 -7.082 -9.960 142 HB2 ASP 20 2HB ASP 20 5.746 -7.524 -11.859 143 HB3 ASP 20 1HB ASP 20 7.038 -7.158 -12.993 144 H ARG 21 H ARG 21 9.153 -5.444 -12.400 145 HA ARG 21 HA ARG 21 11.434 -7.243 -12.075 146 HB2 ARG 21 2HB ARG 21 12.569 -5.990 -13.766 147 HB3 ARG 21 1HB ARG 21 10.899 -6.135 -14.298 148 HG2 ARG 21 2HG ARG 21 10.441 -3.845 -13.622 149 HG3 ARG 21 1HG ARG 21 12.055 -3.686 -12.942 150 HD2 ARG 21 2HD ARG 21 13.024 -3.953 -15.202 151 HD3 ARG 21 1HD ARG 21 11.391 -4.076 -15.876 152 HE ARG 21 HE ARG 21 11.893 -1.700 -14.300 153 HH11 ARG 21 1HH1 ARG 21 12.018 -3.062 -17.540 154 HH12 ARG 21 2HH1 ARG 21 11.945 -1.515 -18.325 155 HH21 ARG 21 1HH2 ARG 21 11.725 0.324 -15.335 156 HH22 ARG 21 2HH2 ARG 21 11.778 0.410 -17.067 157 H PHE 22 H PHE 22 10.257 -4.385 -10.572 158 HA PHE 22 HA PHE 22 12.571 -3.136 -9.647 159 HB2 PHE 22 2HB PHE 22 10.221 -2.275 -9.423 160 HB3 PHE 22 1HB PHE 22 9.924 -3.454 -8.154 161 HD1 PHE 22 HD1 PHE 22 11.620 -0.293 -9.008 162 HD2 PHE 22 HD2 PHE 22 10.881 -3.137 -5.900 163 HE1 PHE 22 HE1 PHE 22 12.420 1.319 -7.333 164 HE2 PHE 22 HE2 PHE 22 11.689 -1.519 -4.243 165 HZ PHE 22 HZ PHE 22 12.453 0.705 -4.951 166 H PHE 23 H PHE 23 10.740 -5.823 -8.130 167 HA PHE 23 HA PHE 23 12.584 -6.232 -5.960 168 HB2 PHE 23 2HB PHE 23 10.243 -7.800 -7.075 169 HB3 PHE 23 1HB PHE 23 11.287 -8.540 -5.868 170 HD1 PHE 23 HD2 PHE 23 10.928 -4.969 -5.336 171 HD2 PHE 23 HD1 PHE 23 9.034 -8.756 -4.652 172 HE1 PHE 23 HE2 PHE 23 9.597 -3.988 -3.514 173 HE2 PHE 23 HE1 PHE 23 7.716 -7.758 -2.825 174 HZ PHE 23 HZ PHE 23 7.995 -5.377 -2.258 175 H SER 24 H SER 24 12.670 -7.133 -9.261 176 HA SER 24 HA SER 24 14.185 -9.616 -8.826 177 HB2 SER 24 2HB SER 24 13.043 -8.451 -11.398 178 HB3 SER 24 1HB SER 24 13.677 -10.084 -11.166 179 HG SER 24 HG SER 24 11.391 -8.939 -9.931 180 H GLU 25 H GLU 25 14.651 -6.326 -9.945 181 HA GLU 25 HA GLU 25 17.342 -6.968 -11.021 182 HB2 GLU 25 2HB GLU 25 15.442 -4.892 -12.219 183 HB3 GLU 25 1HB GLU 25 17.006 -5.395 -12.851 184 HG2 GLU 25 2HG GLU 25 16.060 -7.669 -13.270 185 HG3 GLU 25 1HG GLU 25 14.490 -7.079 -12.728 186 H HIS 26 H HIS 26 15.205 -4.331 -9.838 187 HA HIS 26 HA HIS 26 17.335 -2.408 -9.656 188 HB2 HIS 26 2HB HIS 26 15.057 -1.635 -10.100 189 HB3 HIS 26 1HB HIS 26 14.476 -2.333 -8.589 190 HD2 HIS 26 HD2 HIS 26 16.535 0.776 -9.825 191 HE1 HIS 26 HE1 HIS 26 15.540 1.257 -5.738 192 HE2 HIS 26 HE2 HIS 26 16.741 2.290 -7.722 193 H ARG 27 H ARG 27 15.238 -3.760 -7.115 194 HA ARG 27 HA ARG 27 17.385 -3.461 -5.120 195 HB2 ARG 27 2HB ARG 27 14.370 -3.799 -4.848 196 HB3 ARG 27 1HB ARG 27 15.459 -3.962 -3.476 197 HG2 ARG 27 2HG ARG 27 15.022 -1.476 -5.149 198 HG3 ARG 27 1HG ARG 27 14.483 -1.751 -3.491 199 HD2 ARG 27 2HD ARG 27 17.348 -1.479 -4.461 200 HD3 ARG 27 1HD ARG 27 16.454 -0.349 -3.438 201 HE ARG 27 HE ARG 27 16.421 -2.716 -2.045 202 HH11 ARG 27 1HH1 ARG 27 18.974 -0.623 -3.257 203 HH12 ARG 27 2HH1 ARG 27 20.091 -1.073 -2.014 204 HH21 ARG 27 1HH2 ARG 27 17.903 -3.308 -0.420 205 HH22 ARG 27 2HH2 ARG 27 19.486 -2.594 -0.401 206 H GLN 28 H GLN 28 17.987 -5.183 -3.810 207 HA GLN 28 HA GLN 28 18.037 -7.801 -4.789 208 HB2 GLN 28 2HB GLN 28 18.842 -8.452 -2.537 209 HB3 GLN 28 1HB GLN 28 19.630 -6.985 -3.102 210 HG2 GLN 28 2HG GLN 28 18.053 -5.645 -1.691 211 HG3 GLN 28 1HG GLN 28 17.401 -7.153 -1.056 212 HE21 GLN 28 1HE2 GLN 28 20.131 -4.986 -1.051 213 HE22 GLN 28 2HE2 GLN 28 20.944 -5.685 0.303 214 H SER 29 H SER 29 16.840 -9.623 -4.328 215 HA SER 29 HA SER 29 14.098 -9.461 -4.276 216 HB2 SER 29 2HB SER 29 15.758 -11.853 -3.365 217 HB3 SER 29 1HB SER 29 14.103 -11.905 -3.980 218 HG SER 29 HG SER 29 16.495 -11.682 -5.333 219 HA PRO 30 HA PRO 30 13.225 -9.086 0.261 220 HB2 PRO 30 2HB PRO 30 10.435 -8.688 -0.757 221 HB3 PRO 30 1HB PRO 30 11.411 -7.632 0.289 222 HG2 PRO 30 2HG PRO 30 10.897 -6.933 -2.225 223 HG3 PRO 30 1HG PRO 30 12.490 -6.604 -1.502 224 HD2 PRO 30 2HD PRO 30 11.691 -8.884 -3.331 225 HD3 PRO 30 1HD PRO 30 13.095 -7.790 -3.445 226 H ILE 31 H ILE 31 11.487 -10.810 -2.279 227 HA ILE 31 HA ILE 31 10.664 -13.003 -0.602 228 HB ILE 31 HB ILE 31 10.873 -13.013 -3.652 229 HG12 ILE 31 2HG1 ILE 31 9.651 -10.963 -3.094 230 HG13 ILE 31 1HG1 ILE 31 8.532 -12.140 -3.761 231 HG21 ILE 31 1HG2 ILE 31 8.980 -14.483 -1.782 232 HG22 ILE 31 2HG2 ILE 31 10.361 -15.181 -2.631 233 HG23 ILE 31 3HG2 ILE 31 8.978 -14.584 -3.546 234 HD11 ILE 31 3HD1 ILE 31 7.508 -10.958 -1.943 235 HD12 ILE 31 1HD1 ILE 31 8.835 -11.372 -0.859 236 HD13 ILE 31 2HD1 ILE 31 7.754 -12.635 -1.456 237 HA PRO 32 HA PRO 32 15.145 -14.054 -0.741 238 HB2 PRO 32 2HB PRO 32 15.179 -15.889 1.291 239 HB3 PRO 32 1HB PRO 32 14.988 -14.149 1.597 240 HG2 PRO 32 2HG PRO 32 12.865 -16.267 1.427 241 HG3 PRO 32 1HG PRO 32 13.098 -15.009 2.664 242 HD2 PRO 32 2HD PRO 32 11.316 -14.694 0.667 243 HD3 PRO 32 1HD PRO 32 12.241 -13.321 1.315 244 HA PRO 33 HA PRO 33 16.102 -17.524 -3.371 245 HB2 PRO 33 2HB PRO 33 17.394 -18.844 -0.965 246 HB3 PRO 33 1HB PRO 33 18.004 -18.693 -2.628 247 HG2 PRO 33 2HG PRO 33 18.858 -17.074 -0.675 248 HG3 PRO 33 1HG PRO 33 18.669 -16.501 -2.346 249 HD2 PRO 33 2HD PRO 33 17.065 -15.831 0.046 250 HD3 PRO 33 1HD PRO 33 17.200 -14.962 -1.498 251 H GLU 34 H GLU 34 15.008 -18.553 -0.154 252 HA GLU 34 HA GLU 34 14.193 -21.193 -0.862 253 HB2 GLU 34 2HB GLU 34 13.395 -19.463 1.519 254 HB3 GLU 34 1HB GLU 34 13.161 -21.207 1.402 255 HG2 GLU 34 2HG GLU 34 15.567 -21.579 1.404 256 HG3 GLU 34 1HG GLU 34 15.874 -19.846 1.341 257 H GLU 35 H GLU 35 12.316 -18.224 -0.133 258 HA GLU 35 HA GLU 35 9.789 -19.281 -0.718 259 HB2 GLU 35 2HB GLU 35 10.680 -16.373 -0.785 260 HB3 GLU 35 1HB GLU 35 9.017 -16.941 -0.664 261 HG2 GLU 35 2HG GLU 35 11.205 -17.317 1.386 262 HG3 GLU 35 1HG GLU 35 9.838 -16.218 1.509 263 H ARG 36 H ARG 36 11.929 -17.218 -2.777 264 HA ARG 36 HA ARG 36 10.053 -17.000 -4.904 265 HB2 ARG 36 2HB ARG 36 11.876 -15.912 -6.141 266 HB3 ARG 36 1HB ARG 36 11.774 -15.286 -4.497 267 HG2 ARG 36 2HG ARG 36 13.678 -16.692 -3.828 268 HG3 ARG 36 1HG ARG 36 13.774 -17.355 -5.459 269 HD2 ARG 36 2HD ARG 36 14.153 -14.424 -4.766 270 HD3 ARG 36 1HD ARG 36 15.464 -15.580 -5.000 271 HE ARG 36 HE ARG 36 13.590 -14.646 -7.091 272 HH11 ARG 36 1HH1 ARG 36 16.674 -16.125 -6.247 273 HH12 ARG 36 2HH1 ARG 36 17.275 -16.090 -7.877 274 HH21 ARG 36 1HH2 ARG 36 14.394 -14.609 -9.217 275 HH22 ARG 36 2HH2 ARG 36 15.974 -15.228 -9.557 276 H ASP 37 H ASP 37 11.883 -19.671 -4.009 277 HA ASP 37 HA ASP 37 12.492 -20.798 -6.541 278 HB2 ASP 37 2HB ASP 37 13.465 -21.633 -4.417 279 HB3 ASP 37 1HB ASP 37 11.881 -22.200 -3.903 280 H ASP 38 H ASP 38 9.615 -21.034 -4.423 281 HA ASP 38 HA ASP 38 8.076 -22.336 -6.587 282 HB2 ASP 38 2HB ASP 38 7.178 -21.690 -3.750 283 HB3 ASP 38 1HB ASP 38 6.314 -22.682 -4.922 284 H PHE 39 H PHE 39 8.210 -19.335 -4.726 285 HA PHE 39 HA PHE 39 5.827 -18.209 -5.966 286 HB2 PHE 39 2HB PHE 39 7.881 -16.969 -4.067 287 HB3 PHE 39 1HB PHE 39 6.444 -16.137 -4.652 288 HD1 PHE 39 HD2 PHE 39 4.153 -17.474 -4.237 289 HD2 PHE 39 HD1 PHE 39 7.726 -18.003 -1.948 290 HE1 PHE 39 HE2 PHE 39 2.833 -18.368 -2.366 291 HE2 PHE 39 HE1 PHE 39 6.397 -18.898 -0.083 292 HZ PHE 39 HZ PHE 39 3.950 -19.079 -0.290 293 H ASP 40 H ASP 40 5.800 -16.566 -7.482 294 HA ASP 40 HA ASP 40 8.219 -16.115 -9.066 295 HB2 ASP 40 2HB ASP 40 6.831 -15.294 -10.786 296 HB3 ASP 40 1HB ASP 40 5.903 -16.616 -10.094 297 H GLY 41 H GLY 41 8.449 -13.722 -9.860 298 HA2 GLY 41 2HA GLY 41 9.353 -12.005 -7.924 299 HA3 GLY 41 1HA GLY 41 8.826 -11.491 -9.510 300 H LEU 42 H LEU 42 7.898 -9.493 -8.894 301 HA LEU 42 HA LEU 42 6.348 -9.327 -6.407 302 HB2 LEU 42 2HB LEU 42 7.950 -7.464 -7.274 303 HB3 LEU 42 1HB LEU 42 6.654 -7.025 -8.363 304 HG LEU 42 HG LEU 42 6.478 -6.989 -5.312 305 HD11 LEU 42 1HD1 LEU 42 6.737 -4.663 -7.231 306 HD12 LEU 42 2HD1 LEU 42 7.974 -5.260 -6.128 307 HD13 LEU 42 3HD1 LEU 42 6.501 -4.544 -5.484 308 HD21 LEU 42 3HD2 LEU 42 4.362 -5.756 -5.557 309 HD22 LEU 42 1HD2 LEU 42 4.254 -7.370 -6.258 310 HD23 LEU 42 2HD2 LEU 42 4.432 -5.967 -7.308 311 H SER 43 H SER 43 4.705 -10.759 -6.998 312 HA SER 43 HA SER 43 2.543 -9.479 -8.556 313 HB2 SER 43 2HB SER 43 2.746 -12.344 -7.507 314 HB3 SER 43 1HB SER 43 1.354 -11.658 -8.357 315 HG SER 43 HG SER 43 3.937 -12.220 -9.320 316 H TYR 44 H TYR 44 0.771 -8.820 -7.461 317 HA TYR 44 HA TYR 44 0.894 -8.844 -4.510 318 HB2 TYR 44 2HB TYR 44 -0.791 -6.864 -4.853 319 HB3 TYR 44 1HB TYR 44 0.916 -6.583 -5.148 320 HD1 TYR 44 HD1 TYR 44 -2.235 -7.456 -6.973 321 HD2 TYR 44 HD2 TYR 44 1.566 -5.549 -7.207 322 HE1 TYR 44 HE1 TYR 44 -2.794 -6.659 -9.212 323 HE2 TYR 44 HE2 TYR 44 1.007 -4.737 -9.467 324 HH TYR 44 HH TYR 44 -0.581 -5.553 -11.347 325 H PHE 45 H PHE 45 -1.588 -8.443 -3.780 326 HA PHE 45 HA PHE 45 -3.161 -10.707 -4.071 327 HB2 PHE 45 2HB PHE 45 -3.938 -7.826 -3.451 328 HB3 PHE 45 1HB PHE 45 -5.142 -9.109 -3.494 329 HD1 PHE 45 HD1 PHE 45 -1.858 -10.061 -2.161 330 HD2 PHE 45 HD2 PHE 45 -5.676 -8.408 -1.165 331 HE1 PHE 45 HE1 PHE 45 -1.440 -10.506 0.218 332 HE2 PHE 45 HE2 PHE 45 -5.248 -8.858 1.210 333 HZ PHE 45 HZ PHE 45 -3.129 -9.903 1.908 334 H ASP 46 H ASP 46 -4.785 -11.355 -5.653 335 HA ASP 46 HA ASP 46 -4.196 -10.253 -8.288 336 HB2 ASP 46 2HB ASP 46 -4.265 -12.753 -7.852 337 HB3 ASP 46 1HB ASP 46 -5.980 -12.611 -7.506 338 HA PRO 47 HA PRO 47 -7.375 -7.160 -8.080 339 HB2 PRO 47 2HB PRO 47 -7.981 -8.165 -10.890 340 HB3 PRO 47 1HB PRO 47 -7.859 -6.495 -10.301 341 HG2 PRO 47 2HG PRO 47 -5.816 -7.545 -11.585 342 HG3 PRO 47 1HG PRO 47 -5.526 -6.571 -10.123 343 HD2 PRO 47 2HD PRO 47 -5.366 -9.543 -10.469 344 HD3 PRO 47 1HD PRO 47 -4.440 -8.475 -9.387 345 H ASP 48 H ASP 48 -8.810 -8.066 -6.554 346 HA ASP 48 HA ASP 48 -11.331 -9.173 -7.614 347 HB2 ASP 48 2HB ASP 48 -10.206 -8.880 -4.793 348 HB3 ASP 48 1HB ASP 48 -11.924 -9.156 -5.057 349 HA PRO 49 HA PRO 49 -11.791 -4.592 -7.790 350 HB2 PRO 49 2HB PRO 49 -13.751 -4.473 -9.696 351 HB3 PRO 49 1HB PRO 49 -12.060 -4.837 -10.093 352 HG2 PRO 49 2HG PRO 49 -14.341 -6.761 -9.694 353 HG3 PRO 49 1HG PRO 49 -13.147 -6.697 -11.012 354 HD2 PRO 49 2HD PRO 49 -12.862 -8.411 -8.945 355 HD3 PRO 49 1HD PRO 49 -11.453 -7.640 -9.712 356 H ASP 50 H ASP 50 -14.225 -6.932 -6.918 357 HA ASP 50 HA ASP 50 -16.317 -5.166 -6.135 358 HB2 ASP 50 2HB ASP 50 -17.303 -7.111 -5.067 359 HB3 ASP 50 1HB ASP 50 -16.607 -7.615 -6.601 360 H TYR 51 H TYR 51 -13.330 -6.091 -4.629 361 HA TYR 51 HA TYR 51 -14.227 -5.462 -1.899 362 HB2 TYR 51 2HB TYR 51 -12.430 -7.366 -2.866 363 HB3 TYR 51 1HB TYR 51 -11.334 -6.109 -2.319 364 HD1 TYR 51 HD2 TYR 51 -11.802 -5.192 0.164 365 HD2 TYR 51 HD1 TYR 51 -13.189 -8.958 -1.310 366 HE1 TYR 51 HE2 TYR 51 -12.070 -6.004 2.474 367 HE2 TYR 51 HE1 TYR 51 -13.459 -9.759 0.989 368 HH TYR 51 HH TYR 51 -13.455 -7.779 3.666 369 H ARG 52 H ARG 52 -13.154 -3.820 -4.514 370 HA ARG 52 HA ARG 52 -11.299 -1.941 -3.391 371 HB2 ARG 52 2HB ARG 52 -11.392 -2.684 -5.804 372 HB3 ARG 52 1HB ARG 52 -12.924 -1.834 -5.971 373 HG2 ARG 52 2HG ARG 52 -11.740 0.297 -5.417 374 HG3 ARG 52 1HG ARG 52 -10.219 -0.601 -5.388 375 HD2 ARG 52 2HD ARG 52 -10.358 0.404 -7.542 376 HD3 ARG 52 1HD ARG 52 -10.726 -1.305 -7.791 377 HE ARG 52 HE ARG 52 -13.156 -0.064 -7.411 378 HH11 ARG 52 1HH1 ARG 52 -10.535 0.231 -9.716 379 HH12 ARG 52 2HH1 ARG 52 -11.567 0.781 -10.997 380 HH21 ARG 52 1HH2 ARG 52 -14.497 0.694 -9.068 381 HH22 ARG 52 2HH2 ARG 52 -13.821 1.046 -10.629 382 H VAL 53 H VAL 53 -11.809 -0.051 -2.351 383 HA VAL 53 HA VAL 53 -14.595 0.990 -2.475 384 HB VAL 53 HB VAL 53 -14.345 1.859 -0.188 385 HG11 VAL 53 1HG1 VAL 53 -13.746 -1.120 -0.308 386 HG12 VAL 53 2HG1 VAL 53 -15.338 -0.363 -0.412 387 HG13 VAL 53 3HG1 VAL 53 -14.413 -0.260 1.085 388 HG21 VAL 53 3HG2 VAL 53 -11.934 2.246 -0.109 389 HG22 VAL 53 1HG2 VAL 53 -11.621 0.509 -0.147 390 HG23 VAL 53 2HG2 VAL 53 -12.419 1.235 1.251 391 H GLU 54 H GLU 54 -14.643 3.390 -1.834 392 HA GLU 54 HA GLU 54 -12.309 4.878 -2.924 393 HB2 GLU 54 2HB GLU 54 -13.890 6.600 -3.732 394 HB3 GLU 54 1HB GLU 54 -14.196 5.043 -4.486 395 HG2 GLU 54 2HG GLU 54 -16.140 4.687 -3.033 396 HG3 GLU 54 1HG GLU 54 -15.811 6.201 -2.192 397 H ALA 55 H ALA 55 -11.958 7.022 -1.921 398 HA ALA 55 HA ALA 55 -13.103 7.381 0.760 399 HB1 ALA 55 3HB ALA 55 -10.113 7.110 0.279 400 HB2 ALA 55 1HB ALA 55 -11.138 5.925 1.091 401 HB3 ALA 55 2HB ALA 55 -10.887 7.514 1.815 402 H THR 56 H THR 56 -12.862 9.452 1.609 403 HA THR 56 HA THR 56 -12.036 11.609 -0.201 404 HB THR 56 HB THR 56 -13.222 11.788 2.612 405 HG1 THR 56 HG1 THR 56 -14.560 10.754 0.920 406 HG21 THR 56 3HG2 THR 56 -13.826 14.098 1.972 407 HG22 THR 56 1HG2 THR 56 -13.033 13.886 0.410 408 HG23 THR 56 2HG2 THR 56 -12.077 13.870 1.895 409 H VAL 57 H VAL 57 -10.172 12.764 0.099 410 HA VAL 57 HA VAL 57 -8.175 11.799 1.958 411 HB VAL 57 HB VAL 57 -7.994 14.062 -0.088 412 HG11 VAL 57 1HG1 VAL 57 -5.784 12.501 1.300 413 HG12 VAL 57 2HG1 VAL 57 -6.229 14.179 1.626 414 HG13 VAL 57 3HG1 VAL 57 -5.559 13.736 0.057 415 HG21 VAL 57 3HG2 VAL 57 -6.948 12.417 -1.595 416 HG22 VAL 57 1HG2 VAL 57 -8.596 11.940 -1.183 417 HG23 VAL 57 2HG2 VAL 57 -7.227 11.136 -0.412 418 H THR 58 H THR 58 -7.607 12.748 3.787 419 HA THR 58 HA THR 58 -8.515 15.472 4.501 420 HB THR 58 HB THR 58 -8.255 13.038 6.343 421 HG1 THR 58 HG1 THR 58 -10.558 13.287 6.507 422 HG21 THR 58 3HG2 THR 58 -7.696 15.144 7.516 423 HG22 THR 58 1HG2 THR 58 -9.230 14.485 8.086 424 HG23 THR 58 2HG2 THR 58 -9.220 15.853 6.974 425 H VAL 59 H VAL 59 -6.636 16.593 4.188 426 HA VAL 59 HA VAL 59 -4.051 15.273 4.614 427 HB VAL 59 HB VAL 59 -4.898 17.721 3.041 428 HG11 VAL 59 1HG1 VAL 59 -2.013 17.206 3.865 429 HG12 VAL 59 2HG1 VAL 59 -2.995 18.587 4.351 430 HG13 VAL 59 3HG1 VAL 59 -2.542 18.383 2.659 431 HG21 VAL 59 3HG2 VAL 59 -3.164 15.300 2.429 432 HG22 VAL 59 1HG2 VAL 59 -3.540 16.590 1.284 433 HG23 VAL 59 2HG2 VAL 59 -4.830 15.564 1.906 434 H HIS 60 H HIS 60 -2.769 15.685 6.215 435 HA HIS 60 HA HIS 60 -3.555 17.452 8.375 436 HB2 HIS 60 2HB HIS 60 -1.337 15.393 7.994 437 HB3 HIS 60 1HB HIS 60 -1.447 16.405 9.438 438 HD1 HIS 60 HD1 HIS 60 -4.063 14.364 7.514 439 HD2 HIS 60 HD2 HIS 60 -2.658 14.936 11.384 440 HE1 HIS 60 HE1 HIS 60 -5.544 12.981 8.983 441 HE2 HIS 60 HE2 HIS 60 -4.791 13.486 11.323 442 H GLU 61 H GLU 61 -3.071 19.496 8.257 443 HA GLU 61 HA GLU 61 -1.324 20.791 6.493 444 HB2 GLU 61 2HB GLU 61 -1.807 22.813 7.850 445 HB3 GLU 61 1HB GLU 61 -3.261 21.875 7.533 446 HG2 GLU 61 2HG GLU 61 -2.997 20.838 9.831 447 HG3 GLU 61 1HG GLU 61 -1.698 21.993 10.125 448 H THR 62 H THR 62 -0.720 19.414 9.629 449 HA THR 62 HA THR 62 2.126 20.244 9.489 450 HB THR 62 HB THR 62 2.159 19.791 11.997 451 HG1 THR 62 HG1 THR 62 -0.168 18.731 11.588 452 HG21 THR 62 3HG2 THR 62 1.041 21.901 12.664 453 HG22 THR 62 1HG2 THR 62 0.230 21.971 11.098 454 HG23 THR 62 2HG2 THR 62 1.987 22.121 11.192 455 HA PRO 63 HA PRO 63 2.059 15.712 8.525 456 HB2 PRO 63 2HB PRO 63 4.509 15.636 7.259 457 HB3 PRO 63 1HB PRO 63 3.022 16.174 6.453 458 HG2 PRO 63 2HG PRO 63 5.193 17.837 7.697 459 HG3 PRO 63 1HG PRO 63 4.371 18.048 6.132 460 HD2 PRO 63 2HD PRO 63 3.665 19.502 8.302 461 HD3 PRO 63 1HD PRO 63 2.463 18.979 7.101 462 H GLU 64 H GLU 64 2.531 14.285 10.085 463 HA GLU 64 HA GLU 64 4.622 14.877 12.055 464 HB2 GLU 64 2HB GLU 64 3.474 13.141 13.437 465 HB3 GLU 64 1HB GLU 64 2.410 14.454 12.949 466 HG2 GLU 64 2HG GLU 64 1.607 12.937 11.063 467 HG3 GLU 64 1HG GLU 64 2.485 11.635 11.857 468 H SER 65 H SER 65 6.002 13.140 12.864 469 HA SER 65 HA SER 65 7.327 11.828 10.634 470 HB2 SER 65 2HB SER 65 8.090 12.120 13.570 471 HB3 SER 65 1HB SER 65 9.140 11.476 12.308 472 HG SER 65 HG SER 65 9.371 13.775 12.882 473 H VAL 66 H VAL 66 6.946 9.726 10.125 474 HA VAL 66 HA VAL 66 6.130 7.799 12.236 475 HB VAL 66 HB VAL 66 5.156 7.777 9.329 476 HG11 VAL 66 1HG1 VAL 66 4.218 6.157 11.727 477 HG12 VAL 66 2HG1 VAL 66 5.171 5.556 10.368 478 HG13 VAL 66 3HG1 VAL 66 3.517 6.105 10.106 479 HG21 VAL 66 3HG2 VAL 66 3.645 8.772 11.778 480 HG22 VAL 66 1HG2 VAL 66 2.957 8.557 10.165 481 HG23 VAL 66 2HG2 VAL 66 4.221 9.757 10.430 482 H ASP 67 H ASP 67 7.531 6.102 12.394 483 HA ASP 67 HA ASP 67 9.676 5.710 10.456 484 HB2 ASP 67 2HB ASP 67 8.977 4.399 13.115 485 HB3 ASP 67 1HB ASP 67 10.198 3.691 12.069 486 H LEU 68 H LEU 68 9.135 4.688 8.604 487 HA LEU 68 HA LEU 68 7.716 2.081 8.775 488 HB2 LEU 68 2HB LEU 68 7.655 3.971 6.387 489 HB3 LEU 68 1HB LEU 68 6.828 2.429 6.516 490 HG LEU 68 HG LEU 68 6.168 4.927 8.125 491 HD11 LEU 68 1HD1 LEU 68 4.142 5.046 6.780 492 HD12 LEU 68 2HD1 LEU 68 4.660 3.653 5.828 493 HD13 LEU 68 3HD1 LEU 68 5.578 5.161 5.768 494 HD21 LEU 68 3HD2 LEU 68 4.177 3.718 8.898 495 HD22 LEU 68 1HD2 LEU 68 5.650 2.893 9.408 496 HD23 LEU 68 2HD2 LEU 68 4.711 2.262 8.052 497 H GLU 69 H GLU 69 8.388 0.624 6.904 498 HA GLU 69 HA GLU 69 11.277 0.807 6.485 499 HB2 GLU 69 2HB GLU 69 11.220 -1.449 5.701 500 HB3 GLU 69 1HB GLU 69 10.216 -1.380 7.139 501 HG2 GLU 69 2HG GLU 69 8.196 -1.527 5.826 502 HG3 GLU 69 1HG GLU 69 9.099 -1.359 4.319 503 H THR 70 H THR 70 12.227 0.744 4.459 504 HA THR 70 HA THR 70 10.557 1.460 2.114 505 HB THR 70 HB THR 70 12.135 3.251 2.820 506 HG1 THR 70 HG1 THR 70 11.985 3.522 0.730 507 HG21 THR 70 3HG2 THR 70 14.356 1.260 2.234 508 HG22 THR 70 1HG2 THR 70 13.917 1.870 3.834 509 HG23 THR 70 2HG2 THR 70 14.572 2.968 2.617 510 H SER 71 H SER 71 12.156 0.845 0.059 511 HA SER 71 HA SER 71 12.082 -2.043 -0.023 512 HB2 SER 71 2HB SER 71 12.944 -0.032 -2.140 513 HB3 SER 71 1HB SER 71 12.496 -1.717 -2.418 514 HG SER 71 HG SER 71 10.388 -1.166 -1.631 515 H ASP 72 H ASP 72 14.232 -0.768 1.656 516 HA ASP 72 HA ASP 72 16.721 -1.594 0.291 517 HB2 ASP 72 2HB ASP 72 16.456 0.920 0.208 518 HB3 ASP 72 1HB ASP 72 16.345 0.954 1.958 519 H ASP 73 H ASP 73 14.767 -2.673 2.374 520 HA ASP 73 HA ASP 73 14.514 -3.467 4.440 521 HB2 ASP 73 2HB ASP 73 16.191 -5.046 5.217 522 HB3 ASP 73 1HB ASP 73 15.999 -5.167 3.482 523 H ARG 74 H ARG 74 15.386 -0.699 4.297 524 HA ARG 74 HA ARG 74 16.819 -0.231 6.833 525 HB2 ARG 74 2HB ARG 74 17.697 0.746 4.664 526 HB3 ARG 74 1HB ARG 74 16.199 1.647 4.491 527 HG2 ARG 74 2HG ARG 74 16.747 2.884 6.591 528 HG3 ARG 74 1HG ARG 74 18.279 2.014 6.676 529 HD2 ARG 74 2HD ARG 74 18.965 3.003 4.522 530 HD3 ARG 74 1HD ARG 74 17.420 3.859 4.418 531 HE ARG 74 HE ARG 74 18.752 4.476 6.849 532 HH11 ARG 74 1HH1 ARG 74 18.892 5.240 3.409 533 HH12 ARG 74 2HH1 ARG 74 19.638 6.786 3.668 534 HH21 ARG 74 1HH2 ARG 74 19.732 6.500 7.168 535 HH22 ARG 74 2HH2 ARG 74 20.113 7.496 5.800 536 H THR 75 H THR 75 15.992 1.882 7.900 537 HA THR 75 HA THR 75 13.035 1.933 8.038 538 HB THR 75 HB THR 75 14.985 2.531 10.332 539 HG1 THR 75 HG1 THR 75 13.251 0.395 10.601 540 HG21 THR 75 3HG2 THR 75 12.962 2.568 11.749 541 HG22 THR 75 1HG2 THR 75 11.948 2.284 10.331 542 HG23 THR 75 2HG2 THR 75 12.856 3.790 10.482 543 H VAL 76 H VAL 76 12.277 3.910 7.488 544 HA VAL 76 HA VAL 76 14.047 6.260 7.550 545 HB VAL 76 HB VAL 76 13.269 6.972 5.247 546 HG11 VAL 76 1HG1 VAL 76 14.932 5.643 3.998 547 HG12 VAL 76 2HG1 VAL 76 15.000 4.471 5.318 548 HG13 VAL 76 3HG1 VAL 76 15.547 6.129 5.579 549 HG21 VAL 76 3HG2 VAL 76 11.345 5.484 4.998 550 HG22 VAL 76 1HG2 VAL 76 12.404 4.073 4.964 551 HG23 VAL 76 2HG2 VAL 76 12.471 5.266 3.661 552 H ARG 77 H ARG 77 13.015 8.178 7.774 553 HA ARG 77 HA ARG 77 10.450 8.068 9.068 554 HB2 ARG 77 2HB ARG 77 12.409 9.402 9.887 555 HB3 ARG 77 1HB ARG 77 12.261 10.458 8.496 556 HG2 ARG 77 2HG ARG 77 9.933 10.136 10.394 557 HG3 ARG 77 1HG ARG 77 11.288 11.173 10.828 558 HD2 ARG 77 2HD ARG 77 9.569 11.483 8.342 559 HD3 ARG 77 1HD ARG 77 9.436 12.443 9.817 560 HE ARG 77 HE ARG 77 11.772 13.185 9.377 561 HH11 ARG 77 1HH1 ARG 77 9.806 12.125 6.664 562 HH12 ARG 77 2HH1 ARG 77 10.692 13.059 5.508 563 HH21 ARG 77 1HH2 ARG 77 12.923 14.398 7.852 564 HH22 ARG 77 2HH2 ARG 77 12.459 14.347 6.178 565 H TYR 78 H TYR 78 8.606 8.224 8.008 566 HA TYR 78 HA TYR 78 8.344 9.669 5.456 567 HB2 TYR 78 2HB TYR 78 6.546 7.699 6.934 568 HB3 TYR 78 1HB TYR 78 5.964 8.648 5.573 569 HD1 TYR 78 HD2 TYR 78 8.985 6.485 6.289 570 HD2 TYR 78 HD1 TYR 78 5.822 7.440 3.585 571 HE1 TYR 78 HE2 TYR 78 9.723 4.702 4.775 572 HE2 TYR 78 HE1 TYR 78 6.571 5.658 2.071 573 HH TYR 78 HH TYR 78 8.783 3.256 2.999 574 H LEU 79 H LEU 79 6.922 11.369 5.252 575 HA LEU 79 HA LEU 79 5.925 12.644 7.708 576 HB2 LEU 79 2HB LEU 79 6.195 13.663 4.851 577 HB3 LEU 79 1HB LEU 79 5.447 14.585 6.147 578 HG LEU 79 HG LEU 79 8.358 13.699 6.044 579 HD11 LEU 79 1HD1 LEU 79 8.884 16.081 5.833 580 HD12 LEU 79 2HD1 LEU 79 7.163 16.480 5.811 581 HD13 LEU 79 3HD1 LEU 79 7.871 15.535 4.497 582 HD21 LEU 79 3HD2 LEU 79 8.665 15.018 8.111 583 HD22 LEU 79 1HD2 LEU 79 7.569 13.660 8.361 584 HD23 LEU 79 2HD2 LEU 79 6.923 15.296 8.200 585 H HIS 80 H HIS 80 3.888 12.371 8.281 586 HA HIS 80 HA HIS 80 1.973 11.009 6.618 587 HB2 HIS 80 2HB HIS 80 2.021 10.554 9.014 588 HB3 HIS 80 1HB HIS 80 1.791 12.258 9.392 589 HD2 HIS 80 HD2 HIS 80 -0.411 10.034 6.990 590 HE1 HIS 80 HE1 HIS 80 -2.814 11.672 10.045 591 HE2 HIS 80 HE2 HIS 80 -2.807 10.418 7.855 592 H VAL 81 H VAL 81 1.383 12.202 4.929 593 HA VAL 81 HA VAL 81 0.799 15.058 5.181 594 HB VAL 81 HB VAL 81 0.675 15.066 2.701 595 HG11 VAL 81 1HG1 VAL 81 3.185 13.745 3.811 596 HG12 VAL 81 2HG1 VAL 81 2.827 15.474 3.808 597 HG13 VAL 81 3HG1 VAL 81 3.073 14.626 2.282 598 HG21 VAL 81 3HG2 VAL 81 1.280 13.051 1.395 599 HG22 VAL 81 1HG2 VAL 81 -0.194 12.784 2.326 600 HG23 VAL 81 2HG2 VAL 81 1.333 12.092 2.878 601 H ALA 82 H ALA 82 -0.933 12.015 4.717 602 HA ALA 82 HA ALA 82 -3.498 13.482 4.604 603 HB1 ALA 82 3HB ALA 82 -4.265 12.216 2.639 604 HB2 ALA 82 1HB ALA 82 -2.686 11.432 2.507 605 HB3 ALA 82 2HB ALA 82 -2.836 13.172 2.247 606 H THR 83 H THR 83 -5.354 12.184 5.027 607 HA THR 83 HA THR 83 -4.965 9.385 5.859 608 HB THR 83 HB THR 83 -6.625 11.429 7.429 609 HG1 THR 83 HG1 THR 83 -4.652 10.061 8.755 610 HG21 THR 83 3HG2 THR 83 -7.666 9.170 7.437 611 HG22 THR 83 1HG2 THR 83 -7.022 9.587 9.028 612 HG23 THR 83 2HG2 THR 83 -6.140 8.470 7.986 613 H LEU 84 H LEU 84 -6.579 8.103 5.112 614 HA LEU 84 HA LEU 84 -8.441 9.348 3.197 615 HB2 LEU 84 2HB LEU 84 -7.513 6.453 3.240 616 HB3 LEU 84 1HB LEU 84 -8.256 7.334 1.910 617 HG LEU 84 HG LEU 84 -5.447 7.763 3.005 618 HD11 LEU 84 1HD1 LEU 84 -5.665 5.718 1.714 619 HD12 LEU 84 2HD1 LEU 84 -4.667 6.904 0.880 620 HD13 LEU 84 3HD1 LEU 84 -6.329 6.626 0.350 621 HD21 LEU 84 3HD2 LEU 84 -6.804 9.238 0.725 622 HD22 LEU 84 1HD2 LEU 84 -5.091 9.347 1.139 623 HD23 LEU 84 2HD2 LEU 84 -6.309 9.919 2.274 624 H SER 85 H SER 85 -10.322 9.607 4.180 625 HA SER 85 HA SER 85 -11.353 7.767 6.185 626 HB2 SER 85 2HB SER 85 -13.210 9.539 6.287 627 HB3 SER 85 1HB SER 85 -11.590 10.088 6.713 628 HG SER 85 HG SER 85 -11.399 11.056 4.713 629 H PHE 86 H PHE 86 -12.662 6.115 5.680 630 HA PHE 86 HA PHE 86 -14.606 6.255 3.536 631 HB2 PHE 86 2HB PHE 86 -13.789 4.225 2.349 632 HB3 PHE 86 1HB PHE 86 -12.639 5.542 2.250 633 HD1 PHE 86 HD1 PHE 86 -10.489 5.434 3.510 634 HD2 PHE 86 HD2 PHE 86 -13.214 2.142 3.479 635 HE1 PHE 86 HE1 PHE 86 -8.712 3.950 4.330 636 HE2 PHE 86 HE2 PHE 86 -11.434 0.664 4.302 637 HZ PHE 86 HZ PHE 86 -9.183 1.565 4.730 638 H ASP 87 H ASP 87 -15.514 3.866 3.311 639 HA ASP 87 HA ASP 87 -15.871 2.650 5.994 640 HB2 ASP 87 2HB ASP 87 -18.148 1.973 5.297 641 HB3 ASP 87 1HB ASP 87 -17.967 3.721 5.270 642 H LEU 88 H LEU 88 -15.771 0.422 6.099 643 HA LEU 88 HA LEU 88 -15.467 -1.225 3.710 644 HB2 LEU 88 2HB LEU 88 -13.130 -0.523 4.198 645 HB3 LEU 88 1HB LEU 88 -13.301 -1.078 5.857 646 HG LEU 88 HG LEU 88 -13.592 -3.424 5.014 647 HD11 LEU 88 1HD1 LEU 88 -12.946 -2.256 2.290 648 HD12 LEU 88 2HD1 LEU 88 -14.471 -2.991 2.789 649 HD13 LEU 88 3HD1 LEU 88 -13.016 -3.977 2.681 650 HD21 LEU 88 3HD2 LEU 88 -11.236 -3.803 4.445 651 HD22 LEU 88 1HD2 LEU 88 -11.404 -2.656 5.773 652 HD23 LEU 88 2HD2 LEU 88 -11.018 -2.076 4.150 653 H ASP 89 H ASP 89 -16.238 -3.282 4.073 654 HA ASP 89 HA ASP 89 -17.223 -5.078 5.021 655 HB2 ASP 89 2HB ASP 89 -15.289 -5.297 6.502 656 HB3 ASP 89 1HB ASP 89 -15.933 -4.081 7.596 657 H GLY 90 H GLY 90 -17.589 -2.787 7.707 658 HA2 GLY 90 2HA GLY 90 -20.241 -1.941 7.065 659 HA3 GLY 90 1HA GLY 90 -20.258 -3.164 8.338 660 H GLU 91 H GLU 91 -17.492 -1.150 8.097 661 HA GLU 91 HA GLU 91 -18.272 0.507 10.418 662 HB2 GLU 91 2HB GLU 91 -16.094 -0.039 11.489 663 HB3 GLU 91 1HB GLU 91 -17.043 -1.501 11.238 664 HG2 GLU 91 2HG GLU 91 -15.697 -1.906 9.129 665 HG3 GLU 91 1HG GLU 91 -14.677 -0.554 9.604 666 H SER 92 H SER 92 -17.090 2.493 10.570 667 HA SER 92 HA SER 92 -15.947 3.566 8.145 668 HB2 SER 92 2HB SER 92 -17.252 4.990 9.715 669 HB3 SER 92 1HB SER 92 -16.034 4.742 10.970 670 HG SER 92 HG SER 92 -15.554 5.936 8.426 671 H ARG 93 H ARG 93 -13.807 3.535 7.578 672 HA ARG 93 HA ARG 93 -11.773 2.799 9.595 673 HB2 ARG 93 2HB ARG 93 -12.023 1.795 6.730 674 HB3 ARG 93 1HB ARG 93 -10.607 1.536 7.731 675 HG2 ARG 93 2HG ARG 93 -13.371 0.479 8.408 676 HG3 ARG 93 1HG ARG 93 -12.144 -0.436 7.530 677 HD2 ARG 93 2HD ARG 93 -11.990 -1.167 9.777 678 HD3 ARG 93 1HD ARG 93 -10.618 -0.082 9.552 679 HE ARG 93 HE ARG 93 -13.141 0.705 10.900 680 HH11 ARG 93 1HH1 ARG 93 -9.619 0.761 10.789 681 HH12 ARG 93 2HH1 ARG 93 -9.473 1.748 12.202 682 HH21 ARG 93 1HH2 ARG 93 -12.913 2.034 12.738 683 HH22 ARG 93 2HH2 ARG 93 -11.333 2.468 13.304 684 H ASP 94 H ASP 94 -9.842 3.845 9.454 685 HA ASP 94 HA ASP 94 -9.406 5.841 7.299 686 HB2 ASP 94 2HB ASP 94 -8.310 5.741 10.148 687 HB3 ASP 94 1HB ASP 94 -7.754 6.885 8.932 688 H LEU 95 H LEU 95 -7.643 5.571 6.000 689 HA LEU 95 HA LEU 95 -5.349 3.998 7.021 690 HB2 LEU 95 2HB LEU 95 -6.397 4.085 4.162 691 HB3 LEU 95 1HB LEU 95 -4.792 3.498 4.582 692 HG LEU 95 HG LEU 95 -7.448 2.266 5.404 693 HD11 LEU 95 1HD1 LEU 95 -6.789 1.798 3.104 694 HD12 LEU 95 2HD1 LEU 95 -6.684 0.346 4.095 695 HD13 LEU 95 3HD1 LEU 95 -5.213 1.215 3.652 696 HD21 LEU 95 3HD2 LEU 95 -5.901 2.084 7.288 697 HD22 LEU 95 1HD2 LEU 95 -4.653 1.418 6.232 698 HD23 LEU 95 2HD2 LEU 95 -6.136 0.511 6.535 699 H HIS 96 H HIS 96 -3.553 5.151 7.160 700 HA HIS 96 HA HIS 96 -3.684 7.977 6.433 701 HB2 HIS 96 2HB HIS 96 -1.721 6.412 8.179 702 HB3 HIS 96 1HB HIS 96 -1.739 8.165 7.986 703 HD2 HIS 96 HD2 HIS 96 -4.243 5.408 9.384 704 HE1 HIS 96 HE1 HIS 96 -4.870 9.078 11.377 705 HE2 HIS 96 HE2 HIS 96 -5.746 6.737 11.018 706 H ALA 97 H ALA 97 -2.540 8.828 4.808 707 HA ALA 97 HA ALA 97 -0.853 7.080 3.152 708 HB1 ALA 97 3HB ALA 97 -1.333 8.666 1.325 709 HB2 ALA 97 1HB ALA 97 -2.266 9.680 2.434 710 HB3 ALA 97 2HB ALA 97 -2.825 8.053 2.039 711 H PHE 98 H PHE 98 1.262 7.423 3.082 712 HA PHE 98 HA PHE 98 2.399 9.948 4.144 713 HB2 PHE 98 2HB PHE 98 3.835 7.268 4.336 714 HB3 PHE 98 1HB PHE 98 4.090 8.726 5.276 715 HD1 PHE 98 HD1 PHE 98 2.621 9.224 7.220 716 HD2 PHE 98 HD2 PHE 98 2.209 5.597 5.013 717 HE1 PHE 98 HE1 PHE 98 1.358 8.227 9.071 718 HE2 PHE 98 HE2 PHE 98 0.945 4.605 6.874 719 HZ PHE 98 HZ PHE 98 0.517 5.923 8.907 720 H ARG 99 H ARG 99 4.653 10.229 3.415 721 HA ARG 99 HA ARG 99 5.756 8.706 1.243 722 HB2 ARG 99 2HB ARG 99 6.004 10.592 -0.350 723 HB3 ARG 99 1HB ARG 99 4.316 10.196 -0.078 724 HG2 ARG 99 2HG ARG 99 4.776 12.217 1.793 725 HG3 ARG 99 1HG ARG 99 5.757 12.720 0.418 726 HD2 ARG 99 2HD ARG 99 2.787 12.104 0.396 727 HD3 ARG 99 1HD ARG 99 3.528 13.695 0.287 728 HE ARG 99 HE ARG 99 4.397 11.954 -1.824 729 HH11 ARG 99 1HH1 ARG 99 1.726 14.056 -0.896 730 HH12 ARG 99 2HH1 ARG 99 1.218 14.314 -2.536 731 HH21 ARG 99 1HH2 ARG 99 3.664 12.276 -3.949 732 HH22 ARG 99 2HH2 ARG 99 2.304 13.316 -4.253 733 H GLN 100 H GLN 100 8.059 9.180 1.064 734 HA GLN 100 HA GLN 100 9.174 9.229 3.570 735 HB2 GLN 100 2HB GLN 100 10.531 9.706 0.903 736 HB3 GLN 100 1HB GLN 100 11.413 9.450 2.406 737 HG2 GLN 100 2HG GLN 100 10.136 7.217 2.581 738 HG3 GLN 100 1HG GLN 100 9.662 7.491 0.906 739 HE21 GLN 100 1HE2 GLN 100 12.832 8.292 2.320 740 HE22 GLN 100 2HE2 GLN 100 13.719 7.149 1.381 741 H ALA 101 H ALA 101 10.092 11.835 1.235 742 HA ALA 101 HA ALA 101 10.132 13.720 3.537 743 HB1 ALA 101 3HB ALA 101 12.380 13.221 2.649 744 HB2 ALA 101 1HB ALA 101 11.945 14.914 2.407 745 HB3 ALA 101 2HB ALA 101 11.884 13.784 1.050 746 H ALA 102 H ALA 102 10.264 14.289 -0.012 747 HA ALA 102 HA ALA 102 8.009 16.201 0.237 748 HB1 ALA 102 3HB ALA 102 10.174 17.361 0.445 749 HB2 ALA 102 1HB ALA 102 9.377 17.803 -1.066 750 HB3 ALA 102 2HB ALA 102 10.719 16.655 -1.078 751 H ASP 103 H ASP 103 7.597 13.618 -0.892 752 HA ASP 103 HA ASP 103 8.204 13.487 -3.685 753 HB2 ASP 103 2HB ASP 103 7.813 11.415 -2.424 754 HB3 ASP 103 1HB ASP 103 6.181 11.928 -2.009 755 H GLU 104 H GLU 104 6.952 13.946 -5.433 756 HA GLU 104 HA GLU 104 4.153 14.805 -5.160 757 HB2 GLU 104 2HB GLU 104 4.551 16.759 -6.671 758 HB3 GLU 104 1HB GLU 104 5.408 16.917 -5.141 759 HG2 GLU 104 2HG GLU 104 7.501 16.165 -6.254 760 HG3 GLU 104 1HG GLU 104 6.631 16.067 -7.783 761 H SER 105 H SER 105 6.049 12.581 -6.273 762 HA SER 105 HA SER 105 5.299 12.440 -9.097 763 HB2 SER 105 2HB SER 105 7.593 11.815 -8.348 764 HB3 SER 105 1HB SER 105 6.921 10.534 -7.344 765 HG SER 105 HG SER 105 6.283 9.452 -9.179 766 H ARG 106 H ARG 106 3.514 12.121 -6.587 767 HA ARG 106 HA ARG 106 1.436 11.331 -6.198 768 HB2 ARG 106 2HB ARG 106 1.647 9.584 -8.693 769 HB3 ARG 106 1HB ARG 106 0.177 10.022 -7.833 770 HG2 ARG 106 2HG ARG 106 1.932 11.824 -9.519 771 HG3 ARG 106 1HG ARG 106 0.279 11.311 -9.856 772 HD2 ARG 106 2HD ARG 106 -0.539 12.625 -7.961 773 HD3 ARG 106 1HD ARG 106 1.115 13.090 -7.541 774 HE ARG 106 HE ARG 106 -0.152 13.840 -10.120 775 HH11 ARG 106 1HH1 ARG 106 1.721 14.751 -7.279 776 HH12 ARG 106 2HH1 ARG 106 1.977 16.377 -7.821 777 HH21 ARG 106 1HH2 ARG 106 0.154 15.998 -10.793 778 HH22 ARG 106 2HH2 ARG 106 1.091 17.086 -9.812 779 H THR 107 H THR 107 4.068 9.893 -5.511 780 HA THR 107 HA THR 107 3.177 7.112 -5.245 781 HB THR 107 HB THR 107 5.902 8.340 -4.652 782 HG1 THR 107 HG1 THR 107 4.754 7.102 -6.931 783 HG21 THR 107 3HG2 THR 107 5.044 5.420 -4.844 784 HG22 THR 107 1HG2 THR 107 5.545 6.255 -3.368 785 HG23 THR 107 2HG2 THR 107 6.708 5.990 -4.669 786 H LEU 108 H LEU 108 1.816 6.996 -3.648 787 HA LEU 108 HA LEU 108 2.452 8.048 -0.951 788 HB2 LEU 108 2HB LEU 108 -0.234 7.303 -2.181 789 HB3 LEU 108 1HB LEU 108 -0.008 7.799 -0.508 790 HG LEU 108 HG LEU 108 0.609 9.558 -2.915 791 HD11 LEU 108 1HD1 LEU 108 -1.791 9.131 -2.748 792 HD12 LEU 108 2HD1 LEU 108 -1.411 10.803 -2.345 793 HD13 LEU 108 3HD1 LEU 108 -1.783 9.650 -1.059 794 HD21 LEU 108 3HD2 LEU 108 0.549 10.210 0.050 795 HD22 LEU 108 1HD2 LEU 108 0.774 11.377 -1.257 796 HD23 LEU 108 2HD2 LEU 108 1.982 10.127 -0.979 797 H PHE 109 H PHE 109 2.589 6.627 0.698 798 HA PHE 109 HA PHE 109 2.393 3.740 0.071 799 HB2 PHE 109 2HB PHE 109 4.706 4.680 0.484 800 HB3 PHE 109 1HB PHE 109 4.200 5.136 2.105 801 HD1 PHE 109 HD1 PHE 109 4.257 2.082 -0.113 802 HD2 PHE 109 HD2 PHE 109 4.796 3.649 3.833 803 HE1 PHE 109 HE1 PHE 109 4.968 -0.138 0.682 804 HE2 PHE 109 HE2 PHE 109 5.501 1.427 4.618 805 HZ PHE 109 HZ PHE 109 5.587 -0.468 3.043 806 H VAL 110 H VAL 110 0.636 2.907 0.978 807 HA VAL 110 HA VAL 110 -0.202 3.748 3.695 808 HB VAL 110 HB VAL 110 -2.554 2.887 3.014 809 HG11 VAL 110 1HG1 VAL 110 -1.557 5.441 1.711 810 HG12 VAL 110 2HG1 VAL 110 -2.103 5.264 3.380 811 HG13 VAL 110 3HG1 VAL 110 -3.244 5.041 2.056 812 HG21 VAL 110 3HG2 VAL 110 -1.451 3.308 0.206 813 HG22 VAL 110 1HG2 VAL 110 -3.145 3.021 0.616 814 HG23 VAL 110 2HG2 VAL 110 -1.942 1.768 0.909 815 HA PRO 111 HA PRO 111 0.622 -0.750 4.259 816 HB2 PRO 111 2HB PRO 111 1.759 -0.498 6.751 817 HB3 PRO 111 1HB PRO 111 2.708 -0.312 5.262 818 HG2 PRO 111 2HG PRO 111 1.613 1.808 7.069 819 HG3 PRO 111 1HG PRO 111 3.189 1.727 6.248 820 HD2 PRO 111 2HD PRO 111 1.060 3.215 5.314 821 HD3 PRO 111 1HD PRO 111 2.347 2.575 4.272 822 H PHE 112 H PHE 112 -1.179 -1.825 5.011 823 HA PHE 112 HA PHE 112 -2.684 -0.636 7.263 824 HB2 PHE 112 2HB PHE 112 -4.775 -1.315 6.404 825 HB3 PHE 112 1HB PHE 112 -3.953 -0.531 5.076 826 HD1 PHE 112 HD1 PHE 112 -3.320 -1.830 3.062 827 HD2 PHE 112 HD2 PHE 112 -5.341 -3.702 6.334 828 HE1 PHE 112 HE1 PHE 112 -3.970 -3.707 1.608 829 HE2 PHE 112 HE2 PHE 112 -5.974 -5.574 4.873 830 HZ PHE 112 HZ PHE 112 -5.295 -5.576 2.503 831 H ARG 113 H ARG 113 -3.809 -2.216 8.620 832 HA ARG 113 HA ARG 113 -2.640 -4.922 8.564 833 HB2 ARG 113 2HB ARG 113 -1.291 -3.397 10.106 834 HB3 ARG 113 1HB ARG 113 -2.731 -3.236 11.111 835 HG2 ARG 113 2HG ARG 113 -2.744 -5.654 11.523 836 HG3 ARG 113 1HG ARG 113 -1.359 -5.860 10.451 837 HD2 ARG 113 2HD ARG 113 -0.066 -4.331 12.027 838 HD3 ARG 113 1HD ARG 113 -1.429 -4.480 13.146 839 HE ARG 113 HE ARG 113 -0.935 -7.037 12.750 840 HH11 ARG 113 1HH1 ARG 113 1.383 -4.454 13.286 841 HH12 ARG 113 2HH1 ARG 113 2.564 -5.495 14.013 842 HH21 ARG 113 1HH2 ARG 113 0.645 -8.412 13.666 843 HH22 ARG 113 2HH2 ARG 113 2.142 -7.745 14.229 844 H ASP 114 H ASP 114 -4.257 -6.356 8.678 845 HA ASP 114 HA ASP 114 -6.853 -5.538 9.842 846 HB2 ASP 114 2HB ASP 114 -7.981 -6.562 7.998 847 HB3 ASP 114 1HB ASP 114 -6.706 -5.593 7.268 848 H LYS 115 H LYS 115 -8.040 -8.142 9.515 849 HA LYS 115 HA LYS 115 -6.771 -9.418 11.825 850 HB2 LYS 115 2HB LYS 115 -9.461 -10.023 10.546 851 HB3 LYS 115 1HB LYS 115 -8.883 -10.622 12.098 852 HG2 LYS 115 2HG LYS 115 -9.595 -7.766 11.384 853 HG3 LYS 115 1HG LYS 115 -10.475 -8.838 12.465 854 HD2 LYS 115 2HD LYS 115 -7.666 -7.792 12.997 855 HD3 LYS 115 1HD LYS 115 -9.140 -7.050 13.611 856 HE2 LYS 115 2HE LYS 115 -8.263 -8.362 15.394 857 HE3 LYS 115 1HE LYS 115 -9.644 -9.259 14.771 858 HZ1 LYS 115 3HZ LYS 115 -8.242 -10.807 13.746 859 HZ2 LYS 115 1HZ LYS 115 -7.559 -10.555 15.268 860 HZ3 LYS 115 2HZ LYS 115 -6.878 -9.832 13.909 861 H THR 116 H THR 116 -6.516 -9.880 8.493 862 HA THR 116 HA THR 116 -6.014 -12.756 8.683 863 HB THR 116 HB THR 116 -5.236 -12.692 6.376 864 HG1 THR 116 HG1 THR 116 -5.654 -9.910 6.158 865 HG21 THR 116 3HG2 THR 116 -7.705 -10.941 6.657 866 HG22 THR 116 1HG2 THR 116 -7.685 -12.707 6.675 867 HG23 THR 116 2HG2 THR 116 -7.232 -11.834 5.211 868 H THR 117 H THR 117 -4.291 -9.761 9.059 869 HA THR 117 HA THR 117 -1.624 -10.790 8.933 870 HB THR 117 HB THR 117 -2.662 -8.267 10.311 871 HG1 THR 117 HG1 THR 117 -3.036 -8.373 8.003 872 HG21 THR 117 3HG2 THR 117 -0.328 -7.457 10.116 873 HG22 THR 117 1HG2 THR 117 0.164 -9.019 9.454 874 HG23 THR 117 2HG2 THR 117 -0.407 -8.904 11.121 875 H GLY 118 H GLY 118 -0.397 -11.642 10.545 876 HA2 GLY 118 2HA GLY 118 0.186 -12.717 12.464 877 HA3 GLY 118 1HA GLY 118 -0.955 -11.696 13.316 878 H GLN 119 H GLN 119 -2.714 -13.265 10.938 879 HA GLN 119 HA GLN 119 -3.467 -15.482 12.739 880 HB2 GLN 119 2HB GLN 119 -5.394 -13.513 11.440 881 HB3 GLN 119 1HB GLN 119 -5.889 -14.995 12.238 882 HG2 GLN 119 2HG GLN 119 -4.483 -12.683 13.607 883 HG3 GLN 119 1HG GLN 119 -6.220 -12.955 13.620 884 HE21 GLN 119 1HE2 GLN 119 -3.178 -13.904 14.969 885 HE22 GLN 119 2HE2 GLN 119 -3.803 -14.970 16.172 886 H GLN 120 H GLN 120 -4.896 -14.331 9.654 887 HA GLN 120 HA GLN 120 -5.128 -17.089 8.773 888 HB2 GLN 120 2HB GLN 120 -6.115 -14.526 7.461 889 HB3 GLN 120 1HB GLN 120 -6.550 -16.158 6.969 890 HG2 GLN 120 2HG GLN 120 -7.639 -16.500 9.185 891 HG3 GLN 120 1HG GLN 120 -7.253 -14.828 9.602 892 HE21 GLN 120 1HE2 GLN 120 -9.444 -14.286 9.827 893 HE22 GLN 120 2HE2 GLN 120 -10.514 -14.146 8.481 894 H SER 121 H SER 121 -2.515 -15.232 8.511 895 HA SER 121 HA SER 121 -1.352 -16.324 6.236 896 HB2 SER 121 2HB SER 121 -1.304 -14.209 4.744 897 HB3 SER 121 1HB SER 121 -2.828 -15.096 4.782 898 HG SER 121 HG SER 121 -3.741 -13.532 5.929 899 H TYR 122 H TYR 122 -0.559 -16.037 8.724 900 HA TYR 122 HA TYR 122 0.923 -15.291 10.233 901 HB2 TYR 122 2HB TYR 122 3.303 -15.161 9.349 902 HB3 TYR 122 1HB TYR 122 2.415 -16.629 8.986 903 HD1 TYR 122 HD2 TYR 122 3.489 -13.360 7.476 904 HD2 TYR 122 HD1 TYR 122 2.258 -17.385 6.748 905 HE1 TYR 122 HE2 TYR 122 4.011 -13.091 5.088 906 HE2 TYR 122 HE1 TYR 122 2.776 -17.117 4.370 907 HH TYR 122 HH TYR 122 4.594 -14.628 3.136 908 H ASP 123 H ASP 123 3.105 -13.645 10.310 909 HA ASP 123 HA ASP 123 1.663 -11.165 10.904 910 HB2 ASP 123 2HB ASP 123 3.134 -12.566 12.558 911 HB3 ASP 123 1HB ASP 123 4.513 -11.835 11.752 912 H GLY 124 H GLY 124 3.817 -9.323 10.968 913 HA2 GLY 124 2HA GLY 124 5.419 -8.253 9.567 914 HA3 GLY 124 1HA GLY 124 4.725 -9.061 8.167 915 H GLY 125 H GLY 125 2.424 -8.565 7.744 916 HA2 GLY 125 2HA GLY 125 0.657 -6.794 8.446 917 HA3 GLY 125 1HA GLY 125 1.902 -5.660 7.932 918 H ARG 126 H ARG 126 -0.261 -5.280 6.613 919 HA ARG 126 HA ARG 126 0.152 -6.543 3.950 920 HB2 ARG 126 2HB ARG 126 -2.255 -4.905 4.864 921 HB3 ARG 126 1HB ARG 126 -2.102 -5.823 3.377 922 HG2 ARG 126 2HG ARG 126 -2.225 -7.054 6.142 923 HG3 ARG 126 1HG ARG 126 -3.618 -6.824 5.091 924 HD2 ARG 126 2HD ARG 126 -3.110 -9.043 4.675 925 HD3 ARG 126 1HD ARG 126 -2.198 -8.264 3.385 926 HE ARG 126 HE ARG 126 -0.184 -8.578 4.694 927 HH11 ARG 126 1HH1 ARG 126 -2.981 -10.410 5.803 928 HH12 ARG 126 2HH1 ARG 126 -2.028 -11.589 6.648 929 HH21 ARG 126 1HH2 ARG 126 1.050 -10.129 5.850 930 HH22 ARG 126 2HH2 ARG 126 0.254 -11.432 6.677 931 H TYR 127 H TYR 127 0.914 -5.174 2.345 932 HA TYR 127 HA TYR 127 1.133 -2.279 2.999 933 HB2 TYR 127 2HB TYR 127 2.970 -3.993 1.256 934 HB3 TYR 127 1HB TYR 127 3.143 -2.254 1.522 935 HD1 TYR 127 HD1 TYR 127 3.607 -1.402 3.878 936 HD2 TYR 127 HD2 TYR 127 3.823 -5.552 2.892 937 HE1 TYR 127 HE1 TYR 127 4.843 -1.836 5.957 938 HE2 TYR 127 HE2 TYR 127 5.068 -5.970 4.963 939 HH TYR 127 HH TYR 127 6.567 -4.581 6.529 940 H MET 128 H MET 128 0.314 -0.846 1.627 941 HA MET 128 HA MET 128 -0.323 -1.645 -1.147 942 HB2 MET 128 2HB MET 128 -2.082 0.048 0.690 943 HB3 MET 128 1HB MET 128 -2.307 -0.080 -1.052 944 HG2 MET 128 2HG MET 128 -2.587 -2.604 -0.636 945 HG3 MET 128 1HG MET 128 -2.765 -2.157 1.061 946 HE1 MET 128 3HE MET 128 -5.836 0.380 0.672 947 HE2 MET 128 1HE MET 128 -4.168 0.831 0.312 948 HE3 MET 128 2HE MET 128 -4.535 -0.128 1.751 949 H GLU 129 H GLU 129 -0.152 0.040 -2.642 950 HA GLU 129 HA GLU 129 0.953 2.625 -1.742 951 HB2 GLU 129 2HB GLU 129 2.812 1.244 -2.523 952 HB3 GLU 129 1HB GLU 129 1.934 0.835 -3.990 953 HG2 GLU 129 2HG GLU 129 2.042 3.262 -4.656 954 HG3 GLU 129 1HG GLU 129 3.074 3.545 -3.251 955 H LEU 130 H LEU 130 -0.131 4.249 -2.574 956 HA LEU 130 HA LEU 130 -2.083 3.879 -4.751 957 HB2 LEU 130 2HB LEU 130 -1.654 6.246 -2.894 958 HB3 LEU 130 1HB LEU 130 -3.056 5.950 -3.917 959 HG LEU 130 HG LEU 130 -2.353 3.990 -1.722 960 HD11 LEU 130 1HD1 LEU 130 -3.733 5.253 -0.168 961 HD12 LEU 130 2HD1 LEU 130 -3.886 6.562 -1.344 962 HD13 LEU 130 3HD1 LEU 130 -2.303 6.154 -0.667 963 HD21 LEU 130 3HD2 LEU 130 -4.102 3.331 -3.322 964 HD22 LEU 130 1HD2 LEU 130 -5.015 4.798 -2.946 965 HD23 LEU 130 2HD2 LEU 130 -4.766 3.565 -1.706 966 H GLU 131 H GLU 131 -1.398 4.585 -6.747 967 HA GLU 131 HA GLU 131 0.057 7.158 -6.819 968 HB2 GLU 131 2HB GLU 131 -0.074 4.919 -8.882 969 HB3 GLU 131 1HB GLU 131 0.668 6.494 -9.169 970 HG2 GLU 131 2HG GLU 131 2.320 6.098 -7.414 971 HG3 GLU 131 1HG GLU 131 1.534 4.589 -6.966 972 HA PRO 132 HA PRO 132 -4.319 8.227 -7.926 973 HB2 PRO 132 2HB PRO 132 -4.081 10.860 -7.086 974 HB3 PRO 132 1HB PRO 132 -4.508 9.524 -6.000 975 HG2 PRO 132 2HG PRO 132 -1.813 10.770 -6.471 976 HG3 PRO 132 1HG PRO 132 -2.613 10.375 -4.929 977 HD2 PRO 132 2HD PRO 132 -0.764 8.740 -5.930 978 HD3 PRO 132 1HD PRO 132 -2.217 8.072 -5.159 979 H ASP 133 H ASP 133 -5.126 9.944 -9.389 980 HA ASP 133 HA ASP 133 -3.613 10.142 -11.781 981 HB2 ASP 133 2HB ASP 133 -6.004 10.109 -11.984 982 HB3 ASP 133 1HB ASP 133 -6.209 11.397 -10.804 983 H ARG 134 H ARG 134 -4.739 12.613 -9.513 984 HA ARG 134 HA ARG 134 -2.390 14.305 -10.094 985 HB2 ARG 134 2HB ARG 134 -3.969 16.144 -9.142 986 HB3 ARG 134 1HB ARG 134 -4.241 15.580 -10.779 987 HG2 ARG 134 2HG ARG 134 -6.380 15.841 -9.734 988 HG3 ARG 134 1HG ARG 134 -6.096 14.122 -9.927 989 HD2 ARG 134 2HD ARG 134 -5.691 13.834 -7.582 990 HD3 ARG 134 1HD ARG 134 -5.561 15.574 -7.321 991 HE ARG 134 HE ARG 134 -7.815 15.695 -7.125 992 HH11 ARG 134 1HH1 ARG 134 -7.172 12.633 -8.737 993 HH12 ARG 134 2HH1 ARG 134 -8.822 12.117 -8.639 994 HH21 ARG 134 1HH2 ARG 134 -9.941 14.962 -6.951 995 HH22 ARG 134 2HH2 ARG 134 -10.377 13.429 -7.634 996 H ASP 135 H ASP 135 -2.104 15.835 -7.955 997 HA ASP 135 HA ASP 135 -1.384 13.909 -5.904 998 HB2 ASP 135 2HB ASP 135 -0.084 16.132 -6.639 999 HB3 ASP 135 1HB ASP 135 -1.092 16.884 -5.415 1000 H LEU 136 H LEU 136 -2.068 14.100 -3.647 1001 HA LEU 136 HA LEU 136 -4.941 14.725 -3.535 1002 HB2 LEU 136 2HB LEU 136 -3.226 12.996 -1.715 1003 HB3 LEU 136 1HB LEU 136 -4.960 13.235 -1.553 1004 HG LEU 136 HG LEU 136 -3.514 11.791 -3.801 1005 HD11 LEU 136 1HD1 LEU 136 -5.552 10.768 -1.807 1006 HD12 LEU 136 2HD1 LEU 136 -3.810 10.534 -1.693 1007 HD13 LEU 136 3HD1 LEU 136 -4.703 9.829 -3.036 1008 HD21 LEU 136 3HD2 LEU 136 -6.483 12.431 -3.630 1009 HD22 LEU 136 1HD2 LEU 136 -5.734 11.337 -4.799 1010 HD23 LEU 136 2HD2 LEU 136 -5.338 13.053 -4.822 1011 H SER 137 H SER 137 -5.602 16.448 -2.539 1012 HA SER 137 HA SER 137 -4.203 17.469 -0.138 1013 HB2 SER 137 2HB SER 137 -5.750 19.094 -2.209 1014 HB3 SER 137 1HB SER 137 -5.085 19.729 -0.699 1015 HG SER 137 HG SER 137 -3.573 18.519 -2.778 1016 H ASP 138 H ASP 138 -5.901 18.768 1.211 1017 HA ASP 138 HA ASP 138 -7.786 16.890 2.150 1018 HB2 ASP 138 2HB ASP 138 -8.476 18.729 3.715 1019 HB3 ASP 138 1HB ASP 138 -6.751 18.413 3.699 1020 H GLY 139 H GLY 139 -9.377 16.306 0.781 1021 HA2 GLY 139 2HA GLY 139 -11.784 17.010 0.462 1022 HA3 GLY 139 1HA GLY 139 -11.137 18.382 -0.423 1023 H ASP 140 H ASP 140 -8.978 16.490 -1.506 1024 HA ASP 140 HA ASP 140 -10.277 15.717 -3.924 1025 HB2 ASP 140 2HB ASP 140 -7.522 15.036 -2.807 1026 HB3 ASP 140 1HB ASP 140 -8.060 14.537 -4.410 1027 H GLU 141 H GLU 141 -10.209 13.455 -4.812 1028 HA GLU 141 HA GLU 141 -11.046 11.483 -2.767 1029 HB2 GLU 141 2HB GLU 141 -11.694 11.704 -5.739 1030 HB3 GLU 141 1HB GLU 141 -12.289 10.437 -4.667 1031 HG2 GLU 141 2HG GLU 141 -13.597 12.002 -3.392 1032 HG3 GLU 141 1HG GLU 141 -12.839 13.380 -4.185 1033 H ILE 142 H ILE 142 -10.538 9.207 -3.191 1034 HA ILE 142 HA ILE 142 -8.251 8.540 -4.851 1035 HB ILE 142 HB ILE 142 -7.148 9.463 -2.820 1036 HG12 ILE 142 2HG1 ILE 142 -5.731 7.484 -2.199 1037 HG13 ILE 142 1HG1 ILE 142 -6.885 6.420 -2.993 1038 HG21 ILE 142 1HG2 ILE 142 -8.679 7.357 -1.261 1039 HG22 ILE 142 2HG2 ILE 142 -8.923 9.104 -1.180 1040 HG23 ILE 142 3HG2 ILE 142 -7.411 8.398 -0.611 1041 HD11 ILE 142 3HD1 ILE 142 -4.904 6.813 -4.355 1042 HD12 ILE 142 1HD1 ILE 142 -5.222 8.548 -4.356 1043 HD13 ILE 142 2HD1 ILE 142 -6.345 7.440 -5.152 1044 H THR 143 H THR 143 -8.072 6.275 -5.106 1045 HA THR 143 HA THR 143 -10.377 4.660 -4.180 1046 HB THR 143 HB THR 143 -8.402 4.059 -6.438 1047 HG1 THR 143 HG1 THR 143 -10.884 5.440 -6.430 1048 HG21 THR 143 3HG2 THR 143 -9.627 2.079 -5.607 1049 HG22 THR 143 1HG2 THR 143 -10.159 2.521 -7.230 1050 HG23 THR 143 2HG2 THR 143 -11.159 2.927 -5.834 1051 H LEU 144 H LEU 144 -10.007 2.904 -2.806 1052 HA LEU 144 HA LEU 144 -7.226 2.322 -1.980 1053 HB2 LEU 144 2HB LEU 144 -9.845 2.284 -0.456 1054 HB3 LEU 144 1HB LEU 144 -8.544 1.229 0.060 1055 HG LEU 144 HG LEU 144 -8.575 3.271 1.404 1056 HD11 LEU 144 1HD1 LEU 144 -6.155 3.221 -0.428 1057 HD12 LEU 144 2HD1 LEU 144 -6.403 2.202 0.992 1058 HD13 LEU 144 3HD1 LEU 144 -6.236 3.946 1.182 1059 HD21 LEU 144 3HD2 LEU 144 -9.603 4.790 -0.231 1060 HD22 LEU 144 1HD2 LEU 144 -8.107 4.811 -1.169 1061 HD23 LEU 144 2HD2 LEU 144 -8.141 5.480 0.466 1062 H ASP 145 H ASP 145 -6.676 0.757 -3.362 1063 HA ASP 145 HA ASP 145 -8.359 -1.562 -3.885 1064 HB2 ASP 145 2HB ASP 145 -5.696 -0.569 -4.947 1065 HB3 ASP 145 1HB ASP 145 -6.278 -2.186 -5.315 1066 H PHE 146 H PHE 146 -8.404 -2.599 -1.850 1067 HA PHE 146 HA PHE 146 -6.041 -3.578 -0.508 1068 HB2 PHE 146 2HB PHE 146 -8.844 -4.782 -0.373 1069 HB3 PHE 146 1HB PHE 146 -7.573 -4.883 0.846 1070 HD1 PHE 146 HD2 PHE 146 -6.679 -2.363 1.523 1071 HD2 PHE 146 HD1 PHE 146 -10.618 -3.390 0.219 1072 HE1 PHE 146 HE2 PHE 146 -7.562 -0.346 2.586 1073 HE2 PHE 146 HE1 PHE 146 -11.496 -1.357 1.291 1074 HZ PHE 146 HZ PHE 146 -9.967 0.165 2.478 1075 H ASN 147 H ASN 147 -7.944 -4.415 -3.185 1076 HA ASN 147 HA ASN 147 -7.188 -7.158 -3.530 1077 HB2 ASN 147 2HB ASN 147 -8.370 -6.862 -5.724 1078 HB3 ASN 147 1HB ASN 147 -9.338 -6.397 -4.332 1079 HD21 ASN 147 1HD2 ASN 147 -7.618 -5.210 -7.149 1080 HD22 ASN 147 2HD2 ASN 147 -8.272 -3.607 -7.114 1081 H LEU 148 H LEU 148 -5.362 -4.374 -3.911 1082 HA LEU 148 HA LEU 148 -3.565 -5.735 -5.857 1083 HB2 LEU 148 2HB LEU 148 -3.851 -2.719 -5.454 1084 HB3 LEU 148 1HB LEU 148 -2.756 -3.506 -6.577 1085 HG LEU 148 HG LEU 148 -5.793 -3.397 -6.779 1086 HD11 LEU 148 1HD1 LEU 148 -3.666 -2.128 -8.533 1087 HD12 LEU 148 2HD1 LEU 148 -4.718 -1.293 -7.386 1088 HD13 LEU 148 3HD1 LEU 148 -5.412 -2.068 -8.807 1089 HD21 LEU 148 3HD2 LEU 148 -3.870 -4.773 -8.676 1090 HD22 LEU 148 1HD2 LEU 148 -5.606 -4.555 -8.927 1091 HD23 LEU 148 2HD2 LEU 148 -5.029 -5.569 -7.607 1092 H ALA 149 H ALA 149 -3.856 -5.697 -2.803 1093 HA ALA 149 HA ALA 149 -1.687 -4.213 -1.690 1094 HB1 ALA 149 3HB ALA 149 -2.151 -5.437 0.390 1095 HB2 ALA 149 1HB ALA 149 -3.188 -6.565 -0.490 1096 HB3 ALA 149 2HB ALA 149 -3.647 -4.867 -0.353 1097 H TYR 150 H TYR 150 0.364 -4.780 -1.223 1098 HA TYR 150 HA TYR 150 1.566 -7.099 -2.509 1099 HB2 TYR 150 2HB TYR 150 3.054 -5.021 -0.852 1100 HB3 TYR 150 1HB TYR 150 3.666 -6.003 -2.181 1101 HD1 TYR 150 HD1 TYR 150 2.339 -5.572 -4.524 1102 HD2 TYR 150 HD2 TYR 150 2.643 -2.769 -1.314 1103 HE1 TYR 150 HE1 TYR 150 1.872 -3.733 -6.080 1104 HE2 TYR 150 HE2 TYR 150 2.183 -0.935 -2.873 1105 HH TYR 150 HH TYR 150 2.323 -0.440 -5.264 1106 H SER 151 H SER 151 2.552 -8.812 -1.439 1107 HA SER 151 HA SER 151 1.943 -9.468 1.232 1108 HB2 SER 151 2HB SER 151 3.524 -11.384 0.769 1109 HB3 SER 151 1HB SER 151 2.299 -11.165 -0.477 1110 HG SER 151 HG SER 151 3.960 -11.138 -1.772 1111 HA PRO 152 HA PRO 152 4.932 -7.206 3.457 1112 HB2 PRO 152 2HB PRO 152 5.261 -8.663 5.779 1113 HB3 PRO 152 1HB PRO 152 3.776 -7.790 5.366 1114 HG2 PRO 152 2HG PRO 152 4.326 -10.702 5.261 1115 HG3 PRO 152 1HG PRO 152 2.803 -9.848 5.570 1116 HD2 PRO 152 2HD PRO 152 3.557 -11.039 3.131 1117 HD3 PRO 152 1HD PRO 152 2.229 -9.883 3.361 1118 H PHE 153 H PHE 153 7.001 -6.919 2.685 1119 HA PHE 153 HA PHE 153 9.124 -8.384 2.214 1120 HB2 PHE 153 2HB PHE 153 9.293 -5.948 4.035 1121 HB3 PHE 153 1HB PHE 153 10.559 -6.549 2.980 1122 HD1 PHE 153 HD1 PHE 153 7.240 -4.830 3.033 1123 HD2 PHE 153 HD2 PHE 153 10.708 -5.790 0.717 1124 HE1 PHE 153 HE1 PHE 153 6.579 -3.163 1.343 1125 HE2 PHE 153 HE2 PHE 153 10.033 -4.136 -0.967 1126 HZ PHE 153 HZ PHE 153 7.974 -2.818 -0.662 1127 H CYS 154 H CYS 154 8.447 -7.223 5.509 1128 HA CYS 154 HA CYS 154 10.694 -8.297 6.772 1129 HB2 CYS 154 2HB CYS 154 9.324 -7.782 8.890 1130 HB3 CYS 154 1HB CYS 154 9.598 -6.447 7.778 1131 HG CYS 154 HG CYS 154 7.137 -5.779 7.871 1132 H ALA 155 H ALA 155 7.538 -9.747 6.198 1133 HA ALA 155 HA ALA 155 7.845 -11.936 8.036 1134 HB1 ALA 155 3HB ALA 155 5.807 -12.814 7.009 1135 HB2 ALA 155 1HB ALA 155 5.932 -11.619 5.712 1136 HB3 ALA 155 2HB ALA 155 5.643 -11.095 7.371 1137 H TYR 156 H TYR 156 8.791 -11.418 4.692 1138 HA TYR 156 HA TYR 156 9.333 -14.264 4.214 1139 HB2 TYR 156 2HB TYR 156 9.623 -11.773 2.493 1140 HB3 TYR 156 1HB TYR 156 10.227 -13.342 1.986 1141 HD1 TYR 156 HD2 TYR 156 8.542 -15.293 1.841 1142 HD2 TYR 156 HD1 TYR 156 7.340 -11.212 2.065 1143 HE1 TYR 156 HE2 TYR 156 6.359 -15.898 0.898 1144 HE2 TYR 156 HE1 TYR 156 5.155 -11.811 1.136 1145 HH TYR 156 HH TYR 156 4.157 -13.613 -0.266 1146 H SER 157 H SER 157 11.036 -11.218 4.746 1147 HA SER 157 HA SER 157 13.532 -12.650 5.354 1148 HB2 SER 157 2HB SER 157 13.370 -10.164 3.582 1149 HB3 SER 157 1HB SER 157 14.845 -10.994 4.086 1150 HG SER 157 HG SER 157 12.776 -12.039 2.453 1151 H ASP 158 H ASP 158 13.983 -12.127 7.386 1152 HA ASP 158 HA ASP 158 12.627 -10.026 8.798 1153 HB2 ASP 158 2HB ASP 158 13.136 -12.258 9.782 1154 HB3 ASP 158 1HB ASP 158 14.853 -11.886 9.729 1155 H THR 159 H THR 159 15.512 -10.115 7.004 1156 HA THR 159 HA THR 159 17.141 -8.199 8.280 1157 HB THR 159 HB THR 159 17.979 -9.607 6.429 1158 HG1 THR 159 HG1 THR 159 18.121 -6.800 5.877 1159 HG21 THR 159 3HG2 THR 159 15.980 -9.603 4.968 1160 HG22 THR 159 1HG2 THR 159 17.430 -9.125 4.081 1161 HG23 THR 159 2HG2 THR 159 16.263 -7.903 4.587 1162 H PHE 160 H PHE 160 14.107 -7.862 6.694 1163 HA PHE 160 HA PHE 160 14.356 -5.031 6.086 1164 HB2 PHE 160 2HB PHE 160 12.095 -7.055 5.850 1165 HB3 PHE 160 1HB PHE 160 11.818 -5.332 5.613 1166 HD1 PHE 160 HD2 PHE 160 13.656 -8.280 4.273 1167 HD2 PHE 160 HD1 PHE 160 12.455 -4.239 3.560 1168 HE1 PHE 160 HE2 PHE 160 14.404 -8.458 1.941 1169 HE2 PHE 160 HE1 PHE 160 13.209 -4.425 1.226 1170 HZ PHE 160 HZ PHE 160 14.189 -6.536 0.416 1171 H SER 161 H SER 161 12.308 -3.745 6.951 1172 HA SER 161 HA SER 161 12.689 -3.783 9.880 1173 HB2 SER 161 2HB SER 161 13.470 -1.746 8.735 1174 HB3 SER 161 1HB SER 161 11.871 -1.494 8.045 1175 HG SER 161 HG SER 161 11.153 -0.782 9.914 1176 H CYS 162 H CYS 162 10.979 -3.705 11.266 1177 HA CYS 162 HA CYS 162 8.293 -4.313 10.244 1178 HB2 CYS 162 2HB CYS 162 7.733 -4.684 12.651 1179 HB3 CYS 162 1HB CYS 162 9.095 -5.673 12.128 1180 HG CYS 162 HG CYS 162 9.185 -2.890 14.096 1181 HA PRO 163 HA PRO 163 7.875 0.274 10.259 1182 HB2 PRO 163 2HB PRO 163 5.116 -0.442 9.271 1183 HB3 PRO 163 1HB PRO 163 6.318 0.666 8.571 1184 HG2 PRO 163 2HG PRO 163 5.892 -1.676 7.439 1185 HG3 PRO 163 1HG PRO 163 7.557 -1.065 7.605 1186 HD2 PRO 163 2HD PRO 163 6.120 -3.105 9.315 1187 HD3 PRO 163 1HD PRO 163 7.759 -3.168 8.624 1188 H LEU 164 H LEU 164 6.214 1.835 11.137 1189 HA LEU 164 HA LEU 164 4.933 0.782 13.590 1190 HB2 LEU 164 2HB LEU 164 6.895 2.265 14.063 1191 HB3 LEU 164 1HB LEU 164 6.139 3.550 13.134 1192 HG LEU 164 HG LEU 164 4.272 3.644 14.787 1193 HD11 LEU 164 1HD1 LEU 164 4.261 1.342 15.560 1194 HD12 LEU 164 2HD1 LEU 164 4.433 2.440 16.925 1195 HD13 LEU 164 3HD1 LEU 164 5.839 1.556 16.326 1196 HD21 LEU 164 3HD2 LEU 164 5.527 4.677 16.635 1197 HD22 LEU 164 1HD2 LEU 164 6.186 5.148 15.068 1198 HD23 LEU 164 2HD2 LEU 164 7.020 3.939 16.048 1199 HA PRO 165 HA PRO 165 1.591 2.544 10.958 1200 HB2 PRO 165 2HB PRO 165 -0.190 0.514 11.156 1201 HB3 PRO 165 1HB PRO 165 1.224 0.406 10.090 1202 HG2 PRO 165 2HG PRO 165 0.754 -0.892 12.726 1203 HG3 PRO 165 1HG PRO 165 1.655 -1.488 11.317 1204 HD2 PRO 165 2HD PRO 165 2.772 -0.274 13.625 1205 HD3 PRO 165 1HD PRO 165 3.613 -0.608 12.099 1206 HA PRO 166 HA PRO 166 -0.367 4.358 14.686 1207 HB2 PRO 166 2HB PRO 166 -2.283 5.842 13.278 1208 HB3 PRO 166 1HB PRO 166 -0.610 6.374 13.541 1209 HG2 PRO 166 2HG PRO 166 -1.788 5.014 11.137 1210 HG3 PRO 166 1HG PRO 166 -0.694 6.418 11.212 1211 HD2 PRO 166 2HD PRO 166 0.279 4.003 10.637 1212 HD3 PRO 166 1HD PRO 166 1.187 5.092 11.710 1213 H GLU 167 H GLU 167 -2.128 3.681 15.922 1214 HA GLU 167 HA GLU 167 -3.352 1.240 15.322 1215 HB2 GLU 167 2HB GLU 167 -4.226 3.288 17.398 1216 HB3 GLU 167 1HB GLU 167 -4.665 1.578 17.391 1217 HG2 GLU 167 2HG GLU 167 -2.274 0.975 17.653 1218 HG3 GLU 167 1HG GLU 167 -1.861 2.688 17.689 1219 H SER 168 H SER 168 -4.387 4.370 14.376 1220 HA SER 168 HA SER 168 -7.185 3.898 14.013 1221 HB2 SER 168 2HB SER 168 -6.258 6.157 14.325 1222 HB3 SER 168 1HB SER 168 -5.331 6.007 12.833 1223 HG SER 168 HG SER 168 -7.871 6.807 13.172 1224 H ASN 169 H ASN 169 -4.486 2.758 12.255 1225 HA ASN 169 HA ASN 169 -5.893 2.662 9.663 1226 HB2 ASN 169 2HB ASN 169 -3.839 2.324 8.594 1227 HB3 ASN 169 1HB ASN 169 -3.374 3.372 9.921 1228 HD21 ASN 169 1HD2 ASN 169 -1.825 1.428 8.325 1229 HD22 ASN 169 2HD2 ASN 169 -1.085 0.373 9.468 1230 H TRP 170 H TRP 170 -5.703 0.871 12.414 1231 HA TRP 170 HA TRP 170 -5.396 -1.791 11.392 1232 HB2 TRP 170 2HB TRP 170 -6.462 -0.722 14.036 1233 HB3 TRP 170 1HB TRP 170 -6.340 -2.442 13.675 1234 HD1 TRP 170 HD1 TRP 170 -3.304 -1.397 12.159 1235 HE1 TRP 170 HE1 TRP 170 -1.309 -1.470 13.771 1236 HE3 TRP 170 HE3 TRP 170 -5.842 -1.584 16.608 1237 HZ2 TRP 170 HZ2 TRP 170 -0.852 -1.610 16.549 1238 HZ3 TRP 170 HZ3 TRP 170 -4.543 -1.692 18.700 1239 HH2 TRP 170 HH2 TRP 170 -2.099 -1.704 18.669 1240 H LEU 171 H LEU 171 -6.867 -2.697 10.101 1241 HA LEU 171 HA LEU 171 -9.661 -1.843 10.098 1242 HB2 LEU 171 2HB LEU 171 -8.394 -4.043 8.410 1243 HB3 LEU 171 1HB LEU 171 -9.890 -3.177 8.099 1244 HG LEU 171 HG LEU 171 -7.057 -2.098 7.819 1245 HD11 LEU 171 1HD1 LEU 171 -7.598 -1.863 5.447 1246 HD12 LEU 171 2HD1 LEU 171 -9.206 -2.533 5.729 1247 HD13 LEU 171 3HD1 LEU 171 -7.778 -3.536 5.976 1248 HD21 LEU 171 3HD2 LEU 171 -8.432 -0.305 8.720 1249 HD22 LEU 171 1HD2 LEU 171 -9.649 -0.565 7.467 1250 HD23 LEU 171 2HD2 LEU 171 -8.041 0.019 7.035 1251 H GLU 172 H GLU 172 -10.957 -2.784 11.649 1252 HA GLU 172 HA GLU 172 -10.154 -5.298 12.889 1253 HB2 GLU 172 2HB GLU 172 -11.154 -3.086 14.014 1254 HB3 GLU 172 1HB GLU 172 -12.695 -3.820 13.625 1255 HG2 GLU 172 2HG GLU 172 -10.532 -5.041 15.371 1256 HG3 GLU 172 1HG GLU 172 -11.998 -4.262 15.947 1257 H THR 173 H THR 173 -10.480 -6.047 10.561 1258 HA THR 173 HA THR 173 -12.677 -7.837 10.398 1259 HB THR 173 HB THR 173 -13.817 -5.792 9.513 1260 HG1 THR 173 HG1 THR 173 -14.767 -7.303 8.410 1261 HG21 THR 173 3HG2 THR 173 -11.728 -5.822 7.295 1262 HG22 THR 173 1HG2 THR 173 -11.839 -4.608 8.573 1263 HG23 THR 173 2HG2 THR 173 -13.135 -4.762 7.387 1264 H ALA 174 H ALA 174 -12.384 -9.247 8.437 1265 HA ALA 174 HA ALA 174 -9.500 -9.576 7.837 1266 HB1 ALA 174 3HB ALA 174 -10.612 -11.524 8.851 1267 HB2 ALA 174 1HB ALA 174 -10.097 -11.890 7.203 1268 HB3 ALA 174 2HB ALA 174 -11.797 -11.554 7.545 1269 H VAL 175 H VAL 175 -8.773 -9.326 5.769 1270 HA VAL 175 HA VAL 175 -10.686 -8.381 3.730 1271 HB VAL 175 HB VAL 175 -7.636 -8.135 3.784 1272 HG11 VAL 175 1HG1 VAL 175 -9.618 -6.942 1.800 1273 HG12 VAL 175 2HG1 VAL 175 -8.477 -8.246 1.468 1274 HG13 VAL 175 3HG1 VAL 175 -7.879 -6.629 1.835 1275 HG21 VAL 175 3HG2 VAL 175 -8.686 -6.717 5.494 1276 HG22 VAL 175 1HG2 VAL 175 -9.771 -6.018 4.288 1277 HG23 VAL 175 2HG2 VAL 175 -8.034 -5.715 4.196 1278 H THR 176 H THR 176 -11.521 -10.388 3.181 1279 HA THR 176 HA THR 176 -9.872 -12.547 2.206 1280 HB THR 176 HB THR 176 -12.137 -13.559 1.613 1281 HG1 THR 176 HG1 THR 176 -13.078 -11.274 1.505 1282 HG21 THR 176 3HG2 THR 176 -11.844 -12.545 4.470 1283 HG22 THR 176 1HG2 THR 176 -11.124 -14.020 3.817 1284 HG23 THR 176 2HG2 THR 176 -12.878 -13.881 3.959 1285 H ALA 177 H ALA 177 -8.693 -11.463 0.586 1286 HA ALA 177 HA ALA 177 -9.955 -11.254 -2.021 1287 HB1 ALA 177 3HB ALA 177 -10.393 -8.994 -1.119 1288 HB2 ALA 177 1HB ALA 177 -9.244 -8.930 -2.457 1289 HB3 ALA 177 2HB ALA 177 -8.674 -8.781 -0.791 1290 H GLY 178 H GLY 178 -8.443 -11.034 -3.711 1291 HA2 GLY 178 2HA GLY 178 -6.618 -11.681 -4.868 1292 HA3 GLY 178 1HA GLY 178 -5.726 -10.846 -3.618 1293 H GLU 179 H GLU 179 -3.995 -12.227 -3.761 1294 HA GLU 179 HA GLU 179 -4.304 -15.104 -3.558 1295 HB2 GLU 179 2HB GLU 179 -1.787 -13.390 -3.762 1296 HB3 GLU 179 1HB GLU 179 -1.850 -15.144 -3.919 1297 HG2 GLU 179 2HG GLU 179 -3.128 -13.127 -5.790 1298 HG3 GLU 179 1HG GLU 179 -1.680 -14.077 -6.113 1299 H ARG 180 H ARG 180 -3.929 -16.314 -1.778 1300 HA ARG 180 HA ARG 180 -3.053 -14.963 0.720 1301 HB2 ARG 180 2HB ARG 180 -4.613 -16.549 1.913 1302 HB3 ARG 180 1HB ARG 180 -5.441 -15.407 0.860 1303 HG2 ARG 180 2HG ARG 180 -5.649 -17.180 -0.879 1304 HG3 ARG 180 1HG ARG 180 -4.874 -18.324 0.217 1305 HD2 ARG 180 2HD ARG 180 -6.744 -18.106 1.794 1306 HD3 ARG 180 1HD ARG 180 -7.502 -16.896 0.749 1307 HE ARG 180 HE ARG 180 -6.974 -19.558 -0.376 1308 HH11 ARG 180 1HH1 ARG 180 -9.381 -17.301 0.857 1309 HH12 ARG 180 2HH1 ARG 180 -10.717 -18.181 0.186 1310 HH21 ARG 180 1HH2 ARG 180 -8.728 -20.689 -1.251 1311 HH22 ARG 180 2HH2 ARG 180 -10.345 -20.104 -1.014 1312 H THR 181 H THR 181 -1.043 -15.801 1.278 1313 HA THR 181 HA THR 181 -0.486 -18.619 1.078 1314 HB THR 181 HB THR 181 1.588 -17.865 2.425 1315 HG1 THR 181 HG1 THR 181 1.886 -15.550 2.422 1316 HG21 THR 181 3HG2 THR 181 1.047 -16.476 -0.228 1317 HG22 THR 181 1HG2 THR 181 1.671 -18.115 -0.026 1318 HG23 THR 181 2HG2 THR 181 2.636 -16.734 0.497 1319 H ASP 182 H ASP 182 0.590 -19.489 3.174 1320 HA ASP 182 HA ASP 182 0.278 -20.637 5.095 1321 HB2 ASP 182 2HB ASP 182 0.849 -18.342 5.914 1322 HB3 ASP 182 1HB ASP 182 -0.865 -17.989 6.065 1323 H LEU 183 H LEU 183 -2.319 -20.133 3.282 1324 HA LEU 183 HA LEU 183 -4.593 -20.358 4.892 1325 HB2 LEU 183 2HB LEU 183 -5.809 -20.965 2.904 1326 HB3 LEU 183 1HB LEU 183 -4.649 -19.718 2.500 1327 HG LEU 183 HG LEU 183 -4.169 -22.663 1.888 1328 HD11 LEU 183 1HD1 LEU 183 -5.329 -20.569 0.026 1329 HD12 LEU 183 2HD1 LEU 183 -6.195 -21.943 0.719 1330 HD13 LEU 183 3HD1 LEU 183 -4.873 -22.220 -0.412 1331 HD21 LEU 183 3HD2 LEU 183 -2.508 -21.843 0.278 1332 HD22 LEU 183 1HD2 LEU 183 -2.124 -21.296 1.909 1333 HD23 LEU 183 2HD2 LEU 183 -2.844 -20.175 0.750 1334 H GLU 184 H GLU 184 -2.482 -22.811 3.503 1335 HA GLU 184 HA GLU 184 -3.621 -24.855 5.321 1336 HB2 GLU 184 2HB GLU 184 -2.438 -25.341 2.538 1337 HB3 GLU 184 1HB GLU 184 -3.016 -26.584 3.646 1338 HG2 GLU 184 2HG GLU 184 -5.312 -25.706 3.454 1339 HG3 GLU 184 1HG GLU 184 -4.740 -24.437 2.374 1340 H HIS 185 H HIS 185 -2.087 -24.118 6.873 1341 HA HIS 185 HA HIS 185 0.741 -24.152 6.380 1342 HB2 HIS 185 2HB HIS 185 -0.313 -22.732 8.151 1343 HB3 HIS 185 1HB HIS 185 -0.744 -24.184 9.051 1344 HD1 HIS 185 HD1 HIS 185 2.061 -21.871 8.356 1345 HD2 HIS 185 HD2 HIS 185 1.529 -25.531 10.255 1346 HE1 HIS 185 HE1 HIS 185 4.123 -22.217 9.740 1347 HE2 HIS 185 HE2 HIS 185 3.674 -24.316 11.045 Start of MODEL 18 1 H1 MET 1 1H MET 1 -17.135 -3.110 -15.261 2 H2 MET 1 2H MET 1 -15.779 -3.458 -14.313 3 H3 MET 1 3H MET 1 -15.952 -4.164 -15.838 4 HA MET 1 HA MET 1 -15.652 -1.264 -15.330 5 HB2 MET 1 2HB MET 1 -13.349 -1.474 -16.124 6 HB3 MET 1 1HB MET 1 -13.581 -2.592 -14.792 7 HG2 MET 1 2HG MET 1 -13.843 -4.444 -16.464 8 HG3 MET 1 1HG MET 1 -13.455 -3.290 -17.738 9 HE1 MET 1 3HE MET 1 -12.129 -5.630 -14.976 10 HE2 MET 1 1HE MET 1 -11.987 -4.101 -14.104 11 HE3 MET 1 2HE MET 1 -10.538 -4.972 -14.602 12 H ASP 2 H ASP 2 -16.237 -0.035 -17.092 13 HA ASP 2 HA ASP 2 -16.840 -1.448 -19.635 14 HB2 ASP 2 2HB ASP 2 -18.755 -0.352 -18.522 15 HB3 ASP 2 1HB ASP 2 -17.881 1.179 -18.517 16 H GLU 3 H GLU 3 -16.347 2.012 -19.156 17 HA GLU 3 HA GLU 3 -13.889 1.947 -20.819 18 HB2 GLU 3 2HB GLU 3 -16.076 4.068 -20.803 19 HB3 GLU 3 1HB GLU 3 -14.523 4.252 -21.624 20 HG2 GLU 3 2HG GLU 3 -15.056 2.231 -22.991 21 HG3 GLU 3 1HG GLU 3 -16.645 2.166 -22.230 22 H ASP 4 H ASP 4 -15.624 4.093 -18.594 23 HA ASP 4 HA ASP 4 -13.553 5.766 -17.830 24 HB2 ASP 4 2HB ASP 4 -15.898 6.287 -17.384 25 HB3 ASP 4 1HB ASP 4 -16.059 4.893 -16.324 26 H THR 5 H THR 5 -14.518 2.675 -16.489 27 HA THR 5 HA THR 5 -12.735 2.990 -14.171 28 HB THR 5 HB THR 5 -14.891 0.862 -14.468 29 HG1 THR 5 HG1 THR 5 -15.206 3.600 -13.685 30 HG21 THR 5 3HG2 THR 5 -13.771 2.332 -12.058 31 HG22 THR 5 1HG2 THR 5 -13.370 0.677 -12.525 32 HG23 THR 5 2HG2 THR 5 -15.013 1.078 -12.017 33 H GLU 6 H GLU 6 -12.579 1.573 -17.215 34 HA GLU 6 HA GLU 6 -11.164 -0.855 -16.430 35 HB2 GLU 6 2HB GLU 6 -11.068 -1.424 -18.702 36 HB3 GLU 6 1HB GLU 6 -12.575 -0.513 -18.599 37 HG2 GLU 6 2HG GLU 6 -11.398 1.485 -19.488 38 HG3 GLU 6 1HG GLU 6 -9.915 0.547 -19.623 39 H ASP 7 H ASP 7 -10.408 2.427 -17.255 40 HA ASP 7 HA ASP 7 -7.673 2.351 -17.826 41 HB2 ASP 7 2HB ASP 7 -9.195 4.510 -16.297 42 HB3 ASP 7 1HB ASP 7 -7.583 4.711 -16.981 43 H TRP 8 H TRP 8 -9.329 2.326 -14.727 44 HA TRP 8 HA TRP 8 -7.427 2.412 -12.800 45 HB2 TRP 8 2HB TRP 8 -9.647 2.157 -12.062 46 HB3 TRP 8 1HB TRP 8 -9.967 0.810 -13.138 47 HD1 TRP 8 HD1 TRP 8 -8.169 1.534 -9.769 48 HE1 TRP 8 HE1 TRP 8 -8.228 -0.641 -8.383 49 HE3 TRP 8 HE3 TRP 8 -10.204 -1.587 -13.256 50 HZ2 TRP 8 HZ2 TRP 8 -9.032 -3.312 -8.740 51 HZ3 TRP 8 HZ3 TRP 8 -10.589 -3.938 -12.648 52 HH2 TRP 8 HH2 TRP 8 -10.013 -4.780 -10.439 53 H GLU 9 H GLU 9 -8.205 -0.490 -14.761 54 HA GLU 9 HA GLU 9 -6.205 -2.156 -13.544 55 HB2 GLU 9 2HB GLU 9 -8.320 -3.037 -14.618 56 HB3 GLU 9 1HB GLU 9 -7.649 -2.617 -16.193 57 HG2 GLU 9 2HG GLU 9 -5.679 -4.141 -15.629 58 HG3 GLU 9 1HG GLU 9 -6.595 -4.673 -14.221 59 H THR 10 H THR 10 -6.263 0.067 -16.255 60 HA THR 10 HA THR 10 -4.029 -0.909 -17.717 61 HB THR 10 HB THR 10 -5.125 1.935 -17.638 62 HG1 THR 10 HG1 THR 10 -6.563 1.265 -19.181 63 HG21 THR 10 3HG2 THR 10 -4.225 2.117 -19.936 64 HG22 THR 10 1HG2 THR 10 -3.560 0.487 -19.821 65 HG23 THR 10 2HG2 THR 10 -2.929 1.775 -18.789 66 H GLN 11 H GLN 11 -4.302 1.921 -15.470 67 HA GLN 11 HA GLN 11 -1.546 2.414 -15.282 68 HB2 GLN 11 2HB GLN 11 -2.039 3.840 -13.394 69 HB3 GLN 11 1HB GLN 11 -3.325 4.027 -14.580 70 HG2 GLN 11 2HG GLN 11 -4.791 2.572 -13.225 71 HG3 GLN 11 1HG GLN 11 -3.498 2.370 -12.041 72 HE21 GLN 11 1HE2 GLN 11 -5.929 4.528 -13.291 73 HE22 GLN 11 2HE2 GLN 11 -5.803 5.719 -12.045 74 H LEU 12 H LEU 12 -3.677 0.234 -13.478 75 HA LEU 12 HA LEU 12 -2.007 -0.427 -11.315 76 HB2 LEU 12 2HB LEU 12 -4.340 -0.966 -11.210 77 HB3 LEU 12 1HB LEU 12 -4.261 -1.901 -12.695 78 HG LEU 12 HG LEU 12 -2.809 -3.593 -11.483 79 HD11 LEU 12 1HD1 LEU 12 -1.935 -2.190 -9.700 80 HD12 LEU 12 2HD1 LEU 12 -2.757 -3.598 -9.035 81 HD13 LEU 12 3HD1 LEU 12 -3.550 -2.021 -9.003 82 HD21 LEU 12 3HD2 LEU 12 -5.177 -4.000 -11.859 83 HD22 LEU 12 1HD2 LEU 12 -5.583 -3.162 -10.357 84 HD23 LEU 12 2HD2 LEU 12 -4.661 -4.668 -10.311 85 H GLN 13 H GLN 13 -2.465 -2.070 -14.462 86 HA GLN 13 HA GLN 13 -0.912 -4.341 -13.850 87 HB2 GLN 13 2HB GLN 13 -1.098 -4.932 -16.189 88 HB3 GLN 13 1HB GLN 13 -2.631 -4.255 -15.656 89 HG2 GLN 13 2HG GLN 13 -2.012 -2.096 -16.717 90 HG3 GLN 13 1HG GLN 13 -0.529 -2.833 -17.318 91 HE21 GLN 13 1HE2 GLN 13 -3.727 -4.382 -17.207 92 HE22 GLN 13 2HE2 GLN 13 -3.920 -4.469 -18.919 93 H ALA 14 H ALA 14 -0.105 -1.188 -15.161 94 HA ALA 14 HA ALA 14 2.638 -1.766 -15.793 95 HB1 ALA 14 3HB ALA 14 1.226 0.891 -15.361 96 HB2 ALA 14 1HB ALA 14 1.400 0.046 -16.905 97 HB3 ALA 14 2HB ALA 14 2.827 0.673 -16.076 98 H ASN 15 H ASN 15 0.926 -0.241 -13.050 99 HA ASN 15 HA ASN 15 3.046 0.519 -11.399 100 HB2 ASN 15 2HB ASN 15 0.183 -0.322 -10.771 101 HB3 ASN 15 1HB ASN 15 1.288 0.130 -9.476 102 HD21 ASN 15 1HD2 ASN 15 -0.358 1.783 -9.071 103 HD22 ASN 15 2HD2 ASN 15 -0.289 3.264 -9.953 104 H ARG 16 H ARG 16 1.640 -2.671 -11.891 105 HA ARG 16 HA ARG 16 3.368 -3.818 -9.795 106 HB2 ARG 16 2HB ARG 16 2.035 -5.890 -10.011 107 HB3 ARG 16 1HB ARG 16 1.069 -4.490 -9.554 108 HG2 ARG 16 2HG ARG 16 0.253 -4.289 -11.875 109 HG3 ARG 16 1HG ARG 16 1.209 -5.702 -12.336 110 HD2 ARG 16 2HD ARG 16 -1.214 -6.195 -11.910 111 HD3 ARG 16 1HD ARG 16 -0.105 -7.136 -10.908 112 HE ARG 16 HE ARG 16 -1.011 -4.715 -9.626 113 HH11 ARG 16 1HH1 ARG 16 -1.857 -8.072 -10.231 114 HH12 ARG 16 2HH1 ARG 16 -2.884 -8.188 -8.841 115 HH21 ARG 16 1HH2 ARG 16 -2.358 -4.890 -7.785 116 HH22 ARG 16 2HH2 ARG 16 -3.169 -6.390 -7.454 117 H ASP 17 H ASP 17 3.157 -3.555 -13.268 118 HA ASP 17 HA ASP 17 4.786 -5.778 -14.000 119 HB2 ASP 17 2HB ASP 17 3.500 -4.557 -15.705 120 HB3 ASP 17 1HB ASP 17 4.383 -3.072 -15.376 121 H GLU 18 H GLU 18 5.564 -2.349 -13.541 122 HA GLU 18 HA GLU 18 8.367 -2.577 -13.610 123 HB2 GLU 18 2HB GLU 18 8.380 -0.310 -12.640 124 HB3 GLU 18 1HB GLU 18 7.232 -0.452 -13.961 125 HG2 GLU 18 2HG GLU 18 5.828 0.661 -12.551 126 HG3 GLU 18 1HG GLU 18 5.552 -0.935 -11.868 127 H LYS 19 H LYS 19 6.015 -3.099 -11.080 128 HA LYS 19 HA LYS 19 7.834 -3.221 -8.874 129 HB2 LYS 19 2HB LYS 19 5.305 -2.760 -8.782 130 HB3 LYS 19 1HB LYS 19 5.074 -4.487 -9.009 131 HG2 LYS 19 2HG LYS 19 4.878 -4.070 -6.675 132 HG3 LYS 19 1HG LYS 19 6.434 -4.863 -6.915 133 HD2 LYS 19 2HD LYS 19 6.921 -3.142 -5.384 134 HD3 LYS 19 1HD LYS 19 7.445 -2.460 -6.923 135 HE2 LYS 19 2HE LYS 19 4.763 -1.890 -5.607 136 HE3 LYS 19 1HE LYS 19 6.182 -0.864 -5.452 137 HZ1 LYS 19 3HZ LYS 19 4.666 -0.019 -7.105 138 HZ2 LYS 19 1HZ LYS 19 4.751 -1.455 -7.991 139 HZ3 LYS 19 2HZ LYS 19 6.118 -0.473 -7.832 140 H ASP 20 H ASP 20 6.642 -5.474 -11.260 141 HA ASP 20 HA ASP 20 7.392 -7.932 -9.999 142 HB2 ASP 20 2HB ASP 20 5.603 -7.900 -11.664 143 HB3 ASP 20 1HB ASP 20 6.691 -7.265 -12.892 144 H ARG 21 H ARG 21 9.082 -5.613 -12.016 145 HA ARG 21 HA ARG 21 11.489 -7.330 -12.044 146 HB2 ARG 21 2HB ARG 21 12.494 -5.535 -13.468 147 HB3 ARG 21 1HB ARG 21 11.078 -6.303 -14.171 148 HG2 ARG 21 2HG ARG 21 9.704 -4.390 -13.728 149 HG3 ARG 21 1HG ARG 21 10.954 -3.637 -12.735 150 HD2 ARG 21 2HD ARG 21 10.789 -2.599 -14.963 151 HD3 ARG 21 1HD ARG 21 12.372 -3.321 -14.692 152 HE ARG 21 HE ARG 21 11.143 -5.295 -15.998 153 HH11 ARG 21 1HH1 ARG 21 11.238 -1.858 -16.758 154 HH12 ARG 21 2HH1 ARG 21 11.106 -2.114 -18.469 155 HH21 ARG 21 1HH2 ARG 21 10.997 -5.620 -18.229 156 HH22 ARG 21 2HH2 ARG 21 10.972 -4.262 -19.305 157 H PHE 22 H PHE 22 10.085 -4.681 -10.321 158 HA PHE 22 HA PHE 22 12.229 -3.204 -9.403 159 HB2 PHE 22 2HB PHE 22 9.763 -2.773 -9.058 160 HB3 PHE 22 1HB PHE 22 9.771 -3.971 -7.776 161 HD1 PHE 22 HD1 PHE 22 10.904 -0.594 -8.778 162 HD2 PHE 22 HD2 PHE 22 10.664 -3.423 -5.580 163 HE1 PHE 22 HE1 PHE 22 11.428 1.178 -7.153 164 HE2 PHE 22 HE2 PHE 22 11.185 -1.649 -3.984 165 HZ PHE 22 HZ PHE 22 11.563 0.653 -4.754 166 H PHE 23 H PHE 23 10.846 -6.124 -7.836 167 HA PHE 23 HA PHE 23 12.689 -6.130 -5.640 168 HB2 PHE 23 2HB PHE 23 10.864 -8.333 -6.666 169 HB3 PHE 23 1HB PHE 23 11.793 -8.448 -5.188 170 HD1 PHE 23 HD2 PHE 23 10.011 -5.285 -6.082 171 HD2 PHE 23 HD1 PHE 23 9.843 -8.951 -3.874 172 HE1 PHE 23 HE2 PHE 23 8.107 -4.435 -4.776 173 HE2 PHE 23 HE1 PHE 23 7.939 -8.086 -2.588 174 HZ PHE 23 HZ PHE 23 7.092 -5.828 -3.017 175 H SER 24 H SER 24 12.991 -7.214 -8.895 176 HA SER 24 HA SER 24 14.998 -9.287 -8.209 177 HB2 SER 24 2HB SER 24 13.404 -8.895 -10.775 178 HB3 SER 24 1HB SER 24 14.557 -10.201 -10.468 179 HG SER 24 HG SER 24 12.444 -10.877 -10.037 180 H GLU 25 H GLU 25 14.705 -6.144 -9.766 181 HA GLU 25 HA GLU 25 17.329 -6.486 -11.100 182 HB2 GLU 25 2HB GLU 25 14.933 -4.927 -12.180 183 HB3 GLU 25 1HB GLU 25 16.508 -5.076 -12.955 184 HG2 GLU 25 2HG GLU 25 14.504 -7.306 -12.505 185 HG3 GLU 25 1HG GLU 25 14.835 -6.499 -14.037 186 H HIS 26 H HIS 26 14.899 -4.094 -9.998 187 HA HIS 26 HA HIS 26 16.675 -1.854 -9.951 188 HB2 HIS 26 2HB HIS 26 14.255 -1.526 -10.173 189 HB3 HIS 26 1HB HIS 26 13.955 -2.304 -8.622 190 HD2 HIS 26 HD2 HIS 26 15.024 1.172 -10.057 191 HE1 HIS 26 HE1 HIS 26 14.588 1.471 -5.856 192 HE2 HIS 26 HE2 HIS 26 14.688 2.764 -8.035 193 H ARG 27 H ARG 27 15.458 -4.065 -7.519 194 HA ARG 27 HA ARG 27 17.599 -3.351 -5.628 195 HB2 ARG 27 2HB ARG 27 14.622 -3.636 -5.037 196 HB3 ARG 27 1HB ARG 27 15.837 -3.819 -3.775 197 HG2 ARG 27 2HG ARG 27 15.327 -1.333 -5.437 198 HG3 ARG 27 1HG ARG 27 14.914 -1.566 -3.738 199 HD2 ARG 27 2HD ARG 27 17.321 -1.786 -3.200 200 HD3 ARG 27 1HD ARG 27 17.717 -1.529 -4.902 201 HE ARG 27 HE ARG 27 16.260 0.547 -3.392 202 HH11 ARG 27 1HH1 ARG 27 19.157 -0.459 -5.115 203 HH12 ARG 27 2HH1 ARG 27 19.823 1.142 -5.174 204 HH21 ARG 27 1HH2 ARG 27 17.192 2.628 -3.415 205 HH22 ARG 27 2HH2 ARG 27 18.713 2.881 -4.214 206 H GLN 28 H GLN 28 18.300 -5.030 -4.336 207 HA GLN 28 HA GLN 28 18.288 -7.683 -5.193 208 HB2 GLN 28 2HB GLN 28 19.251 -8.276 -3.008 209 HB3 GLN 28 1HB GLN 28 19.983 -6.795 -3.602 210 HG2 GLN 28 2HG GLN 28 17.776 -6.872 -1.520 211 HG3 GLN 28 1HG GLN 28 19.492 -6.819 -1.130 212 HE21 GLN 28 1HE2 GLN 28 17.352 -4.892 -0.484 213 HE22 GLN 28 2HE2 GLN 28 17.899 -3.374 -1.107 214 H SER 29 H SER 29 17.105 -9.487 -4.624 215 HA SER 29 HA SER 29 14.359 -9.179 -4.193 216 HB2 SER 29 2HB SER 29 15.998 -11.736 -3.939 217 HB3 SER 29 1HB SER 29 14.241 -11.656 -4.133 218 HG SER 29 HG SER 29 15.213 -10.193 -6.070 219 HA PRO 30 HA PRO 30 14.307 -9.107 0.379 220 HB2 PRO 30 2HB PRO 30 11.661 -8.571 0.659 221 HB3 PRO 30 1HB PRO 30 12.787 -7.318 0.092 222 HG2 PRO 30 2HG PRO 30 10.983 -9.080 -1.548 223 HG3 PRO 30 1HG PRO 30 11.203 -7.314 -1.624 224 HD2 PRO 30 2HD PRO 30 12.489 -8.970 -3.337 225 HD3 PRO 30 1HD PRO 30 13.245 -7.470 -2.748 226 H ILE 31 H ILE 31 12.250 -10.941 -1.818 227 HA ILE 31 HA ILE 31 11.673 -13.099 -0.008 228 HB ILE 31 HB ILE 31 11.678 -13.226 -3.067 229 HG12 ILE 31 2HG1 ILE 31 10.360 -11.219 -2.381 230 HG13 ILE 31 1HG1 ILE 31 9.336 -12.451 -3.103 231 HG21 ILE 31 1HG2 ILE 31 10.023 -14.743 -1.014 232 HG22 ILE 31 2HG2 ILE 31 11.390 -15.387 -1.929 233 HG23 ILE 31 3HG2 ILE 31 9.906 -14.923 -2.766 234 HD11 ILE 31 3HD1 ILE 31 9.580 -11.805 -0.166 235 HD12 ILE 31 1HD1 ILE 31 8.584 -13.100 -0.840 236 HD13 ILE 31 2HD1 ILE 31 8.236 -11.420 -1.238 237 HA PRO 32 HA PRO 32 16.173 -13.982 -0.438 238 HB2 PRO 32 2HB PRO 32 16.415 -15.786 1.623 239 HB3 PRO 32 1HB PRO 32 16.224 -14.044 1.919 240 HG2 PRO 32 2HG PRO 32 14.120 -16.196 1.965 241 HG3 PRO 32 1HG PRO 32 14.429 -14.907 3.155 242 HD2 PRO 32 2HD PRO 32 12.488 -14.656 1.297 243 HD3 PRO 32 1HD PRO 32 13.443 -13.254 1.830 244 HA PRO 33 HA PRO 33 16.686 -17.626 -3.035 245 HB2 PRO 33 2HB PRO 33 18.600 -18.724 -0.962 246 HB3 PRO 33 1HB PRO 33 18.798 -18.574 -2.722 247 HG2 PRO 33 2HG PRO 33 19.971 -16.860 -1.045 248 HG3 PRO 33 1HG PRO 33 19.347 -16.330 -2.624 249 HD2 PRO 33 2HD PRO 33 18.267 -15.810 0.105 250 HD3 PRO 33 1HD PRO 33 18.091 -14.850 -1.379 251 H GLU 34 H GLU 34 16.244 -18.162 0.401 252 HA GLU 34 HA GLU 34 15.620 -20.939 0.322 253 HB2 GLU 34 2HB GLU 34 14.712 -19.015 2.492 254 HB3 GLU 34 1HB GLU 34 15.124 -20.720 2.648 255 HG2 GLU 34 2HG GLU 34 17.017 -18.387 2.226 256 HG3 GLU 34 1HG GLU 34 16.872 -19.395 3.665 257 H GLU 35 H GLU 35 13.552 -18.034 0.822 258 HA GLU 35 HA GLU 35 11.086 -19.344 0.615 259 HB2 GLU 35 2HB GLU 35 11.842 -16.432 0.167 260 HB3 GLU 35 1HB GLU 35 10.175 -17.003 0.220 261 HG2 GLU 35 2HG GLU 35 12.179 -17.225 2.486 262 HG3 GLU 35 1HG GLU 35 10.920 -15.999 2.352 263 H ARG 36 H ARG 36 12.911 -17.493 -1.918 264 HA ARG 36 HA ARG 36 10.800 -17.696 -3.821 265 HB2 ARG 36 2HB ARG 36 12.290 -16.596 -5.375 266 HB3 ARG 36 1HB ARG 36 12.397 -15.808 -3.805 267 HG2 ARG 36 2HG ARG 36 14.550 -16.840 -3.369 268 HG3 ARG 36 1HG ARG 36 14.424 -17.826 -4.829 269 HD2 ARG 36 2HD ARG 36 14.679 -14.797 -4.706 270 HD3 ARG 36 1HD ARG 36 15.913 -15.945 -5.250 271 HE ARG 36 HE ARG 36 13.447 -16.150 -6.718 272 HH11 ARG 36 1HH1 ARG 36 16.488 -14.394 -6.629 273 HH12 ARG 36 2HH1 ARG 36 16.406 -13.965 -8.309 274 HH21 ARG 36 1HH2 ARG 36 13.365 -15.611 -8.887 275 HH22 ARG 36 2HH2 ARG 36 14.635 -14.657 -9.586 276 H ASP 37 H ASP 37 12.960 -20.037 -2.808 277 HA ASP 37 HA ASP 37 13.267 -21.559 -5.204 278 HB2 ASP 37 2HB ASP 37 14.692 -21.886 -3.189 279 HB3 ASP 37 1HB ASP 37 13.291 -22.451 -2.281 280 H ASP 38 H ASP 38 10.985 -21.731 -2.438 281 HA ASP 38 HA ASP 38 9.181 -23.586 -3.747 282 HB2 ASP 38 2HB ASP 38 8.818 -21.895 -1.231 283 HB3 ASP 38 1HB ASP 38 7.671 -23.116 -1.781 284 H PHE 39 H PHE 39 9.355 -20.103 -3.295 285 HA PHE 39 HA PHE 39 6.691 -19.549 -4.242 286 HB2 PHE 39 2HB PHE 39 9.047 -17.793 -3.465 287 HB3 PHE 39 1HB PHE 39 7.660 -17.097 -4.290 288 HD1 PHE 39 HD1 PHE 39 8.733 -18.820 -1.160 289 HD2 PHE 39 HD2 PHE 39 5.605 -16.663 -3.121 290 HE1 PHE 39 HE1 PHE 39 7.577 -18.546 0.990 291 HE2 PHE 39 HE2 PHE 39 4.454 -16.400 -0.965 292 HZ PHE 39 HZ PHE 39 5.439 -17.331 1.089 293 H ASP 40 H ASP 40 6.089 -18.827 -6.185 294 HA ASP 40 HA ASP 40 7.797 -19.205 -8.508 295 HB2 ASP 40 2HB ASP 40 5.394 -19.998 -8.451 296 HB3 ASP 40 1HB ASP 40 4.866 -18.330 -8.302 297 H GLY 41 H GLY 41 7.808 -17.411 -10.200 298 HA2 GLY 41 2HA GLY 41 8.908 -15.003 -9.482 299 HA3 GLY 41 1HA GLY 41 7.985 -15.238 -10.953 300 H LEU 42 H LEU 42 8.194 -12.895 -9.232 301 HA LEU 42 HA LEU 42 6.695 -12.591 -7.059 302 HB2 LEU 42 2HB LEU 42 7.003 -10.466 -9.193 303 HB3 LEU 42 1HB LEU 42 6.534 -10.144 -7.529 304 HG LEU 42 HG LEU 42 9.212 -11.336 -8.368 305 HD11 LEU 42 1HD1 LEU 42 10.158 -9.159 -7.859 306 HD12 LEU 42 2HD1 LEU 42 8.557 -8.513 -7.485 307 HD13 LEU 42 3HD1 LEU 42 8.949 -9.024 -9.129 308 HD21 LEU 42 3HD2 LEU 42 8.562 -12.042 -6.104 309 HD22 LEU 42 1HD2 LEU 42 8.261 -10.363 -5.644 310 HD23 LEU 42 2HD2 LEU 42 9.898 -10.897 -6.032 311 H SER 43 H SER 43 4.768 -13.555 -6.902 312 HA SER 43 HA SER 43 2.469 -12.931 -8.518 313 HB2 SER 43 2HB SER 43 2.679 -14.363 -5.830 314 HB3 SER 43 1HB SER 43 1.267 -14.356 -6.896 315 HG SER 43 HG SER 43 2.512 -15.430 -8.460 316 H TYR 44 H TYR 44 1.035 -11.360 -8.159 317 HA TYR 44 HA TYR 44 1.058 -9.826 -5.624 318 HB2 TYR 44 2HB TYR 44 0.857 -8.693 -8.455 319 HB3 TYR 44 1HB TYR 44 0.510 -7.757 -6.999 320 HD1 TYR 44 HD2 TYR 44 2.465 -7.945 -5.126 321 HD2 TYR 44 HD1 TYR 44 3.059 -8.439 -9.336 322 HE1 TYR 44 HE2 TYR 44 4.848 -7.425 -4.852 323 HE2 TYR 44 HE1 TYR 44 5.446 -7.923 -9.057 324 HH TYR 44 HH TYR 44 6.934 -6.837 -7.513 325 H PHE 45 H PHE 45 -0.923 -8.852 -5.057 326 HA PHE 45 HA PHE 45 -2.976 -10.753 -5.015 327 HB2 PHE 45 2HB PHE 45 -2.908 -7.829 -4.168 328 HB3 PHE 45 1HB PHE 45 -4.322 -8.853 -3.903 329 HD1 PHE 45 HD1 PHE 45 -0.851 -10.188 -3.546 330 HD2 PHE 45 HD2 PHE 45 -4.253 -8.570 -1.510 331 HE1 PHE 45 HE1 PHE 45 0.090 -10.917 -1.408 332 HE2 PHE 45 HE2 PHE 45 -3.296 -9.312 0.628 333 HZ PHE 45 HZ PHE 45 -1.131 -10.484 0.683 334 H ASP 46 H ASP 46 -5.051 -10.848 -6.054 335 HA ASP 46 HA ASP 46 -4.890 -9.912 -8.790 336 HB2 ASP 46 2HB ASP 46 -5.473 -12.263 -8.360 337 HB3 ASP 46 1HB ASP 46 -6.836 -11.778 -7.359 338 HA PRO 47 HA PRO 47 -7.684 -6.437 -7.971 339 HB2 PRO 47 2HB PRO 47 -8.320 -5.816 -10.586 340 HB3 PRO 47 1HB PRO 47 -6.764 -5.403 -9.839 341 HG2 PRO 47 2HG PRO 47 -7.439 -7.735 -11.614 342 HG3 PRO 47 1HG PRO 47 -6.037 -6.637 -11.688 343 HD2 PRO 47 2HD PRO 47 -5.842 -9.076 -10.553 344 HD3 PRO 47 1HD PRO 47 -4.952 -7.682 -9.898 345 H ASP 48 H ASP 48 -9.483 -7.331 -6.968 346 HA ASP 48 HA ASP 48 -11.772 -7.967 -8.727 347 HB2 ASP 48 2HB ASP 48 -11.131 -8.865 -5.922 348 HB3 ASP 48 1HB ASP 48 -12.822 -8.543 -6.281 349 HA PRO 49 HA PRO 49 -12.552 -3.548 -7.726 350 HB2 PRO 49 2HB PRO 49 -14.506 -3.221 -9.667 351 HB3 PRO 49 1HB PRO 49 -12.761 -3.149 -10.001 352 HG2 PRO 49 2HG PRO 49 -14.649 -5.458 -10.368 353 HG3 PRO 49 1HG PRO 49 -13.399 -4.838 -11.474 354 HD2 PRO 49 2HD PRO 49 -12.946 -7.004 -9.944 355 HD3 PRO 49 1HD PRO 49 -11.653 -5.832 -10.277 356 H ASP 50 H ASP 50 -14.608 -6.281 -7.473 357 HA ASP 50 HA ASP 50 -17.009 -5.329 -6.507 358 HB2 ASP 50 2HB ASP 50 -16.483 -7.728 -6.896 359 HB3 ASP 50 1HB ASP 50 -15.447 -7.743 -5.472 360 H TYR 51 H TYR 51 -13.923 -5.657 -4.739 361 HA TYR 51 HA TYR 51 -15.160 -4.824 -2.195 362 HB2 TYR 51 2HB TYR 51 -13.403 -6.830 -2.599 363 HB3 TYR 51 1HB TYR 51 -12.216 -5.546 -2.441 364 HD1 TYR 51 HD2 TYR 51 -12.203 -4.182 -0.213 365 HD2 TYR 51 HD1 TYR 51 -14.418 -7.793 -0.662 366 HE1 TYR 51 HE2 TYR 51 -12.364 -4.384 2.230 367 HE2 TYR 51 HE1 TYR 51 -14.588 -7.989 1.777 368 HH TYR 51 HH TYR 51 -13.362 -7.203 3.797 369 H ARG 52 H ARG 52 -14.553 -3.030 -4.593 370 HA ARG 52 HA ARG 52 -12.441 -1.246 -3.663 371 HB2 ARG 52 2HB ARG 52 -12.636 -1.901 -6.048 372 HB3 ARG 52 1HB ARG 52 -14.217 -1.132 -6.130 373 HG2 ARG 52 2HG ARG 52 -13.233 1.066 -5.818 374 HG3 ARG 52 1HG ARG 52 -11.643 0.357 -5.503 375 HD2 ARG 52 2HD ARG 52 -11.850 1.249 -7.822 376 HD3 ARG 52 1HD ARG 52 -11.516 -0.489 -7.787 377 HE ARG 52 HE ARG 52 -14.319 0.177 -7.895 378 HH11 ARG 52 1HH1 ARG 52 -11.471 -0.343 -9.887 379 HH12 ARG 52 2HH1 ARG 52 -12.397 -0.767 -11.287 380 HH21 ARG 52 1HH2 ARG 52 -15.504 -0.456 -9.654 381 HH22 ARG 52 2HH2 ARG 52 -14.712 -0.828 -11.149 382 H VAL 53 H VAL 53 -12.782 0.615 -2.630 383 HA VAL 53 HA VAL 53 -15.521 1.731 -2.354 384 HB VAL 53 HB VAL 53 -15.030 2.430 -0.086 385 HG11 VAL 53 1HG1 VAL 53 -15.823 0.124 -0.265 386 HG12 VAL 53 2HG1 VAL 53 -14.726 0.284 1.106 387 HG13 VAL 53 3HG1 VAL 53 -14.164 -0.467 -0.392 388 HG21 VAL 53 3HG2 VAL 53 -12.658 3.034 -0.304 389 HG22 VAL 53 1HG2 VAL 53 -12.209 1.331 -0.410 390 HG23 VAL 53 2HG2 VAL 53 -12.889 1.975 1.088 391 H GLU 54 H GLU 54 -15.376 4.120 -1.683 392 HA GLU 54 HA GLU 54 -13.060 5.521 -2.909 393 HB2 GLU 54 2HB GLU 54 -14.528 7.403 -3.413 394 HB3 GLU 54 1HB GLU 54 -15.200 5.947 -4.135 395 HG2 GLU 54 2HG GLU 54 -16.898 5.804 -2.407 396 HG3 GLU 54 1HG GLU 54 -16.159 7.130 -1.513 397 H ALA 55 H ALA 55 -12.370 7.457 -1.768 398 HA ALA 55 HA ALA 55 -13.218 7.773 1.029 399 HB1 ALA 55 3HB ALA 55 -10.336 7.171 0.262 400 HB2 ALA 55 1HB ALA 55 -11.434 6.056 1.077 401 HB3 ALA 55 2HB ALA 55 -10.930 7.541 1.885 402 H THR 56 H THR 56 -12.637 9.769 1.943 403 HA THR 56 HA THR 56 -11.751 11.861 0.064 404 HB THR 56 HB THR 56 -13.081 12.239 2.790 405 HG1 THR 56 HG1 THR 56 -14.151 11.734 0.238 406 HG21 THR 56 3HG2 THR 56 -11.884 14.242 1.943 407 HG22 THR 56 1HG2 THR 56 -13.634 14.491 1.924 408 HG23 THR 56 2HG2 THR 56 -12.777 14.136 0.424 409 H VAL 57 H VAL 57 -9.919 12.951 0.422 410 HA VAL 57 HA VAL 57 -7.879 11.821 2.084 411 HB VAL 57 HB VAL 57 -7.757 14.279 0.265 412 HG11 VAL 57 1HG1 VAL 57 -5.519 12.494 1.278 413 HG12 VAL 57 2HG1 VAL 57 -5.847 14.143 1.815 414 HG13 VAL 57 3HG1 VAL 57 -5.334 13.842 0.152 415 HG21 VAL 57 3HG2 VAL 57 -6.924 12.785 -1.502 416 HG22 VAL 57 1HG2 VAL 57 -8.546 12.304 -0.997 417 HG23 VAL 57 2HG2 VAL 57 -7.141 11.386 -0.448 418 H THR 58 H THR 58 -7.453 12.435 4.101 419 HA THR 58 HA THR 58 -8.272 15.090 5.135 420 HB THR 58 HB THR 58 -7.612 12.589 6.778 421 HG1 THR 58 HG1 THR 58 -10.219 13.129 6.863 422 HG21 THR 58 3HG2 THR 58 -8.804 13.749 8.597 423 HG22 THR 58 1HG2 THR 58 -9.094 15.133 7.543 424 HG23 THR 58 2HG2 THR 58 -7.445 14.724 8.026 425 H VAL 59 H VAL 59 -6.432 16.347 4.750 426 HA VAL 59 HA VAL 59 -3.769 15.133 5.041 427 HB VAL 59 HB VAL 59 -4.674 17.732 3.743 428 HG11 VAL 59 1HG1 VAL 59 -2.304 18.243 3.206 429 HG12 VAL 59 2HG1 VAL 59 -1.783 16.889 4.212 430 HG13 VAL 59 3HG1 VAL 59 -2.582 18.279 4.949 431 HG21 VAL 59 3HG2 VAL 59 -3.627 16.707 1.736 432 HG22 VAL 59 1HG2 VAL 59 -4.908 15.689 2.404 433 HG23 VAL 59 2HG2 VAL 59 -3.213 15.281 2.691 434 H HIS 60 H HIS 60 -2.488 15.510 6.670 435 HA HIS 60 HA HIS 60 -3.447 17.074 8.925 436 HB2 HIS 60 2HB HIS 60 -1.204 15.044 8.581 437 HB3 HIS 60 1HB HIS 60 -1.421 15.964 10.074 438 HD1 HIS 60 HD1 HIS 60 -3.465 13.653 7.829 439 HD2 HIS 60 HD2 HIS 60 -3.212 14.835 11.802 440 HE1 HIS 60 HE1 HIS 60 -5.212 12.340 9.044 441 HE2 HIS 60 HE2 HIS 60 -5.148 13.185 11.393 442 H GLU 61 H GLU 61 -2.935 19.102 9.112 443 HA GLU 61 HA GLU 61 -1.135 20.639 7.688 444 HB2 GLU 61 2HB GLU 61 -1.522 22.352 9.471 445 HB3 GLU 61 1HB GLU 61 -3.013 21.591 8.925 446 HG2 GLU 61 2HG GLU 61 -2.949 20.097 10.925 447 HG3 GLU 61 1HG GLU 61 -1.515 20.957 11.489 448 H THR 62 H THR 62 -0.615 18.753 10.602 449 HA THR 62 HA THR 62 2.269 19.428 10.608 450 HB THR 62 HB THR 62 2.201 18.764 13.068 451 HG1 THR 62 HG1 THR 62 0.070 17.666 12.806 452 HG21 THR 62 3HG2 THR 62 2.190 21.157 12.432 453 HG22 THR 62 1HG2 THR 62 1.224 20.883 13.883 454 HG23 THR 62 2HG2 THR 62 0.429 21.124 12.326 455 HA PRO 63 HA PRO 63 1.890 14.964 9.306 456 HB2 PRO 63 2HB PRO 63 4.192 14.946 7.761 457 HB3 PRO 63 1HB PRO 63 2.618 15.498 7.150 458 HG2 PRO 63 2HG PRO 63 4.916 17.138 8.181 459 HG3 PRO 63 1HG PRO 63 3.900 17.404 6.742 460 HD2 PRO 63 2HD PRO 63 3.468 18.770 9.046 461 HD3 PRO 63 1HD PRO 63 2.125 18.286 7.988 462 H GLU 64 H GLU 64 2.536 13.489 10.781 463 HA GLU 64 HA GLU 64 4.864 13.925 12.461 464 HB2 GLU 64 2HB GLU 64 4.121 11.920 13.688 465 HB3 GLU 64 1HB GLU 64 2.800 13.065 13.489 466 HG2 GLU 64 2HG GLU 64 1.795 11.713 11.754 467 HG3 GLU 64 1HG GLU 64 3.191 10.638 11.717 468 H SER 65 H SER 65 6.420 12.194 12.838 469 HA SER 65 HA SER 65 7.463 11.107 10.330 470 HB2 SER 65 2HB SER 65 8.681 11.340 13.114 471 HB3 SER 65 1HB SER 65 9.540 10.799 11.672 472 HG SER 65 HG SER 65 8.205 13.275 11.669 473 H VAL 66 H VAL 66 6.744 9.146 9.817 474 HA VAL 66 HA VAL 66 6.217 7.079 11.870 475 HB VAL 66 HB VAL 66 5.051 7.235 9.046 476 HG11 VAL 66 1HG1 VAL 66 3.451 5.519 9.832 477 HG12 VAL 66 2HG1 VAL 66 4.256 5.480 11.402 478 HG13 VAL 66 3HG1 VAL 66 5.115 4.938 9.959 479 HG21 VAL 66 3HG2 VAL 66 2.938 7.985 10.103 480 HG22 VAL 66 1HG2 VAL 66 4.243 9.145 10.364 481 HG23 VAL 66 2HG2 VAL 66 3.749 8.061 11.668 482 H ASP 67 H ASP 67 7.694 5.484 11.903 483 HA ASP 67 HA ASP 67 9.695 5.158 9.840 484 HB2 ASP 67 2HB ASP 67 9.172 3.574 12.401 485 HB3 ASP 67 1HB ASP 67 10.553 3.313 11.337 486 H LEU 68 H LEU 68 9.140 4.155 8.001 487 HA LEU 68 HA LEU 68 7.683 1.580 8.129 488 HB2 LEU 68 2HB LEU 68 7.520 3.570 5.835 489 HB3 LEU 68 1HB LEU 68 6.693 2.025 5.934 490 HG LEU 68 HG LEU 68 6.120 4.469 7.667 491 HD11 LEU 68 1HD1 LEU 68 4.010 4.594 6.453 492 HD12 LEU 68 2HD1 LEU 68 4.482 3.225 5.442 493 HD13 LEU 68 3HD1 LEU 68 5.378 4.745 5.355 494 HD21 LEU 68 3HD2 LEU 68 5.703 2.397 8.925 495 HD22 LEU 68 1HD2 LEU 68 4.678 1.795 7.621 496 HD23 LEU 68 2HD2 LEU 68 4.197 3.224 8.542 497 H GLU 69 H GLU 69 8.172 0.218 6.194 498 HA GLU 69 HA GLU 69 10.996 -0.145 5.923 499 HB2 GLU 69 2HB GLU 69 10.382 -2.135 4.594 500 HB3 GLU 69 1HB GLU 69 9.426 -2.057 6.070 501 HG2 GLU 69 2HG GLU 69 7.534 -1.095 4.748 502 HG3 GLU 69 1HG GLU 69 8.485 -1.306 3.280 503 H THR 70 H THR 70 12.284 0.188 4.127 504 HA THR 70 HA THR 70 11.042 1.103 1.595 505 HB THR 70 HB THR 70 12.453 2.881 2.605 506 HG1 THR 70 HG1 THR 70 12.404 2.862 0.367 507 HG21 THR 70 3HG2 THR 70 14.909 2.632 2.759 508 HG22 THR 70 1HG2 THR 70 14.755 0.922 2.345 509 HG23 THR 70 2HG2 THR 70 14.079 1.527 3.858 510 H SER 71 H SER 71 12.837 0.615 -0.218 511 HA SER 71 HA SER 71 13.154 -2.309 -0.215 512 HB2 SER 71 2HB SER 71 13.397 -0.354 -2.532 513 HB3 SER 71 1HB SER 71 13.071 -2.093 -2.605 514 HG SER 71 HG SER 71 11.171 -1.214 -1.134 515 H ASP 72 H ASP 72 15.061 -0.117 0.939 516 HA ASP 72 HA ASP 72 17.400 -0.334 -0.871 517 HB2 ASP 72 2HB ASP 72 16.546 1.885 1.048 518 HB3 ASP 72 1HB ASP 72 18.129 1.840 0.280 519 H ASP 73 H ASP 73 16.686 -2.331 1.025 520 HA ASP 73 HA ASP 73 17.257 -3.548 2.840 521 HB2 ASP 73 2HB ASP 73 19.584 -4.240 2.992 522 HB3 ASP 73 1HB ASP 73 19.130 -4.074 1.306 523 H ARG 74 H ARG 74 16.404 -1.071 3.571 524 HA ARG 74 HA ARG 74 17.838 -0.414 6.045 525 HB2 ARG 74 2HB ARG 74 18.770 0.875 3.961 526 HB3 ARG 74 1HB ARG 74 17.240 1.738 3.954 527 HG2 ARG 74 2HG ARG 74 17.736 2.712 6.138 528 HG3 ARG 74 1HG ARG 74 19.190 1.723 6.289 529 HD2 ARG 74 2HD ARG 74 18.706 3.886 4.214 530 HD3 ARG 74 1HD ARG 74 19.731 4.041 5.643 531 HE ARG 74 HE ARG 74 21.121 2.223 4.666 532 HH11 ARG 74 1HH1 ARG 74 19.171 4.189 2.493 533 HH12 ARG 74 2HH1 ARG 74 20.191 3.897 1.122 534 HH21 ARG 74 1HH2 ARG 74 22.434 1.835 2.867 535 HH22 ARG 74 2HH2 ARG 74 22.047 2.557 1.335 536 H THR 75 H THR 75 16.496 1.756 6.777 537 HA THR 75 HA THR 75 13.598 1.363 6.537 538 HB THR 75 HB THR 75 15.042 1.893 9.192 539 HG1 THR 75 HG1 THR 75 15.401 -0.243 8.461 540 HG21 THR 75 3HG2 THR 75 12.124 1.209 8.637 541 HG22 THR 75 1HG2 THR 75 12.726 2.805 9.099 542 HG23 THR 75 2HG2 THR 75 12.841 1.453 10.231 543 H VAL 76 H VAL 76 12.513 3.423 6.678 544 HA VAL 76 HA VAL 76 14.191 5.834 6.806 545 HB VAL 76 HB VAL 76 13.185 6.790 4.686 546 HG11 VAL 76 1HG1 VAL 76 15.506 5.989 4.690 547 HG12 VAL 76 2HG1 VAL 76 14.744 5.688 3.127 548 HG13 VAL 76 3HG1 VAL 76 14.965 4.359 4.272 549 HG21 VAL 76 3HG2 VAL 76 11.278 5.281 4.437 550 HG22 VAL 76 1HG2 VAL 76 12.358 3.920 4.137 551 HG23 VAL 76 2HG2 VAL 76 12.271 5.255 2.981 552 H ARG 77 H ARG 77 13.108 7.680 7.216 553 HA ARG 77 HA ARG 77 10.612 7.482 8.593 554 HB2 ARG 77 2HB ARG 77 12.409 8.937 9.411 555 HB3 ARG 77 1HB ARG 77 12.413 9.849 7.913 556 HG2 ARG 77 2HG ARG 77 9.878 9.775 9.544 557 HG3 ARG 77 1HG ARG 77 11.212 10.776 10.111 558 HD2 ARG 77 2HD ARG 77 9.883 10.999 7.380 559 HD3 ARG 77 1HD ARG 77 9.587 12.064 8.758 560 HE ARG 77 HE ARG 77 11.888 12.806 8.611 561 HH11 ARG 77 1HH1 ARG 77 10.746 11.096 5.758 562 HH12 ARG 77 2HH1 ARG 77 11.942 11.811 4.728 563 HH21 ARG 77 1HH2 ARG 77 13.434 13.704 7.254 564 HH22 ARG 77 2HH2 ARG 77 13.462 13.285 5.568 565 H TYR 78 H TYR 78 8.689 7.644 7.669 566 HA TYR 78 HA TYR 78 8.260 9.122 5.149 567 HB2 TYR 78 2HB TYR 78 6.564 7.073 6.643 568 HB3 TYR 78 1HB TYR 78 5.899 8.070 5.359 569 HD1 TYR 78 HD2 TYR 78 8.993 5.938 5.817 570 HD2 TYR 78 HD1 TYR 78 5.677 6.961 3.322 571 HE1 TYR 78 HE2 TYR 78 9.705 4.266 4.177 572 HE2 TYR 78 HE1 TYR 78 6.392 5.283 1.679 573 HH TYR 78 HH TYR 78 8.693 2.898 2.366 574 H LEU 79 H LEU 79 6.641 10.724 5.082 575 HA LEU 79 HA LEU 79 5.934 11.974 7.666 576 HB2 LEU 79 2HB LEU 79 5.881 13.073 4.826 577 HB3 LEU 79 1HB LEU 79 5.273 13.949 6.226 578 HG LEU 79 HG LEU 79 8.175 13.105 5.804 579 HD11 LEU 79 1HD1 LEU 79 8.630 15.483 5.483 580 HD12 LEU 79 2HD1 LEU 79 6.911 15.859 5.637 581 HD13 LEU 79 3HD1 LEU 79 7.491 14.895 4.274 582 HD21 LEU 79 3HD2 LEU 79 7.600 13.125 8.193 583 HD22 LEU 79 1HD2 LEU 79 6.928 14.753 8.043 584 HD23 LEU 79 2HD2 LEU 79 8.656 14.480 7.804 585 H HIS 80 H HIS 80 3.910 11.761 8.393 586 HA HIS 80 HA HIS 80 1.872 10.417 6.860 587 HB2 HIS 80 2HB HIS 80 2.025 9.998 9.266 588 HB3 HIS 80 1HB HIS 80 1.874 11.714 9.627 589 HD2 HIS 80 HD2 HIS 80 -0.662 9.942 7.204 590 HE1 HIS 80 HE1 HIS 80 -2.618 11.008 10.787 591 HE2 HIS 80 HE2 HIS 80 -2.869 9.917 8.522 592 H VAL 81 H VAL 81 1.302 11.632 5.164 593 HA VAL 81 HA VAL 81 0.908 14.530 5.419 594 HB VAL 81 HB VAL 81 0.783 14.515 2.910 595 HG11 VAL 81 1HG1 VAL 81 3.263 13.191 4.087 596 HG12 VAL 81 2HG1 VAL 81 2.931 14.924 4.033 597 HG13 VAL 81 3HG1 VAL 81 3.185 14.031 2.534 598 HG21 VAL 81 3HG2 VAL 81 1.387 12.472 1.650 599 HG22 VAL 81 1HG2 VAL 81 -0.097 12.222 2.572 600 HG23 VAL 81 2HG2 VAL 81 1.426 11.541 3.152 601 H ALA 82 H ALA 82 -0.953 11.597 4.782 602 HA ALA 82 HA ALA 82 -3.450 13.188 4.723 603 HB1 ALA 82 3HB ALA 82 -4.244 12.007 2.717 604 HB2 ALA 82 1HB ALA 82 -2.692 11.175 2.574 605 HB3 ALA 82 2HB ALA 82 -2.779 12.927 2.372 606 H THR 83 H THR 83 -5.371 11.900 4.971 607 HA THR 83 HA THR 83 -5.076 9.098 5.794 608 HB THR 83 HB THR 83 -6.577 11.211 7.420 609 HG1 THR 83 HG1 THR 83 -4.751 9.628 8.688 610 HG21 THR 83 3HG2 THR 83 -7.111 9.374 8.990 611 HG22 THR 83 1HG2 THR 83 -6.374 8.208 7.889 612 HG23 THR 83 2HG2 THR 83 -7.838 9.074 7.409 613 H LEU 84 H LEU 84 -6.129 8.252 4.156 614 HA LEU 84 HA LEU 84 -8.350 9.436 2.792 615 HB2 LEU 84 2HB LEU 84 -7.459 6.545 2.489 616 HB3 LEU 84 1HB LEU 84 -8.141 7.616 1.272 617 HG LEU 84 HG LEU 84 -5.314 7.733 2.415 618 HD11 LEU 84 1HD1 LEU 84 -5.609 5.932 0.819 619 HD12 LEU 84 2HD1 LEU 84 -4.570 7.190 0.154 620 HD13 LEU 84 3HD1 LEU 84 -6.250 7.060 -0.380 621 HD21 LEU 84 3HD2 LEU 84 -6.563 9.614 0.381 622 HD22 LEU 84 1HD2 LEU 84 -4.853 9.569 0.828 623 HD23 LEU 84 2HD2 LEU 84 -6.063 10.024 2.023 624 H SER 85 H SER 85 -10.173 9.572 3.987 625 HA SER 85 HA SER 85 -10.941 7.498 5.912 626 HB2 SER 85 2HB SER 85 -11.989 10.340 5.532 627 HB3 SER 85 1HB SER 85 -12.382 9.257 6.875 628 HG SER 85 HG SER 85 -9.958 10.574 6.281 629 H PHE 86 H PHE 86 -12.756 6.288 5.693 630 HA PHE 86 HA PHE 86 -14.834 6.780 3.727 631 HB2 PHE 86 2HB PHE 86 -14.465 4.597 2.537 632 HB3 PHE 86 1HB PHE 86 -13.180 5.759 2.262 633 HD1 PHE 86 HD1 PHE 86 -10.926 5.404 3.241 634 HD2 PHE 86 HD2 PHE 86 -14.023 2.488 3.721 635 HE1 PHE 86 HE1 PHE 86 -9.256 3.726 3.892 636 HE2 PHE 86 HE2 PHE 86 -12.340 0.822 4.378 637 HZ PHE 86 HZ PHE 86 -9.960 1.438 4.462 638 H ASP 87 H ASP 87 -16.106 4.429 3.661 639 HA ASP 87 HA ASP 87 -16.413 3.470 6.461 640 HB2 ASP 87 2HB ASP 87 -18.572 3.706 4.310 641 HB3 ASP 87 1HB ASP 87 -18.812 3.012 5.909 642 H LEU 88 H LEU 88 -16.802 1.224 6.693 643 HA LEU 88 HA LEU 88 -16.614 -0.626 4.490 644 HB2 LEU 88 2HB LEU 88 -14.242 0.255 4.804 645 HB3 LEU 88 1HB LEU 88 -14.259 -0.417 6.424 646 HG LEU 88 HG LEU 88 -14.596 -2.717 5.371 647 HD11 LEU 88 1HD1 LEU 88 -14.056 -3.005 2.989 648 HD12 LEU 88 2HD1 LEU 88 -13.970 -1.252 2.789 649 HD13 LEU 88 3HD1 LEU 88 -15.502 -2.021 3.210 650 HD21 LEU 88 3HD2 LEU 88 -12.241 -3.002 4.753 651 HD22 LEU 88 1HD2 LEU 88 -12.403 -1.982 6.182 652 HD23 LEU 88 2HD2 LEU 88 -12.050 -1.251 4.614 653 H ASP 89 H ASP 89 -17.414 -2.567 5.086 654 HA ASP 89 HA ASP 89 -18.374 -4.258 6.208 655 HB2 ASP 89 2HB ASP 89 -16.184 -4.461 7.372 656 HB3 ASP 89 1HB ASP 89 -16.734 -3.329 8.605 657 H GLY 90 H GLY 90 -18.153 -1.996 8.963 658 HA2 GLY 90 2HA GLY 90 -20.989 -1.366 8.938 659 HA3 GLY 90 1HA GLY 90 -20.498 -2.460 10.229 660 H GLU 91 H GLU 91 -18.107 -0.238 9.215 661 HA GLU 91 HA GLU 91 -18.816 1.910 11.056 662 HB2 GLU 91 2HB GLU 91 -16.648 1.710 12.306 663 HB3 GLU 91 1HB GLU 91 -17.751 0.369 12.590 664 HG2 GLU 91 2HG GLU 91 -16.453 -1.022 10.984 665 HG3 GLU 91 1HG GLU 91 -15.320 0.314 10.773 666 H SER 92 H SER 92 -17.466 3.733 10.845 667 HA SER 92 HA SER 92 -16.415 4.243 8.214 668 HB2 SER 92 2HB SER 92 -17.552 6.020 9.585 669 HB3 SER 92 1HB SER 92 -16.192 5.997 10.707 670 HG SER 92 HG SER 92 -15.824 6.437 7.938 671 H ARG 93 H ARG 93 -14.408 3.731 7.557 672 HA ARG 93 HA ARG 93 -12.255 3.229 9.528 673 HB2 ARG 93 2HB ARG 93 -12.860 1.800 6.904 674 HB3 ARG 93 1HB ARG 93 -11.342 1.614 7.770 675 HG2 ARG 93 2HG ARG 93 -14.068 0.876 8.884 676 HG3 ARG 93 1HG ARG 93 -12.924 -0.258 8.160 677 HD2 ARG 93 2HD ARG 93 -12.644 -0.466 10.522 678 HD3 ARG 93 1HD ARG 93 -11.254 0.469 9.961 679 HE ARG 93 HE ARG 93 -13.632 1.830 11.052 680 HH11 ARG 93 1HH1 ARG 93 -10.212 1.074 11.415 681 HH12 ARG 93 2HH1 ARG 93 -9.973 2.247 12.667 682 HH21 ARG 93 1HH2 ARG 93 -13.283 3.393 12.625 683 HH22 ARG 93 2HH2 ARG 93 -11.714 3.563 13.353 684 H ASP 94 H ASP 94 -10.266 4.053 9.095 685 HA ASP 94 HA ASP 94 -9.940 5.785 6.709 686 HB2 ASP 94 2HB ASP 94 -8.851 7.475 8.130 687 HB3 ASP 94 1HB ASP 94 -10.489 7.177 8.682 688 H LEU 95 H LEU 95 -8.010 5.642 5.704 689 HA LEU 95 HA LEU 95 -5.831 4.019 6.901 690 HB2 LEU 95 2HB LEU 95 -6.589 4.268 3.959 691 HB3 LEU 95 1HB LEU 95 -5.153 3.442 4.559 692 HG LEU 95 HG LEU 95 -8.051 2.613 4.925 693 HD11 LEU 95 1HD1 LEU 95 -5.708 1.216 3.607 694 HD12 LEU 95 2HD1 LEU 95 -7.051 2.021 2.784 695 HD13 LEU 95 3HD1 LEU 95 -7.354 0.587 3.761 696 HD21 LEU 95 3HD2 LEU 95 -5.608 1.424 6.281 697 HD22 LEU 95 1HD2 LEU 95 -7.215 0.688 6.246 698 HD23 LEU 95 2HD2 LEU 95 -6.972 2.228 7.062 699 H HIS 96 H HIS 96 -3.843 4.929 6.941 700 HA HIS 96 HA HIS 96 -3.756 7.798 6.365 701 HB2 HIS 96 2HB HIS 96 -1.843 6.043 7.970 702 HB3 HIS 96 1HB HIS 96 -1.793 7.804 7.872 703 HD2 HIS 96 HD2 HIS 96 -4.225 5.034 9.269 704 HE1 HIS 96 HE1 HIS 96 -4.900 8.671 11.278 705 HE2 HIS 96 HE2 HIS 96 -5.763 6.341 10.857 706 H ALA 97 H ALA 97 -2.581 8.613 4.748 707 HA ALA 97 HA ALA 97 -0.987 6.834 3.022 708 HB1 ALA 97 3HB ALA 97 -1.308 8.571 1.284 709 HB2 ALA 97 1HB ALA 97 -2.204 9.568 2.438 710 HB3 ALA 97 2HB ALA 97 -2.856 8.011 1.922 711 H PHE 98 H PHE 98 1.148 7.074 2.948 712 HA PHE 98 HA PHE 98 2.415 9.501 4.068 713 HB2 PHE 98 2HB PHE 98 3.719 6.755 4.240 714 HB3 PHE 98 1HB PHE 98 4.042 8.196 5.189 715 HD1 PHE 98 HD1 PHE 98 2.680 8.708 7.180 716 HD2 PHE 98 HD2 PHE 98 1.921 5.213 4.848 717 HE1 PHE 98 HE1 PHE 98 1.352 7.758 9.016 718 HE2 PHE 98 HE2 PHE 98 0.597 4.274 6.692 719 HZ PHE 98 HZ PHE 98 0.318 5.545 8.774 720 H ARG 99 H ARG 99 4.609 9.764 3.319 721 HA ARG 99 HA ARG 99 5.659 8.339 1.057 722 HB2 ARG 99 2HB ARG 99 5.808 10.352 -0.432 723 HB3 ARG 99 1HB ARG 99 4.163 9.786 -0.177 724 HG2 ARG 99 2HG ARG 99 4.286 11.692 1.772 725 HG3 ARG 99 1HG ARG 99 5.446 12.366 0.622 726 HD2 ARG 99 2HD ARG 99 2.534 11.687 0.129 727 HD3 ARG 99 1HD ARG 99 3.273 13.285 0.166 728 HE ARG 99 HE ARG 99 4.435 11.604 -1.851 729 HH11 ARG 99 1HH1 ARG 99 1.651 13.671 -1.249 730 HH12 ARG 99 2HH1 ARG 99 1.367 13.973 -2.934 731 HH21 ARG 99 1HH2 ARG 99 4.011 11.956 -4.024 732 HH22 ARG 99 2HH2 ARG 99 2.707 12.997 -4.506 733 H GLN 100 H GLN 100 7.932 8.851 0.796 734 HA GLN 100 HA GLN 100 9.053 8.691 3.288 735 HB2 GLN 100 2HB GLN 100 10.447 9.348 0.670 736 HB3 GLN 100 1HB GLN 100 11.283 8.886 2.145 737 HG2 GLN 100 2HG GLN 100 9.914 6.733 2.101 738 HG3 GLN 100 1HG GLN 100 9.415 7.196 0.474 739 HE21 GLN 100 1HE2 GLN 100 12.643 7.695 1.888 740 HE22 GLN 100 2HE2 GLN 100 13.459 6.602 0.829 741 H ALA 101 H ALA 101 10.241 11.412 1.218 742 HA ALA 101 HA ALA 101 10.054 13.165 3.616 743 HB1 ALA 101 3HB ALA 101 12.399 12.608 3.101 744 HB2 ALA 101 1HB ALA 101 12.077 14.326 2.854 745 HB3 ALA 101 2HB ALA 101 12.204 13.243 1.465 746 H ALA 102 H ALA 102 10.771 13.839 0.175 747 HA ALA 102 HA ALA 102 8.605 15.861 0.148 748 HB1 ALA 102 3HB ALA 102 10.136 17.225 -1.228 749 HB2 ALA 102 1HB ALA 102 11.367 15.961 -1.134 750 HB3 ALA 102 2HB ALA 102 10.876 16.828 0.323 751 H ASP 103 H ASP 103 8.128 13.201 -0.704 752 HA ASP 103 HA ASP 103 8.588 12.808 -3.482 753 HB2 ASP 103 2HB ASP 103 8.154 10.856 -2.085 754 HB3 ASP 103 1HB ASP 103 6.595 11.502 -1.590 755 H GLU 104 H GLU 104 7.499 13.448 -5.182 756 HA GLU 104 HA GLU 104 4.772 14.572 -4.996 757 HB2 GLU 104 2HB GLU 104 7.098 15.775 -6.586 758 HB3 GLU 104 1HB GLU 104 5.430 16.351 -6.630 759 HG2 GLU 104 2HG GLU 104 5.582 16.945 -4.225 760 HG3 GLU 104 1HG GLU 104 7.243 16.366 -4.192 761 H SER 105 H SER 105 6.412 12.064 -5.952 762 HA SER 105 HA SER 105 5.630 11.807 -8.739 763 HB2 SER 105 2HB SER 105 7.799 10.911 -7.827 764 HB3 SER 105 1HB SER 105 6.882 9.747 -6.870 765 HG SER 105 HG SER 105 6.220 8.749 -8.719 766 H ARG 106 H ARG 106 3.723 11.961 -6.288 767 HA ARG 106 HA ARG 106 1.542 11.450 -5.949 768 HB2 ARG 106 2HB ARG 106 1.708 9.544 -8.328 769 HB3 ARG 106 1HB ARG 106 0.236 10.199 -7.618 770 HG2 ARG 106 2HG ARG 106 2.360 11.840 -9.044 771 HG3 ARG 106 1HG ARG 106 0.868 11.259 -9.786 772 HD2 ARG 106 2HD ARG 106 -0.479 12.654 -8.364 773 HD3 ARG 106 1HD ARG 106 0.906 13.061 -7.346 774 HE ARG 106 HE ARG 106 1.446 14.712 -8.799 775 HH11 ARG 106 1HH1 ARG 106 -0.620 12.489 -10.587 776 HH12 ARG 106 2HH1 ARG 106 -0.688 13.504 -11.991 777 HH21 ARG 106 1HH2 ARG 106 1.336 16.015 -10.644 778 HH22 ARG 106 2HH2 ARG 106 0.419 15.491 -12.022 779 H THR 107 H THR 107 3.993 9.569 -5.188 780 HA THR 107 HA THR 107 2.783 6.931 -5.100 781 HB THR 107 HB THR 107 5.523 7.807 -4.089 782 HG1 THR 107 HG1 THR 107 4.527 7.299 -6.653 783 HG21 THR 107 3HG2 THR 107 4.497 5.058 -4.923 784 HG22 THR 107 1HG2 THR 107 4.813 5.571 -3.258 785 HG23 THR 107 2HG2 THR 107 6.140 5.437 -4.410 786 H LEU 108 H LEU 108 1.083 7.397 -3.678 787 HA LEU 108 HA LEU 108 1.632 8.001 -0.867 788 HB2 LEU 108 2HB LEU 108 -0.985 7.386 -2.309 789 HB3 LEU 108 1HB LEU 108 -0.844 7.895 -0.630 790 HG LEU 108 HG LEU 108 -0.119 9.584 -3.068 791 HD11 LEU 108 1HD1 LEU 108 -2.536 9.321 -2.795 792 HD12 LEU 108 2HD1 LEU 108 -2.032 10.972 -2.444 793 HD13 LEU 108 3HD1 LEU 108 -2.426 9.873 -1.119 794 HD21 LEU 108 3HD2 LEU 108 0.239 11.431 -1.473 795 HD22 LEU 108 1HD2 LEU 108 1.370 10.107 -1.198 796 HD23 LEU 108 2HD2 LEU 108 -0.012 10.322 -0.121 797 H PHE 109 H PHE 109 2.290 6.360 0.354 798 HA PHE 109 HA PHE 109 1.653 3.571 -0.346 799 HB2 PHE 109 2HB PHE 109 4.058 4.189 -0.014 800 HB3 PHE 109 1HB PHE 109 3.698 4.721 1.623 801 HD1 PHE 109 HD1 PHE 109 3.131 1.636 -0.492 802 HD2 PHE 109 HD2 PHE 109 4.337 3.207 3.311 803 HE1 PHE 109 HE1 PHE 109 3.596 -0.644 0.314 804 HE2 PHE 109 HE2 PHE 109 4.791 0.921 4.103 805 HZ PHE 109 HZ PHE 109 4.421 -1.004 2.609 806 H VAL 110 H VAL 110 -0.164 2.841 0.648 807 HA VAL 110 HA VAL 110 -0.753 3.701 3.427 808 HB VAL 110 HB VAL 110 -3.170 3.159 3.041 809 HG11 VAL 110 1HG1 VAL 110 -2.090 5.290 1.174 810 HG12 VAL 110 2HG1 VAL 110 -2.425 5.478 2.895 811 HG13 VAL 110 3HG1 VAL 110 -3.752 5.189 1.770 812 HG21 VAL 110 3HG2 VAL 110 -3.027 1.626 1.145 813 HG22 VAL 110 1HG2 VAL 110 -2.432 2.919 0.107 814 HG23 VAL 110 2HG2 VAL 110 -4.081 2.982 0.742 815 HA PRO 111 HA PRO 111 -0.130 -0.831 3.977 816 HB2 PRO 111 2HB PRO 111 1.123 -0.612 6.420 817 HB3 PRO 111 1HB PRO 111 2.025 -0.511 4.891 818 HG2 PRO 111 2HG PRO 111 1.120 1.717 6.693 819 HG3 PRO 111 1HG PRO 111 2.661 1.527 5.822 820 HD2 PRO 111 2HD PRO 111 0.598 3.119 4.916 821 HD3 PRO 111 1HD PRO 111 1.791 2.364 3.837 822 H PHE 112 H PHE 112 -1.972 -1.751 4.833 823 HA PHE 112 HA PHE 112 -3.374 -0.344 7.026 824 HB2 PHE 112 2HB PHE 112 -5.518 -1.113 6.208 825 HB3 PHE 112 1HB PHE 112 -4.702 -0.223 4.939 826 HD1 PHE 112 HD2 PHE 112 -5.764 -3.624 6.051 827 HD2 PHE 112 HD1 PHE 112 -4.233 -1.273 2.807 828 HE1 PHE 112 HE2 PHE 112 -6.237 -5.458 4.491 829 HE2 PHE 112 HE1 PHE 112 -4.727 -3.123 1.262 830 HZ PHE 112 HZ PHE 112 -5.720 -5.209 2.101 831 H ARG 113 H ARG 113 -4.114 -1.641 8.743 832 HA ARG 113 HA ARG 113 -3.289 -4.481 8.655 833 HB2 ARG 113 2HB ARG 113 -2.214 -3.206 10.473 834 HB3 ARG 113 1HB ARG 113 -3.795 -2.735 11.094 835 HG2 ARG 113 2HG ARG 113 -4.329 -5.049 11.643 836 HG3 ARG 113 1HG ARG 113 -2.850 -5.615 10.868 837 HD2 ARG 113 2HD ARG 113 -1.495 -4.491 12.577 838 HD3 ARG 113 1HD ARG 113 -2.961 -3.848 13.333 839 HE ARG 113 HE ARG 113 -3.544 -6.018 14.049 840 HH11 ARG 113 1HH1 ARG 113 -0.370 -5.992 12.541 841 HH12 ARG 113 2HH1 ARG 113 0.086 -7.522 13.221 842 HH21 ARG 113 1HH2 ARG 113 -2.923 -8.020 14.902 843 HH22 ARG 113 2HH2 ARG 113 -1.350 -8.659 14.547 844 H ASP 114 H ASP 114 -4.821 -6.027 8.768 845 HA ASP 114 HA ASP 114 -7.659 -5.212 9.026 846 HB2 ASP 114 2HB ASP 114 -8.068 -7.095 7.361 847 HB3 ASP 114 1HB ASP 114 -7.175 -5.723 6.707 848 H LYS 115 H LYS 115 -8.686 -7.883 9.019 849 HA LYS 115 HA LYS 115 -7.761 -8.828 11.663 850 HB2 LYS 115 2HB LYS 115 -10.367 -9.468 10.246 851 HB3 LYS 115 1HB LYS 115 -9.939 -9.940 11.885 852 HG2 LYS 115 2HG LYS 115 -10.151 -7.040 11.044 853 HG3 LYS 115 1HG LYS 115 -11.553 -7.962 11.555 854 HD2 LYS 115 2HD LYS 115 -10.955 -6.798 13.482 855 HD3 LYS 115 1HD LYS 115 -10.240 -8.379 13.752 856 HE2 LYS 115 2HE LYS 115 -8.505 -6.249 12.521 857 HE3 LYS 115 1HE LYS 115 -8.894 -6.114 14.235 858 HZ1 LYS 115 3HZ LYS 115 -7.883 -8.169 14.680 859 HZ2 LYS 115 1HZ LYS 115 -6.805 -7.334 13.689 860 HZ3 LYS 115 2HZ LYS 115 -7.756 -8.575 13.053 861 H THR 116 H THR 116 -7.951 -9.790 8.331 862 HA THR 116 HA THR 116 -7.604 -12.625 8.828 863 HB THR 116 HB THR 116 -7.142 -12.393 6.136 864 HG1 THR 116 HG1 THR 116 -7.306 -10.213 5.898 865 HG21 THR 116 3HG2 THR 116 -9.546 -12.755 5.767 866 HG22 THR 116 1HG2 THR 116 -9.881 -12.240 7.425 867 HG23 THR 116 2HG2 THR 116 -8.965 -13.719 7.127 868 H THR 117 H THR 117 -5.510 -9.951 8.693 869 HA THR 117 HA THR 117 -3.077 -11.249 7.966 870 HB THR 117 HB THR 117 -3.241 -8.788 7.997 871 HG1 THR 117 HG1 THR 117 -1.175 -9.425 8.213 872 HG21 THR 117 3HG2 THR 117 -3.389 -8.989 11.031 873 HG22 THR 117 1HG2 THR 117 -4.701 -8.457 9.974 874 HG23 THR 117 2HG2 THR 117 -3.223 -7.499 10.100 875 H GLY 118 H GLY 118 -1.544 -12.285 9.283 876 HA2 GLY 118 2HA GLY 118 -0.690 -13.387 11.130 877 HA3 GLY 118 1HA GLY 118 -1.936 -12.663 12.138 878 H GLN 119 H GLN 119 -3.568 -13.921 9.574 879 HA GLN 119 HA GLN 119 -4.034 -16.554 10.853 880 HB2 GLN 119 2HB GLN 119 -6.016 -14.762 9.362 881 HB3 GLN 119 1HB GLN 119 -6.379 -16.374 9.961 882 HG2 GLN 119 2HG GLN 119 -5.640 -13.995 11.696 883 HG3 GLN 119 1HG GLN 119 -7.283 -14.566 11.405 884 HE21 GLN 119 1HE2 GLN 119 -4.278 -15.210 13.049 885 HE22 GLN 119 2HE2 GLN 119 -4.882 -16.452 14.080 886 H GLN 120 H GLN 120 -5.138 -15.205 7.735 887 HA GLN 120 HA GLN 120 -4.107 -17.526 6.273 888 HB2 GLN 120 2HB GLN 120 -5.476 -16.755 4.435 889 HB3 GLN 120 1HB GLN 120 -6.444 -16.632 5.900 890 HG2 GLN 120 2HG GLN 120 -5.918 -14.182 5.988 891 HG3 GLN 120 1HG GLN 120 -5.061 -14.340 4.458 892 HE21 GLN 120 1HE2 GLN 120 -8.116 -15.904 5.330 893 HE22 GLN 120 2HE2 GLN 120 -9.071 -15.065 4.165 894 H SER 121 H SER 121 -2.883 -14.651 7.246 895 HA SER 121 HA SER 121 -0.898 -14.478 5.104 896 HB2 SER 121 2HB SER 121 -2.549 -12.085 6.061 897 HB3 SER 121 1HB SER 121 -1.138 -11.986 5.004 898 HG SER 121 HG SER 121 -3.726 -12.807 4.449 899 H TYR 122 H TYR 122 0.908 -12.947 5.818 900 HA TYR 122 HA TYR 122 1.764 -13.603 8.467 901 HB2 TYR 122 2HB TYR 122 3.369 -13.356 6.585 902 HB3 TYR 122 1HB TYR 122 2.973 -11.646 6.457 903 HD1 TYR 122 HD2 TYR 122 4.393 -14.183 8.840 904 HD2 TYR 122 HD1 TYR 122 4.198 -10.049 7.760 905 HE1 TYR 122 HE2 TYR 122 6.128 -13.660 10.504 906 HE2 TYR 122 HE1 TYR 122 5.927 -9.535 9.429 907 HH TYR 122 HH TYR 122 7.817 -11.923 10.923 908 H ASP 123 H ASP 123 2.192 -12.191 10.159 909 HA ASP 123 HA ASP 123 0.067 -10.442 10.874 910 HB2 ASP 123 2HB ASP 123 1.254 -11.808 12.542 911 HB3 ASP 123 1HB ASP 123 2.761 -10.963 12.209 912 H GLY 124 H GLY 124 -0.065 -8.221 10.980 913 HA2 GLY 124 2HA GLY 124 1.332 -6.118 11.339 914 HA3 GLY 124 1HA GLY 124 2.172 -6.585 9.864 915 H GLY 125 H GLY 125 -0.402 -7.651 8.763 916 HA2 GLY 125 2HA GLY 125 -2.514 -6.540 8.104 917 HA3 GLY 125 1HA GLY 125 -1.567 -5.069 7.877 918 H ARG 126 H ARG 126 -2.702 -5.329 5.731 919 HA ARG 126 HA ARG 126 -0.730 -6.519 3.852 920 HB2 ARG 126 2HB ARG 126 -3.728 -6.169 3.402 921 HB3 ARG 126 1HB ARG 126 -2.590 -6.668 2.156 922 HG2 ARG 126 2HG ARG 126 -3.078 -8.239 4.711 923 HG3 ARG 126 1HG ARG 126 -3.953 -8.523 3.207 924 HD2 ARG 126 2HD ARG 126 -2.209 -10.154 3.346 925 HD3 ARG 126 1HD ARG 126 -1.742 -9.007 2.096 926 HE ARG 126 HE ARG 126 -0.431 -8.072 4.298 927 HH11 ARG 126 1HH1 ARG 126 -0.535 -11.229 2.733 928 HH12 ARG 126 2HH1 ARG 126 1.057 -11.675 3.251 929 HH21 ARG 126 1HH2 ARG 126 1.599 -8.718 5.077 930 HH22 ARG 126 2HH2 ARG 126 2.277 -10.241 4.589 931 H TYR 127 H TYR 127 -0.284 -5.086 1.964 932 HA TYR 127 HA TYR 127 -0.433 -2.276 2.944 933 HB2 TYR 127 2HB TYR 127 2.191 -3.224 1.802 934 HB3 TYR 127 1HB TYR 127 1.875 -2.092 3.114 935 HD1 TYR 127 HD1 TYR 127 2.233 -5.612 2.220 936 HD2 TYR 127 HD2 TYR 127 1.614 -2.955 5.472 937 HE1 TYR 127 HE1 TYR 127 2.626 -7.448 3.798 938 HE2 TYR 127 HE2 TYR 127 2.052 -4.773 7.063 939 HH TYR 127 HH TYR 127 3.502 -7.576 6.297 940 H MET 128 H MET 128 -0.660 -0.790 1.440 941 HA MET 128 HA MET 128 -0.880 -1.617 -1.404 942 HB2 MET 128 2HB MET 128 -2.762 0.032 0.318 943 HB3 MET 128 1HB MET 128 -2.774 0.182 -1.439 944 HG2 MET 128 2HG MET 128 -3.075 -2.446 -1.336 945 HG3 MET 128 1HG MET 128 -3.687 -2.076 0.281 946 HE1 MET 128 3HE MET 128 -6.548 0.517 -0.657 947 HE2 MET 128 1HE MET 128 -4.857 0.990 -0.510 948 HE3 MET 128 2HE MET 128 -5.567 -0.127 0.659 949 H GLU 129 H GLU 129 -0.670 0.019 -2.965 950 HA GLU 129 HA GLU 129 0.540 2.601 -2.215 951 HB2 GLU 129 2HB GLU 129 2.399 1.125 -2.772 952 HB3 GLU 129 1HB GLU 129 1.575 0.550 -4.217 953 HG2 GLU 129 2HG GLU 129 1.751 2.927 -5.128 954 HG3 GLU 129 1HG GLU 129 2.799 3.288 -3.751 955 H LEU 130 H LEU 130 -0.507 4.224 -3.271 956 HA LEU 130 HA LEU 130 -1.935 3.675 -5.812 957 HB2 LEU 130 2HB LEU 130 -2.831 6.027 -4.147 958 HB3 LEU 130 1HB LEU 130 -3.744 5.007 -5.239 959 HG LEU 130 HG LEU 130 -3.482 3.196 -3.307 960 HD11 LEU 130 1HD1 LEU 130 -3.449 4.213 -1.058 961 HD12 LEU 130 2HD1 LEU 130 -3.061 5.779 -1.770 962 HD13 LEU 130 3HD1 LEU 130 -1.924 4.434 -1.912 963 HD21 LEU 130 3HD2 LEU 130 -5.376 5.541 -3.002 964 HD22 LEU 130 1HD2 LEU 130 -5.585 3.927 -2.315 965 HD23 LEU 130 2HD2 LEU 130 -5.625 4.153 -4.062 966 H GLU 131 H GLU 131 -1.746 5.215 -7.403 967 HA GLU 131 HA GLU 131 -0.208 7.673 -6.889 968 HB2 GLU 131 2HB GLU 131 0.148 5.867 -9.322 969 HB3 GLU 131 1HB GLU 131 0.836 7.482 -9.150 970 HG2 GLU 131 2HG GLU 131 2.090 6.689 -7.132 971 HG3 GLU 131 1HG GLU 131 1.473 5.064 -7.426 972 HA PRO 132 HA PRO 132 -4.470 8.711 -8.328 973 HB2 PRO 132 2HB PRO 132 -4.369 11.321 -7.355 974 HB3 PRO 132 1HB PRO 132 -4.792 9.913 -6.360 975 HG2 PRO 132 2HG PRO 132 -2.123 11.279 -6.644 976 HG3 PRO 132 1HG PRO 132 -2.968 10.761 -5.163 977 HD2 PRO 132 2HD PRO 132 -1.015 9.263 -6.168 978 HD3 PRO 132 1HD PRO 132 -2.475 8.492 -5.509 979 H ASP 133 H ASP 133 -5.351 10.624 -9.564 980 HA ASP 133 HA ASP 133 -4.024 10.770 -12.068 981 HB2 ASP 133 2HB ASP 133 -6.461 10.708 -11.977 982 HB3 ASP 133 1HB ASP 133 -6.513 12.157 -10.982 983 H ARG 134 H ARG 134 -4.797 13.261 -9.614 984 HA ARG 134 HA ARG 134 -2.255 14.608 -10.292 985 HB2 ARG 134 2HB ARG 134 -3.311 16.754 -9.649 986 HB3 ARG 134 1HB ARG 134 -4.109 16.017 -11.026 987 HG2 ARG 134 2HG ARG 134 -5.988 16.633 -9.867 988 HG3 ARG 134 1HG ARG 134 -5.745 15.072 -9.108 989 HD2 ARG 134 2HD ARG 134 -4.933 16.011 -7.121 990 HD3 ARG 134 1HD ARG 134 -4.482 17.531 -7.892 991 HE ARG 134 HE ARG 134 -7.210 16.701 -7.116 992 HH11 ARG 134 1HH1 ARG 134 -4.988 19.256 -8.102 993 HH12 ARG 134 2HH1 ARG 134 -6.121 20.526 -7.763 994 HH21 ARG 134 1HH2 ARG 134 -8.661 18.394 -6.648 995 HH22 ARG 134 2HH2 ARG 134 -8.190 20.041 -6.944 996 H ASP 135 H ASP 135 -1.809 16.157 -8.140 997 HA ASP 135 HA ASP 135 -1.279 14.085 -6.134 998 HB2 ASP 135 2HB ASP 135 0.493 15.810 -7.061 999 HB3 ASP 135 1HB ASP 135 -0.243 16.945 -5.935 1000 H LEU 136 H LEU 136 -2.062 14.256 -3.942 1001 HA LEU 136 HA LEU 136 -4.724 15.495 -4.023 1002 HB2 LEU 136 2HB LEU 136 -3.620 13.311 -2.216 1003 HB3 LEU 136 1HB LEU 136 -5.287 13.875 -2.226 1004 HG LEU 136 HG LEU 136 -3.873 12.453 -4.515 1005 HD11 LEU 136 1HD1 LEU 136 -6.103 11.452 -2.732 1006 HD12 LEU 136 2HD1 LEU 136 -4.408 10.987 -2.609 1007 HD13 LEU 136 3HD1 LEU 136 -5.325 10.577 -4.054 1008 HD21 LEU 136 3HD2 LEU 136 -6.754 13.399 -4.352 1009 HD22 LEU 136 1HD2 LEU 136 -6.057 12.417 -5.644 1010 HD23 LEU 136 2HD2 LEU 136 -5.493 14.067 -5.394 1011 H SER 137 H SER 137 -5.647 16.471 -2.242 1012 HA SER 137 HA SER 137 -4.011 17.447 -0.018 1013 HB2 SER 137 2HB SER 137 -5.597 19.267 -1.895 1014 HB3 SER 137 1HB SER 137 -4.858 19.782 -0.376 1015 HG SER 137 HG SER 137 -3.534 18.794 -2.689 1016 H ASP 138 H ASP 138 -5.513 18.689 1.534 1017 HA ASP 138 HA ASP 138 -7.585 17.000 2.421 1018 HB2 ASP 138 2HB ASP 138 -8.086 18.894 4.057 1019 HB3 ASP 138 1HB ASP 138 -6.443 18.276 4.085 1020 H GLY 139 H GLY 139 -9.271 16.676 1.102 1021 HA2 GLY 139 2HA GLY 139 -11.581 17.730 0.871 1022 HA3 GLY 139 1HA GLY 139 -10.759 18.981 -0.054 1023 H ASP 140 H ASP 140 -8.887 16.837 -1.140 1024 HA ASP 140 HA ASP 140 -10.348 16.079 -3.482 1025 HB2 ASP 140 2HB ASP 140 -7.591 15.338 -2.425 1026 HB3 ASP 140 1HB ASP 140 -8.231 14.590 -3.888 1027 H GLU 141 H GLU 141 -10.723 13.874 -4.214 1028 HA GLU 141 HA GLU 141 -11.181 11.887 -2.059 1029 HB2 GLU 141 2HB GLU 141 -12.420 12.079 -4.841 1030 HB3 GLU 141 1HB GLU 141 -12.842 10.898 -3.599 1031 HG2 GLU 141 2HG GLU 141 -13.799 12.599 -2.187 1032 HG3 GLU 141 1HG GLU 141 -13.173 13.891 -3.212 1033 H ILE 142 H ILE 142 -11.025 9.546 -2.996 1034 HA ILE 142 HA ILE 142 -9.004 8.989 -4.956 1035 HB ILE 142 HB ILE 142 -7.521 9.851 -3.211 1036 HG12 ILE 142 2HG1 ILE 142 -6.049 7.840 -2.777 1037 HG13 ILE 142 1HG1 ILE 142 -7.337 6.806 -3.384 1038 HG21 ILE 142 1HG2 ILE 142 -8.763 7.846 -1.306 1039 HG22 ILE 142 2HG2 ILE 142 -8.949 9.598 -1.253 1040 HG23 ILE 142 3HG2 ILE 142 -7.372 8.869 -0.952 1041 HD11 ILE 142 3HD1 ILE 142 -5.588 7.181 -5.041 1042 HD12 ILE 142 1HD1 ILE 142 -5.878 8.920 -4.980 1043 HD13 ILE 142 2HD1 ILE 142 -7.131 7.833 -5.591 1044 H THR 143 H THR 143 -8.980 6.806 -5.464 1045 HA THR 143 HA THR 143 -11.193 5.177 -4.461 1046 HB THR 143 HB THR 143 -9.249 4.744 -6.778 1047 HG1 THR 143 HG1 THR 143 -11.900 5.806 -6.739 1048 HG21 THR 143 3HG2 THR 143 -11.894 3.394 -6.156 1049 HG22 THR 143 1HG2 THR 143 -10.297 2.637 -6.070 1050 HG23 THR 143 2HG2 THR 143 -10.946 3.161 -7.626 1051 H LEU 144 H LEU 144 -10.880 3.333 -3.144 1052 HA LEU 144 HA LEU 144 -8.121 2.453 -2.514 1053 HB2 LEU 144 2HB LEU 144 -10.443 3.081 -0.645 1054 HB3 LEU 144 1HB LEU 144 -9.278 1.865 -0.181 1055 HG LEU 144 HG LEU 144 -8.848 4.026 0.908 1056 HD11 LEU 144 1HD1 LEU 144 -6.648 3.228 -1.015 1057 HD12 LEU 144 2HD1 LEU 144 -6.968 2.525 0.572 1058 HD13 LEU 144 3HD1 LEU 144 -6.445 4.202 0.444 1059 HD21 LEU 144 3HD2 LEU 144 -8.071 5.978 -0.310 1060 HD22 LEU 144 1HD2 LEU 144 -9.683 5.521 -0.852 1061 HD23 LEU 144 2HD2 LEU 144 -8.278 5.140 -1.850 1062 H ASP 145 H ASP 145 -8.191 0.532 -3.755 1063 HA ASP 145 HA ASP 145 -10.066 -1.475 -2.641 1064 HB2 ASP 145 2HB ASP 145 -9.893 -2.782 -4.762 1065 HB3 ASP 145 1HB ASP 145 -10.772 -1.282 -4.869 1066 H PHE 146 H PHE 146 -9.213 -2.730 -1.441 1067 HA PHE 146 HA PHE 146 -6.505 -3.004 -0.816 1068 HB2 PHE 146 2HB PHE 146 -8.737 -4.878 0.043 1069 HB3 PHE 146 1HB PHE 146 -7.258 -4.504 0.927 1070 HD1 PHE 146 HD2 PHE 146 -7.024 -1.646 0.938 1071 HD2 PHE 146 HD1 PHE 146 -10.582 -3.977 1.183 1072 HE1 PHE 146 HE2 PHE 146 -8.182 0.227 1.997 1073 HE2 PHE 146 HE1 PHE 146 -11.742 -2.092 2.246 1074 HZ PHE 146 HZ PHE 146 -10.541 0.013 2.660 1075 H ASN 147 H ASN 147 -8.049 -4.458 -3.343 1076 HA ASN 147 HA ASN 147 -6.783 -7.031 -3.447 1077 HB2 ASN 147 2HB ASN 147 -8.241 -5.381 -5.561 1078 HB3 ASN 147 1HB ASN 147 -7.780 -7.072 -5.743 1079 HD21 ASN 147 1HD2 ASN 147 -8.987 -8.654 -4.707 1080 HD22 ASN 147 2HD2 ASN 147 -10.480 -8.321 -3.901 1081 H LEU 148 H LEU 148 -5.501 -3.969 -3.833 1082 HA LEU 148 HA LEU 148 -3.617 -4.714 -5.997 1083 HB2 LEU 148 2HB LEU 148 -3.957 -1.943 -4.800 1084 HB3 LEU 148 1HB LEU 148 -3.252 -2.379 -6.352 1085 HG LEU 148 HG LEU 148 -6.190 -2.450 -5.594 1086 HD11 LEU 148 1HD1 LEU 148 -6.544 -0.707 -7.161 1087 HD12 LEU 148 2HD1 LEU 148 -4.855 -0.751 -7.707 1088 HD13 LEU 148 3HD1 LEU 148 -5.248 -0.206 -6.072 1089 HD21 LEU 148 3HD2 LEU 148 -5.810 -4.355 -7.022 1090 HD22 LEU 148 1HD2 LEU 148 -4.927 -3.372 -8.187 1091 HD23 LEU 148 2HD2 LEU 148 -6.654 -3.114 -7.940 1092 H ALA 149 H ALA 149 -3.624 -5.359 -2.953 1093 HA ALA 149 HA ALA 149 -1.395 -3.971 -1.827 1094 HB1 ALA 149 3HB ALA 149 -3.173 -4.926 -0.407 1095 HB2 ALA 149 1HB ALA 149 -1.590 -5.568 0.045 1096 HB3 ALA 149 2HB ALA 149 -2.707 -6.553 -0.902 1097 H TYR 150 H TYR 150 0.693 -4.720 -1.411 1098 HA TYR 150 HA TYR 150 1.715 -6.902 -3.138 1099 HB2 TYR 150 2HB TYR 150 3.240 -4.404 -2.261 1100 HB3 TYR 150 1HB TYR 150 3.757 -5.606 -3.439 1101 HD1 TYR 150 HD1 TYR 150 1.623 -5.916 -5.333 1102 HD2 TYR 150 HD2 TYR 150 2.810 -2.337 -3.314 1103 HE1 TYR 150 HE1 TYR 150 0.674 -4.570 -7.152 1104 HE2 TYR 150 HE2 TYR 150 1.864 -0.989 -5.142 1105 HH TYR 150 HH TYR 150 1.254 -1.175 -7.451 1106 H SER 151 H SER 151 3.369 -8.229 -2.256 1107 HA SER 151 HA SER 151 3.392 -8.774 0.477 1108 HB2 SER 151 2HB SER 151 5.444 -9.544 -1.647 1109 HB3 SER 151 1HB SER 151 5.233 -10.339 -0.082 1110 HG SER 151 HG SER 151 4.144 -11.297 -1.991 1111 HA PRO 152 HA PRO 152 6.330 -5.744 2.013 1112 HB2 PRO 152 2HB PRO 152 6.686 -6.630 4.539 1113 HB3 PRO 152 1HB PRO 152 5.080 -6.112 3.981 1114 HG2 PRO 152 2HG PRO 152 6.153 -8.905 4.255 1115 HG3 PRO 152 1HG PRO 152 4.563 -8.267 4.727 1116 HD2 PRO 152 2HD PRO 152 5.054 -9.636 2.356 1117 HD3 PRO 152 1HD PRO 152 3.703 -8.505 2.591 1118 H PHE 153 H PHE 153 8.472 -5.518 1.551 1119 HA PHE 153 HA PHE 153 10.453 -7.302 1.227 1120 HB2 PHE 153 2HB PHE 153 10.848 -4.557 2.512 1121 HB3 PHE 153 1HB PHE 153 12.021 -5.441 1.544 1122 HD1 PHE 153 HD2 PHE 153 11.759 -5.576 -0.929 1123 HD2 PHE 153 HD1 PHE 153 9.037 -3.289 1.451 1124 HE1 PHE 153 HE2 PHE 153 10.924 -4.458 -2.945 1125 HE2 PHE 153 HE1 PHE 153 8.209 -2.172 -0.579 1126 HZ PHE 153 HZ PHE 153 9.153 -2.757 -2.777 1127 H CYS 154 H CYS 154 9.505 -5.804 4.277 1128 HA CYS 154 HA CYS 154 11.655 -6.547 5.889 1129 HB2 CYS 154 2HB CYS 154 10.144 -5.894 7.744 1130 HB3 CYS 154 1HB CYS 154 10.128 -4.732 6.418 1131 HG CYS 154 HG CYS 154 7.652 -5.127 5.585 1132 H ALA 155 H ALA 155 8.453 -8.129 5.557 1133 HA ALA 155 HA ALA 155 8.644 -9.952 7.648 1134 HB1 ALA 155 3HB ALA 155 7.195 -10.342 5.017 1135 HB2 ALA 155 1HB ALA 155 6.575 -9.477 6.426 1136 HB3 ALA 155 2HB ALA 155 6.870 -11.214 6.522 1137 H TYR 156 H TYR 156 9.882 -10.237 4.363 1138 HA TYR 156 HA TYR 156 10.612 -13.058 4.779 1139 HB2 TYR 156 2HB TYR 156 10.583 -11.340 2.264 1140 HB3 TYR 156 1HB TYR 156 11.054 -13.038 2.310 1141 HD1 TYR 156 HD1 TYR 156 8.193 -10.698 2.566 1142 HD2 TYR 156 HD2 TYR 156 9.364 -14.817 2.620 1143 HE1 TYR 156 HE1 TYR 156 5.840 -11.369 2.332 1144 HE2 TYR 156 HE2 TYR 156 7.009 -15.482 2.383 1145 HH TYR 156 HH TYR 156 4.792 -14.561 2.845 1146 H SER 157 H SER 157 12.119 -9.968 4.941 1147 HA SER 157 HA SER 157 14.717 -11.313 5.309 1148 HB2 SER 157 2HB SER 157 14.243 -8.875 3.548 1149 HB3 SER 157 1HB SER 157 15.835 -9.311 4.172 1150 HG SER 157 HG SER 157 14.301 -11.213 2.793 1151 H ASP 158 H ASP 158 15.325 -10.938 7.299 1152 HA ASP 158 HA ASP 158 14.283 -8.966 9.059 1153 HB2 ASP 158 2HB ASP 158 16.820 -10.628 9.421 1154 HB3 ASP 158 1HB ASP 158 15.924 -9.803 10.694 1155 H THR 159 H THR 159 16.870 -8.901 6.785 1156 HA THR 159 HA THR 159 18.392 -6.731 7.886 1157 HB THR 159 HB THR 159 19.434 -8.307 6.303 1158 HG1 THR 159 HG1 THR 159 19.344 -5.698 5.143 1159 HG21 THR 159 3HG2 THR 159 17.510 -8.738 4.805 1160 HG22 THR 159 1HG2 THR 159 18.950 -8.266 3.898 1161 HG23 THR 159 2HG2 THR 159 17.651 -7.100 4.162 1162 H PHE 160 H PHE 160 15.281 -6.744 6.736 1163 HA PHE 160 HA PHE 160 15.302 -3.801 6.362 1164 HB2 PHE 160 2HB PHE 160 13.205 -5.828 5.401 1165 HB3 PHE 160 1HB PHE 160 13.078 -4.086 5.240 1166 HD1 PHE 160 HD2 PHE 160 15.228 -6.974 4.171 1167 HD2 PHE 160 HD1 PHE 160 13.739 -3.088 3.219 1168 HE1 PHE 160 HE2 PHE 160 16.186 -7.161 1.911 1169 HE2 PHE 160 HE1 PHE 160 14.686 -3.292 0.965 1170 HZ PHE 160 HZ PHE 160 15.908 -5.318 0.301 1171 H SER 161 H SER 161 14.494 -2.855 8.243 1172 HA SER 161 HA SER 161 13.164 -4.398 10.293 1173 HB2 SER 161 2HB SER 161 13.430 -1.362 10.093 1174 HB3 SER 161 1HB SER 161 13.029 -2.293 11.539 1175 HG SER 161 HG SER 161 15.172 -3.356 11.075 1176 H CYS 162 H CYS 162 10.951 -4.325 10.878 1177 HA CYS 162 HA CYS 162 9.185 -4.115 8.647 1178 HB2 CYS 162 2HB CYS 162 8.645 -4.806 11.560 1179 HB3 CYS 162 1HB CYS 162 7.473 -4.979 10.249 1180 HG CYS 162 HG CYS 162 10.313 -6.506 9.500 1181 HA PRO 163 HA PRO 163 7.488 -0.006 9.439 1182 HB2 PRO 163 2HB PRO 163 5.155 -0.167 8.047 1183 HB3 PRO 163 1HB PRO 163 6.725 -0.183 7.213 1184 HG2 PRO 163 2HG PRO 163 4.963 -2.513 7.934 1185 HG3 PRO 163 1HG PRO 163 5.768 -2.152 6.386 1186 HD2 PRO 163 2HD PRO 163 6.829 -3.892 8.188 1187 HD3 PRO 163 1HD PRO 163 7.845 -2.889 7.130 1188 H LEU 164 H LEU 164 5.965 1.005 10.875 1189 HA LEU 164 HA LEU 164 4.306 -0.820 12.487 1190 HB2 LEU 164 2HB LEU 164 4.222 0.993 14.145 1191 HB3 LEU 164 1HB LEU 164 5.860 0.511 13.778 1192 HG LEU 164 HG LEU 164 5.645 2.678 12.100 1193 HD11 LEU 164 1HD1 LEU 164 3.373 3.263 12.797 1194 HD12 LEU 164 2HD1 LEU 164 4.509 4.532 13.244 1195 HD13 LEU 164 3HD1 LEU 164 3.902 3.420 14.474 1196 HD21 LEU 164 3HD2 LEU 164 7.464 2.309 13.690 1197 HD22 LEU 164 1HD2 LEU 164 6.433 2.841 15.023 1198 HD23 LEU 164 2HD2 LEU 164 6.895 3.975 13.749 1199 HA PRO 165 HA PRO 165 0.836 1.154 10.272 1200 HB2 PRO 165 2HB PRO 165 -1.129 -0.581 11.010 1201 HB3 PRO 165 1HB PRO 165 0.091 -1.025 9.799 1202 HG2 PRO 165 2HG PRO 165 -0.073 -1.820 12.680 1203 HG3 PRO 165 1HG PRO 165 0.442 -2.777 11.275 1204 HD2 PRO 165 2HD PRO 165 2.188 -1.520 13.071 1205 HD3 PRO 165 1HD PRO 165 2.623 -2.045 11.432 1206 HA PRO 166 HA PRO 166 -0.324 3.625 13.992 1207 HB2 PRO 166 2HB PRO 166 -2.068 5.330 12.610 1208 HB3 PRO 166 1HB PRO 166 -0.312 5.574 12.703 1209 HG2 PRO 166 2HG PRO 166 -1.922 4.307 10.505 1210 HG3 PRO 166 1HG PRO 166 -0.571 5.460 10.385 1211 HD2 PRO 166 2HD PRO 166 -0.175 2.841 9.948 1212 HD3 PRO 166 1HD PRO 166 1.052 3.806 10.805 1213 H GLU 167 H GLU 167 -2.019 3.239 15.406 1214 HA GLU 167 HA GLU 167 -3.544 0.950 14.963 1215 HB2 GLU 167 2HB GLU 167 -3.889 3.028 17.158 1216 HB3 GLU 167 1HB GLU 167 -4.583 1.405 17.175 1217 HG2 GLU 167 2HG GLU 167 -2.274 0.452 17.089 1218 HG3 GLU 167 1HG GLU 167 -1.624 2.088 17.180 1219 H SER 168 H SER 168 -4.371 4.177 14.129 1220 HA SER 168 HA SER 168 -7.220 3.933 14.115 1221 HB2 SER 168 2HB SER 168 -5.486 5.869 12.537 1222 HB3 SER 168 1HB SER 168 -7.193 6.068 12.947 1223 HG SER 168 HG SER 168 -5.144 6.871 14.326 1224 H ASN 169 H ASN 169 -4.835 2.674 11.966 1225 HA ASN 169 HA ASN 169 -6.517 2.770 9.565 1226 HB2 ASN 169 2HB ASN 169 -4.598 2.249 8.283 1227 HB3 ASN 169 1HB ASN 169 -3.993 3.343 9.514 1228 HD21 ASN 169 1HD2 ASN 169 -2.341 1.742 8.035 1229 HD22 ASN 169 2HD2 ASN 169 -1.621 0.543 9.040 1230 H TRP 170 H TRP 170 -6.595 0.939 12.129 1231 HA TRP 170 HA TRP 170 -6.351 -1.733 11.064 1232 HB2 TRP 170 2HB TRP 170 -7.400 -0.706 13.740 1233 HB3 TRP 170 1HB TRP 170 -7.290 -2.416 13.325 1234 HD1 TRP 170 HD1 TRP 170 -4.302 -0.612 12.022 1235 HE1 TRP 170 HE1 TRP 170 -2.273 -0.971 13.545 1236 HE3 TRP 170 HE3 TRP 170 -6.679 -2.644 16.064 1237 HZ2 TRP 170 HZ2 TRP 170 -1.729 -1.985 16.108 1238 HZ3 TRP 170 HZ3 TRP 170 -5.323 -3.285 18.015 1239 HH2 TRP 170 HH2 TRP 170 -2.900 -2.962 18.039 1240 H LEU 171 H LEU 171 -7.821 -2.427 9.682 1241 HA LEU 171 HA LEU 171 -10.571 -1.521 9.577 1242 HB2 LEU 171 2HB LEU 171 -9.195 -3.724 7.966 1243 HB3 LEU 171 1HB LEU 171 -10.718 -2.934 7.579 1244 HG LEU 171 HG LEU 171 -7.954 -1.646 7.478 1245 HD11 LEU 171 1HD1 LEU 171 -8.324 -3.212 5.635 1246 HD12 LEU 171 2HD1 LEU 171 -8.268 -1.548 5.062 1247 HD13 LEU 171 3HD1 LEU 171 -9.821 -2.378 5.204 1248 HD21 LEU 171 3HD2 LEU 171 -9.583 0.024 8.149 1249 HD22 LEU 171 1HD2 LEU 171 -10.660 -0.434 6.826 1250 HD23 LEU 171 2HD2 LEU 171 -9.097 0.316 6.482 1251 H GLU 172 H GLU 172 -11.920 -2.429 11.131 1252 HA GLU 172 HA GLU 172 -11.293 -5.007 12.302 1253 HB2 GLU 172 2HB GLU 172 -12.168 -3.029 13.644 1254 HB3 GLU 172 1HB GLU 172 -13.734 -3.269 12.873 1255 HG2 GLU 172 2HG GLU 172 -13.819 -5.575 13.827 1256 HG3 GLU 172 1HG GLU 172 -12.279 -5.279 14.631 1257 H THR 173 H THR 173 -11.547 -5.657 9.850 1258 HA THR 173 HA THR 173 -13.896 -7.338 9.696 1259 HB THR 173 HB THR 173 -14.674 -5.303 8.519 1260 HG1 THR 173 HG1 THR 173 -15.554 -7.029 7.582 1261 HG21 THR 173 3HG2 THR 173 -12.495 -4.377 7.791 1262 HG22 THR 173 1HG2 THR 173 -13.620 -4.518 6.433 1263 HG23 THR 173 2HG2 THR 173 -12.323 -5.696 6.632 1264 H ALA 174 H ALA 174 -13.573 -9.096 8.283 1265 HA ALA 174 HA ALA 174 -10.822 -9.906 7.924 1266 HB1 ALA 174 3HB ALA 174 -13.429 -11.285 7.195 1267 HB2 ALA 174 1HB ALA 174 -12.496 -11.526 8.673 1268 HB3 ALA 174 2HB ALA 174 -11.827 -12.027 7.118 1269 H VAL 175 H VAL 175 -9.928 -8.575 6.357 1270 HA VAL 175 HA VAL 175 -11.286 -7.976 3.871 1271 HB VAL 175 HB VAL 175 -8.415 -7.324 4.688 1272 HG11 VAL 175 1HG1 VAL 175 -8.667 -7.318 2.234 1273 HG12 VAL 175 2HG1 VAL 175 -8.468 -5.670 2.831 1274 HG13 VAL 175 3HG1 VAL 175 -10.068 -6.250 2.361 1275 HG21 VAL 175 3HG2 VAL 175 -10.060 -6.244 6.170 1276 HG22 VAL 175 1HG2 VAL 175 -10.915 -5.587 4.771 1277 HG23 VAL 175 2HG2 VAL 175 -9.277 -5.041 5.142 1278 H THR 176 H THR 176 -11.611 -9.909 2.880 1279 HA THR 176 HA THR 176 -9.365 -11.637 2.123 1280 HB THR 176 HB THR 176 -11.179 -13.097 1.149 1281 HG1 THR 176 HG1 THR 176 -12.822 -11.698 0.695 1282 HG21 THR 176 3HG2 THR 176 -10.430 -13.482 3.480 1283 HG22 THR 176 1HG2 THR 176 -12.154 -13.826 3.307 1284 HG23 THR 176 2HG2 THR 176 -11.626 -12.322 4.063 1285 H ALA 177 H ALA 177 -8.237 -10.439 0.664 1286 HA ALA 177 HA ALA 177 -9.491 -9.699 -1.900 1287 HB1 ALA 177 3HB ALA 177 -8.452 -7.447 -1.818 1288 HB2 ALA 177 1HB ALA 177 -7.902 -7.761 -0.168 1289 HB3 ALA 177 2HB ALA 177 -9.632 -7.669 -0.523 1290 H GLY 178 H GLY 178 -8.175 -10.016 -3.589 1291 HA2 GLY 178 2HA GLY 178 -6.455 -10.835 -4.840 1292 HA3 GLY 178 1HA GLY 178 -5.383 -10.174 -3.622 1293 H GLU 179 H GLU 179 -3.978 -11.928 -3.884 1294 HA GLU 179 HA GLU 179 -4.777 -14.623 -3.134 1295 HB2 GLU 179 2HB GLU 179 -1.999 -13.435 -3.635 1296 HB3 GLU 179 1HB GLU 179 -2.363 -15.151 -3.442 1297 HG2 GLU 179 2HG GLU 179 -3.682 -15.136 -5.509 1298 HG3 GLU 179 1HG GLU 179 -3.428 -13.399 -5.681 1299 H ARG 180 H ARG 180 -4.078 -15.654 -1.197 1300 HA ARG 180 HA ARG 180 -3.623 -13.919 1.120 1301 HB2 ARG 180 2HB ARG 180 -4.101 -15.880 2.458 1302 HB3 ARG 180 1HB ARG 180 -5.275 -15.857 1.148 1303 HG2 ARG 180 2HG ARG 180 -3.786 -17.524 -0.066 1304 HG3 ARG 180 1HG ARG 180 -2.839 -17.643 1.416 1305 HD2 ARG 180 2HD ARG 180 -4.302 -19.475 1.518 1306 HD3 ARG 180 1HD ARG 180 -5.064 -18.276 2.562 1307 HE ARG 180 HE ARG 180 -6.716 -17.893 0.899 1308 HH11 ARG 180 1HH1 ARG 180 -4.530 -20.522 0.023 1309 HH12 ARG 180 2HH1 ARG 180 -5.612 -21.179 -1.163 1310 HH21 ARG 180 1HH2 ARG 180 -8.116 -18.774 -0.670 1311 HH22 ARG 180 2HH2 ARG 180 -7.643 -20.187 -1.558 1312 H THR 181 H THR 181 -1.988 -15.549 2.703 1313 HA THR 181 HA THR 181 0.481 -16.053 1.147 1314 HB THR 181 HB THR 181 0.316 -15.033 4.030 1315 HG1 THR 181 HG1 THR 181 0.464 -13.743 1.587 1316 HG21 THR 181 3HG2 THR 181 2.313 -16.444 3.630 1317 HG22 THR 181 1HG2 THR 181 2.762 -14.751 3.858 1318 HG23 THR 181 2HG2 THR 181 2.739 -15.446 2.236 1319 H ASP 182 H ASP 182 0.273 -18.261 0.925 1320 HA ASP 182 HA ASP 182 -0.910 -19.959 2.881 1321 HB2 ASP 182 2HB ASP 182 0.708 -20.751 0.418 1322 HB3 ASP 182 1HB ASP 182 -0.448 -21.756 1.287 1323 H LEU 183 H LEU 183 0.598 -19.245 4.628 1324 HA LEU 183 HA LEU 183 3.278 -20.396 4.640 1325 HB2 LEU 183 2HB LEU 183 3.690 -19.220 6.660 1326 HB3 LEU 183 1HB LEU 183 2.795 -18.117 5.636 1327 HG LEU 183 HG LEU 183 1.594 -19.647 7.996 1328 HD11 LEU 183 1HD1 LEU 183 3.252 -18.011 8.760 1329 HD12 LEU 183 2HD1 LEU 183 1.622 -17.519 9.206 1330 HD13 LEU 183 3HD1 LEU 183 2.436 -16.733 7.850 1331 HD21 LEU 183 3HD2 LEU 183 0.377 -17.387 6.360 1332 HD22 LEU 183 1HD2 LEU 183 -0.345 -18.151 7.783 1333 HD23 LEU 183 2HD2 LEU 183 -0.112 -19.082 6.306 1334 H GLU 184 H GLU 184 0.111 -21.163 5.770 1335 HA GLU 184 HA GLU 184 1.016 -23.166 7.712 1336 HB2 GLU 184 2HB GLU 184 -1.674 -23.482 7.838 1337 HB3 GLU 184 1HB GLU 184 -0.820 -22.226 8.715 1338 HG2 GLU 184 2HG GLU 184 -2.836 -21.326 7.722 1339 HG3 GLU 184 1HG GLU 184 -1.415 -20.583 6.996 1340 H HIS 185 H HIS 185 -0.378 -23.037 4.482 1341 HA HIS 185 HA HIS 185 -0.261 -25.988 4.264 1342 HB2 HIS 185 2HB HIS 185 -1.799 -23.869 2.731 1343 HB3 HIS 185 1HB HIS 185 -1.414 -25.394 1.945 1344 HD1 HIS 185 HD1 HIS 185 -3.986 -23.855 3.927 1345 HD2 HIS 185 HD2 HIS 185 -2.445 -27.695 3.554 1346 HE1 HIS 185 HE1 HIS 185 -5.773 -25.392 4.796 1347 HE2 HIS 185 HE2 HIS 185 -4.872 -27.709 4.407 Start of MODEL 19 1 H1 MET 1 1H MET 1 -19.834 5.143 -16.972 2 H2 MET 1 2H MET 1 -19.978 6.800 -16.690 3 H3 MET 1 3H MET 1 -18.791 5.910 -15.888 4 HA MET 1 HA MET 1 -18.927 6.256 -18.810 5 HB2 MET 1 2HB MET 1 -18.508 8.425 -17.656 6 HB3 MET 1 1HB MET 1 -17.154 7.703 -16.792 7 HG2 MET 1 2HG MET 1 -16.404 9.087 -18.683 8 HG3 MET 1 1HG MET 1 -15.941 7.398 -18.889 9 HE1 MET 1 3HE MET 1 -19.311 9.512 -21.279 10 HE2 MET 1 1HE MET 1 -18.244 10.335 -20.139 11 HE3 MET 1 2HE MET 1 -19.464 9.205 -19.550 12 H ASP 2 H ASP 2 -17.503 4.989 -19.909 13 HA ASP 2 HA ASP 2 -16.783 2.566 -18.699 14 HB2 ASP 2 2HB ASP 2 -15.724 3.577 -21.383 15 HB3 ASP 2 1HB ASP 2 -15.817 1.900 -20.840 16 H GLU 3 H GLU 3 -14.553 4.930 -20.237 17 HA GLU 3 HA GLU 3 -12.175 3.802 -19.459 18 HB2 GLU 3 2HB GLU 3 -12.808 6.716 -20.054 19 HB3 GLU 3 1HB GLU 3 -11.168 6.123 -19.789 20 HG2 GLU 3 2HG GLU 3 -11.364 4.625 -21.714 21 HG3 GLU 3 1HG GLU 3 -13.030 5.138 -21.968 22 H ASP 4 H ASP 4 -13.970 6.370 -17.776 23 HA ASP 4 HA ASP 4 -12.306 7.086 -15.728 24 HB2 ASP 4 2HB ASP 4 -14.481 8.170 -16.110 25 HB3 ASP 4 1HB ASP 4 -15.335 6.730 -15.574 26 H THR 5 H THR 5 -14.469 4.301 -15.773 27 HA THR 5 HA THR 5 -13.817 3.325 -13.160 28 HB THR 5 HB THR 5 -15.225 1.967 -15.505 29 HG1 THR 5 HG1 THR 5 -15.993 3.989 -13.842 30 HG21 THR 5 3HG2 THR 5 -15.354 1.308 -12.541 31 HG22 THR 5 1HG2 THR 5 -14.538 0.345 -13.772 32 HG23 THR 5 2HG2 THR 5 -16.293 0.532 -13.821 33 H GLU 6 H GLU 6 -12.904 2.349 -16.529 34 HA GLU 6 HA GLU 6 -11.391 0.048 -15.567 35 HB2 GLU 6 2HB GLU 6 -11.191 -0.617 -17.867 36 HB3 GLU 6 1HB GLU 6 -12.836 -0.040 -17.630 37 HG2 GLU 6 2HG GLU 6 -12.191 2.137 -18.653 38 HG3 GLU 6 1HG GLU 6 -10.576 1.502 -18.945 39 H ASP 7 H ASP 7 -10.580 3.231 -15.770 40 HA ASP 7 HA ASP 7 -7.992 3.316 -16.954 41 HB2 ASP 7 2HB ASP 7 -9.144 4.935 -14.638 42 HB3 ASP 7 1HB ASP 7 -7.508 5.209 -15.232 43 H TRP 8 H TRP 8 -9.118 2.487 -13.795 44 HA TRP 8 HA TRP 8 -6.943 1.864 -12.286 45 HB2 TRP 8 2HB TRP 8 -9.261 1.813 -11.510 46 HB3 TRP 8 1HB TRP 8 -9.628 0.454 -12.565 47 HD1 TRP 8 HD1 TRP 8 -7.117 1.117 -9.650 48 HE1 TRP 8 HE1 TRP 8 -7.157 -0.932 -8.127 49 HE3 TRP 8 HE3 TRP 8 -10.428 -1.793 -12.255 50 HZ2 TRP 8 HZ2 TRP 8 -8.399 -3.452 -8.026 51 HZ3 TRP 8 HZ3 TRP 8 -10.996 -4.017 -11.363 52 HH2 TRP 8 HH2 TRP 8 -9.999 -4.827 -9.287 53 H GLU 9 H GLU 9 -8.530 -0.255 -14.707 54 HA GLU 9 HA GLU 9 -6.686 -2.459 -14.273 55 HB2 GLU 9 2HB GLU 9 -9.073 -2.869 -14.691 56 HB3 GLU 9 1HB GLU 9 -8.956 -2.094 -16.268 57 HG2 GLU 9 2HG GLU 9 -7.377 -3.883 -16.988 58 HG3 GLU 9 1HG GLU 9 -7.590 -4.670 -15.423 59 H THR 10 H THR 10 -7.158 0.114 -16.586 60 HA THR 10 HA THR 10 -5.638 -0.845 -18.765 61 HB THR 10 HB THR 10 -6.241 2.034 -17.941 62 HG1 THR 10 HG1 THR 10 -8.182 1.550 -18.554 63 HG21 THR 10 3HG2 THR 10 -5.444 0.929 -20.671 64 HG22 THR 10 1HG2 THR 10 -4.455 1.981 -19.653 65 HG23 THR 10 2HG2 THR 10 -5.959 2.587 -20.351 66 H GLN 11 H GLN 11 -4.764 1.338 -16.051 67 HA GLN 11 HA GLN 11 -1.986 1.364 -16.600 68 HB2 GLN 11 2HB GLN 11 -1.690 2.323 -14.399 69 HB3 GLN 11 1HB GLN 11 -3.127 3.023 -15.134 70 HG2 GLN 11 2HG GLN 11 -4.578 1.739 -13.728 71 HG3 GLN 11 1HG GLN 11 -3.244 0.765 -13.125 72 HE21 GLN 11 1HE2 GLN 11 -4.857 3.853 -12.921 73 HE22 GLN 11 2HE2 GLN 11 -4.056 4.389 -11.487 74 H LEU 12 H LEU 12 -4.076 -0.940 -14.937 75 HA LEU 12 HA LEU 12 -2.111 -2.013 -13.172 76 HB2 LEU 12 2HB LEU 12 -4.481 -1.942 -12.637 77 HB3 LEU 12 1HB LEU 12 -4.847 -3.012 -13.977 78 HG LEU 12 HG LEU 12 -3.661 -4.859 -12.832 79 HD11 LEU 12 1HD1 LEU 12 -1.988 -3.627 -11.567 80 HD12 LEU 12 2HD1 LEU 12 -2.940 -4.637 -10.484 81 HD13 LEU 12 3HD1 LEU 12 -3.237 -2.898 -10.555 82 HD21 LEU 12 3HD2 LEU 12 -5.781 -3.522 -11.120 83 HD22 LEU 12 1HD2 LEU 12 -5.325 -5.228 -11.068 84 HD23 LEU 12 2HD2 LEU 12 -6.075 -4.563 -12.516 85 H GLN 13 H GLN 13 -3.269 -2.996 -16.386 86 HA GLN 13 HA GLN 13 -1.989 -5.518 -16.483 87 HB2 GLN 13 2HB GLN 13 -2.265 -5.386 -18.908 88 HB3 GLN 13 1HB GLN 13 -3.710 -4.785 -18.110 89 HG2 GLN 13 2HG GLN 13 -2.928 -2.454 -18.533 90 HG3 GLN 13 1HG GLN 13 -1.555 -3.112 -19.421 91 HE21 GLN 13 1HE2 GLN 13 -4.906 -4.312 -19.525 92 HE22 GLN 13 2HE2 GLN 13 -5.171 -3.929 -21.186 93 H ALA 14 H ALA 14 -0.757 -2.282 -16.697 94 HA ALA 14 HA ALA 14 1.944 -3.093 -17.490 95 HB1 ALA 14 3HB ALA 14 0.981 -0.980 -18.331 96 HB2 ALA 14 1HB ALA 14 2.444 -0.692 -17.387 97 HB3 ALA 14 2HB ALA 14 0.855 -0.377 -16.677 98 H ASN 15 H ASN 15 0.161 -2.014 -14.594 99 HA ASN 15 HA ASN 15 2.273 -1.607 -12.807 100 HB2 ASN 15 2HB ASN 15 -0.606 -2.433 -12.271 101 HB3 ASN 15 1HB ASN 15 0.539 -2.113 -10.972 102 HD21 ASN 15 1HD2 ASN 15 -0.834 -0.446 -10.249 103 HD22 ASN 15 2HD2 ASN 15 -0.912 1.087 -11.037 104 H ARG 16 H ARG 16 0.466 -4.574 -13.527 105 HA ARG 16 HA ARG 16 1.604 -6.231 -11.567 106 HB2 ARG 16 2HB ARG 16 0.877 -8.137 -12.942 107 HB3 ARG 16 1HB ARG 16 -0.375 -6.904 -12.856 108 HG2 ARG 16 2HG ARG 16 0.084 -6.174 -15.114 109 HG3 ARG 16 1HG ARG 16 1.510 -7.214 -15.209 110 HD2 ARG 16 2HD ARG 16 -0.408 -8.175 -16.415 111 HD3 ARG 16 1HD ARG 16 0.114 -9.208 -15.084 112 HE ARG 16 HE ARG 16 -2.235 -7.405 -14.924 113 HH11 ARG 16 1HH1 ARG 16 -0.794 -10.566 -14.313 114 HH12 ARG 16 2HH1 ARG 16 -2.211 -11.180 -13.525 115 HH21 ARG 16 1HH2 ARG 16 -4.051 -8.208 -13.854 116 HH22 ARG 16 2HH2 ARG 16 -4.063 -9.841 -13.264 117 H ASP 17 H ASP 17 2.787 -5.220 -14.710 118 HA ASP 17 HA ASP 17 4.859 -7.180 -14.977 119 HB2 ASP 17 2HB ASP 17 3.722 -6.073 -16.911 120 HB3 ASP 17 1HB ASP 17 4.461 -4.542 -16.461 121 H GLU 18 H GLU 18 4.829 -3.665 -14.248 122 HA GLU 18 HA GLU 18 7.604 -3.362 -13.921 123 HB2 GLU 18 2HB GLU 18 7.054 -1.178 -12.865 124 HB3 GLU 18 1HB GLU 18 6.170 -1.439 -14.366 125 HG2 GLU 18 2HG GLU 18 4.144 -1.984 -13.157 126 HG3 GLU 18 1HG GLU 18 4.995 -1.946 -11.618 127 H LYS 19 H LYS 19 5.083 -4.233 -11.571 128 HA LYS 19 HA LYS 19 6.830 -4.006 -9.273 129 HB2 LYS 19 2HB LYS 19 4.132 -5.402 -9.488 130 HB3 LYS 19 1HB LYS 19 4.973 -5.012 -7.991 131 HG2 LYS 19 2HG LYS 19 3.813 -3.043 -9.982 132 HG3 LYS 19 1HG LYS 19 3.167 -3.431 -8.387 133 HD2 LYS 19 2HD LYS 19 5.183 -2.450 -7.336 134 HD3 LYS 19 1HD LYS 19 5.844 -2.088 -8.935 135 HE2 LYS 19 2HE LYS 19 3.850 -0.630 -9.368 136 HE3 LYS 19 1HE LYS 19 3.323 -0.919 -7.709 137 HZ1 LYS 19 3HZ LYS 19 5.357 0.127 -6.924 138 HZ2 LYS 19 1HZ LYS 19 4.486 1.177 -7.923 139 HZ3 LYS 19 2HZ LYS 19 5.865 0.392 -8.517 140 H ASP 20 H ASP 20 5.885 -6.510 -11.507 141 HA ASP 20 HA ASP 20 6.876 -8.767 -10.082 142 HB2 ASP 20 2HB ASP 20 5.234 -8.920 -11.960 143 HB3 ASP 20 1HB ASP 20 6.490 -8.442 -13.090 144 H ARG 21 H ARG 21 8.322 -6.485 -12.376 145 HA ARG 21 HA ARG 21 10.889 -7.899 -12.341 146 HB2 ARG 21 2HB ARG 21 11.641 -6.263 -14.028 147 HB3 ARG 21 1HB ARG 21 10.197 -7.125 -14.518 148 HG2 ARG 21 2HG ARG 21 9.838 -4.939 -15.269 149 HG3 ARG 21 1HG ARG 21 8.888 -5.032 -13.793 150 HD2 ARG 21 2HD ARG 21 10.095 -2.884 -14.012 151 HD3 ARG 21 1HD ARG 21 10.594 -3.780 -12.576 152 HE ARG 21 HE ARG 21 12.330 -4.335 -14.768 153 HH11 ARG 21 1HH1 ARG 21 11.637 -1.805 -12.392 154 HH12 ARG 21 2HH1 ARG 21 13.250 -1.158 -12.443 155 HH21 ARG 21 1HH2 ARG 21 14.421 -3.457 -14.834 156 HH22 ARG 21 2HH2 ARG 21 14.832 -2.095 -13.833 157 H PHE 22 H PHE 22 9.375 -5.214 -10.738 158 HA PHE 22 HA PHE 22 11.521 -3.766 -9.717 159 HB2 PHE 22 2HB PHE 22 9.077 -3.290 -9.320 160 HB3 PHE 22 1HB PHE 22 9.004 -4.642 -8.204 161 HD1 PHE 22 HD2 PHE 22 10.189 -4.484 -5.981 162 HD2 PHE 22 HD1 PHE 22 9.936 -1.138 -8.630 163 HE1 PHE 22 HE2 PHE 22 10.734 -2.973 -4.122 164 HE2 PHE 22 HE1 PHE 22 10.482 0.365 -6.761 165 HZ PHE 22 HZ PHE 22 10.882 -0.552 -4.510 166 H PHE 23 H PHE 23 9.985 -6.656 -8.334 167 HA PHE 23 HA PHE 23 11.882 -7.061 -6.233 168 HB2 PHE 23 2HB PHE 23 9.645 -8.781 -7.379 169 HB3 PHE 23 1HB PHE 23 10.646 -9.314 -6.033 170 HD1 PHE 23 HD2 PHE 23 8.830 -6.088 -6.875 171 HD2 PHE 23 HD1 PHE 23 9.511 -9.162 -3.990 172 HE1 PHE 23 HE2 PHE 23 7.334 -4.941 -5.288 173 HE2 PHE 23 HE1 PHE 23 8.020 -8.007 -2.412 174 HZ PHE 23 HZ PHE 23 6.944 -5.896 -3.050 175 H SER 24 H SER 24 12.132 -7.671 -9.540 176 HA SER 24 HA SER 24 13.976 -9.953 -9.266 177 HB2 SER 24 2HB SER 24 12.689 -8.779 -11.764 178 HB3 SER 24 1HB SER 24 13.669 -10.248 -11.696 179 HG SER 24 HG SER 24 11.674 -10.383 -9.892 180 H GLU 25 H GLU 25 13.954 -6.487 -10.097 181 HA GLU 25 HA GLU 25 16.700 -6.689 -11.182 182 HB2 GLU 25 2HB GLU 25 14.461 -4.895 -12.230 183 HB3 GLU 25 1HB GLU 25 16.133 -4.867 -12.784 184 HG2 GLU 25 2HG GLU 25 15.853 -7.217 -13.607 185 HG3 GLU 25 1HG GLU 25 14.159 -7.143 -13.113 186 H HIS 26 H HIS 26 14.240 -4.423 -9.854 187 HA HIS 26 HA HIS 26 16.098 -2.321 -9.268 188 HB2 HIS 26 2HB HIS 26 13.767 -1.701 -9.589 189 HB3 HIS 26 1HB HIS 26 13.226 -2.829 -8.348 190 HD2 HIS 26 HD2 HIS 26 14.655 0.771 -8.654 191 HE1 HIS 26 HE1 HIS 26 13.940 -0.049 -4.564 192 HE2 HIS 26 HE2 HIS 26 14.706 1.701 -6.226 193 H ARG 27 H ARG 27 14.151 -4.333 -7.102 194 HA ARG 27 HA ARG 27 16.242 -4.426 -5.058 195 HB2 ARG 27 2HB ARG 27 13.283 -5.124 -5.125 196 HB3 ARG 27 1HB ARG 27 14.307 -5.779 -3.857 197 HG2 ARG 27 2HG ARG 27 13.819 -2.836 -4.390 198 HG3 ARG 27 1HG ARG 27 13.083 -3.799 -3.105 199 HD2 ARG 27 2HD ARG 27 16.021 -3.109 -3.413 200 HD3 ARG 27 1HD ARG 27 14.915 -2.521 -2.170 201 HE ARG 27 HE ARG 27 15.067 -5.364 -2.113 202 HH11 ARG 27 1HH1 ARG 27 16.880 -2.506 -1.136 203 HH12 ARG 27 2HH1 ARG 27 17.710 -3.340 0.145 204 HH21 ARG 27 1HH2 ARG 27 16.235 -6.430 -0.464 205 HH22 ARG 27 2HH2 ARG 27 17.348 -5.537 0.521 206 H GLN 28 H GLN 28 17.212 -6.377 -4.480 207 HA GLN 28 HA GLN 28 16.878 -8.802 -5.971 208 HB2 GLN 28 2HB GLN 28 18.060 -9.866 -3.992 209 HB3 GLN 28 1HB GLN 28 18.936 -8.527 -4.721 210 HG2 GLN 28 2HG GLN 28 18.203 -7.032 -2.924 211 HG3 GLN 28 1HG GLN 28 17.265 -8.337 -2.195 212 HE21 GLN 28 1HE2 GLN 28 19.596 -6.708 -1.229 213 HE22 GLN 28 2HE2 GLN 28 20.751 -7.884 -0.703 214 H SER 29 H SER 29 15.745 -10.696 -5.300 215 HA SER 29 HA SER 29 13.107 -10.359 -4.510 216 HB2 SER 29 2HB SER 29 14.734 -12.935 -4.311 217 HB3 SER 29 1HB SER 29 12.974 -12.817 -4.422 218 HG SER 29 HG SER 29 13.722 -11.486 -6.457 219 HA PRO 30 HA PRO 30 13.585 -10.274 0.073 220 HB2 PRO 30 2HB PRO 30 11.054 -9.492 0.666 221 HB3 PRO 30 1HB PRO 30 12.234 -8.345 -0.004 222 HG2 PRO 30 2HG PRO 30 10.056 -9.834 -1.428 223 HG3 PRO 30 1HG PRO 30 10.521 -8.124 -1.557 224 HD2 PRO 30 2HD PRO 30 11.323 -10.005 -3.371 225 HD3 PRO 30 1HD PRO 30 12.286 -8.563 -2.982 226 H ILE 31 H ILE 31 11.590 -12.183 -1.995 227 HA ILE 31 HA ILE 31 10.398 -14.027 -0.347 228 HB ILE 31 HB ILE 31 11.966 -14.664 -2.898 229 HG12 ILE 31 2HG1 ILE 31 10.350 -12.857 -3.327 230 HG13 ILE 31 1HG1 ILE 31 9.836 -14.332 -4.133 231 HG21 ILE 31 1HG2 ILE 31 11.372 -16.711 -1.692 232 HG22 ILE 31 2HG2 ILE 31 10.409 -16.582 -3.163 233 HG23 ILE 31 3HG2 ILE 31 9.685 -16.201 -1.601 234 HD11 ILE 31 3HD1 ILE 31 7.939 -13.178 -3.189 235 HD12 ILE 31 1HD1 ILE 31 8.687 -13.174 -1.591 236 HD13 ILE 31 2HD1 ILE 31 8.183 -14.696 -2.326 237 HA PRO 32 HA PRO 32 13.686 -15.257 2.398 238 HB2 PRO 32 2HB PRO 32 12.276 -17.932 2.474 239 HB3 PRO 32 1HB PRO 32 12.758 -16.876 3.821 240 HG2 PRO 32 2HG PRO 32 10.213 -17.007 3.081 241 HG3 PRO 32 1HG PRO 32 10.934 -15.443 3.530 242 HD2 PRO 32 2HD PRO 32 10.308 -16.525 0.801 243 HD3 PRO 32 1HD PRO 32 10.149 -14.867 1.425 244 HA PRO 33 HA PRO 33 16.979 -17.423 0.131 245 HB2 PRO 33 2HB PRO 33 17.537 -18.682 2.823 246 HB3 PRO 33 1HB PRO 33 18.661 -17.881 1.705 247 HG2 PRO 33 2HG PRO 33 17.747 -16.667 3.926 248 HG3 PRO 33 1HG PRO 33 18.110 -15.766 2.436 249 HD2 PRO 33 2HD PRO 33 15.483 -16.386 3.661 250 HD3 PRO 33 1HD PRO 33 15.925 -15.096 2.522 251 H GLU 34 H GLU 34 15.523 -19.418 2.685 252 HA GLU 34 HA GLU 34 15.622 -21.946 1.616 253 HB2 GLU 34 2HB GLU 34 13.593 -22.386 3.114 254 HB3 GLU 34 1HB GLU 34 14.985 -21.646 3.898 255 HG2 GLU 34 2HG GLU 34 13.879 -19.406 3.676 256 HG3 GLU 34 1HG GLU 34 12.458 -20.216 3.009 257 H GLU 35 H GLU 35 13.336 -19.396 0.756 258 HA GLU 35 HA GLU 35 11.494 -21.315 -0.519 259 HB2 GLU 35 2HB GLU 35 10.948 -19.224 1.170 260 HB3 GLU 35 1HB GLU 35 10.763 -18.407 -0.368 261 HG2 GLU 35 2HG GLU 35 9.240 -20.864 0.559 262 HG3 GLU 35 1HG GLU 35 8.621 -19.217 0.494 263 H ARG 36 H ARG 36 13.877 -18.865 -1.333 264 HA ARG 36 HA ARG 36 12.614 -17.900 -3.710 265 HB2 ARG 36 2HB ARG 36 14.496 -16.453 -3.947 266 HB3 ARG 36 1HB ARG 36 14.190 -16.566 -2.219 267 HG2 ARG 36 2HG ARG 36 16.050 -18.211 -2.024 268 HG3 ARG 36 1HG ARG 36 16.370 -18.022 -3.748 269 HD2 ARG 36 2HD ARG 36 16.729 -15.981 -1.543 270 HD3 ARG 36 1HD ARG 36 17.958 -16.650 -2.615 271 HE ARG 36 HE ARG 36 16.326 -14.370 -3.076 272 HH11 ARG 36 1HH1 ARG 36 17.846 -17.004 -4.880 273 HH12 ARG 36 2HH1 ARG 36 17.901 -16.099 -6.356 274 HH21 ARG 36 1HH2 ARG 36 16.416 -13.234 -5.022 275 HH22 ARG 36 2HH2 ARG 36 17.094 -13.969 -6.440 276 H ASP 37 H ASP 37 14.697 -20.524 -2.977 277 HA ASP 37 HA ASP 37 15.900 -21.121 -5.405 278 HB2 ASP 37 2HB ASP 37 16.211 -22.293 -3.152 279 HB3 ASP 37 1HB ASP 37 14.728 -23.182 -3.480 280 H ASP 38 H ASP 38 12.658 -21.986 -4.231 281 HA ASP 38 HA ASP 38 11.925 -23.234 -6.814 282 HB2 ASP 38 2HB ASP 38 10.563 -23.472 -4.092 283 HB3 ASP 38 1HB ASP 38 10.156 -24.380 -5.545 284 H PHE 39 H PHE 39 11.726 -20.219 -5.759 285 HA PHE 39 HA PHE 39 9.065 -19.717 -5.044 286 HB2 PHE 39 2HB PHE 39 9.635 -17.427 -4.927 287 HB3 PHE 39 1HB PHE 39 11.141 -18.252 -4.597 288 HD1 PHE 39 HD1 PHE 39 12.244 -18.857 -7.273 289 HD2 PHE 39 HD2 PHE 39 10.160 -15.374 -5.912 290 HE1 PHE 39 HE1 PHE 39 13.342 -17.511 -9.021 291 HE2 PHE 39 HE2 PHE 39 11.258 -14.047 -7.658 292 HZ PHE 39 HZ PHE 39 12.850 -15.106 -9.211 293 H ASP 40 H ASP 40 7.343 -18.730 -6.057 294 HA ASP 40 HA ASP 40 7.205 -18.604 -8.984 295 HB2 ASP 40 2HB ASP 40 5.236 -19.405 -7.721 296 HB3 ASP 40 1HB ASP 40 5.189 -17.907 -6.800 297 H GLY 41 H GLY 41 6.789 -16.560 -10.091 298 HA2 GLY 41 2HA GLY 41 8.345 -14.335 -9.340 299 HA3 GLY 41 1HA GLY 41 7.097 -14.338 -10.580 300 H LEU 42 H LEU 42 6.940 -12.000 -9.595 301 HA LEU 42 HA LEU 42 5.868 -11.904 -6.872 302 HB2 LEU 42 2HB LEU 42 7.565 -10.216 -7.645 303 HB3 LEU 42 1HB LEU 42 6.368 -9.550 -8.734 304 HG LEU 42 HG LEU 42 6.772 -8.321 -6.477 305 HD11 LEU 42 1HD1 LEU 42 3.886 -8.991 -7.124 306 HD12 LEU 42 2HD1 LEU 42 4.859 -7.748 -7.911 307 HD13 LEU 42 3HD1 LEU 42 4.465 -7.598 -6.200 308 HD21 LEU 42 3HD2 LEU 42 5.059 -10.571 -5.364 309 HD22 LEU 42 1HD2 LEU 42 5.571 -9.118 -4.501 310 HD23 LEU 42 2HD2 LEU 42 6.769 -10.303 -5.013 311 H SER 43 H SER 43 3.954 -12.909 -7.096 312 HA SER 43 HA SER 43 1.832 -11.742 -8.725 313 HB2 SER 43 2HB SER 43 1.855 -14.130 -6.821 314 HB3 SER 43 1HB SER 43 0.478 -13.626 -7.808 315 HG SER 43 HG SER 43 2.882 -14.827 -8.576 316 H TYR 44 H TYR 44 -0.038 -10.961 -7.765 317 HA TYR 44 HA TYR 44 0.108 -10.020 -4.964 318 HB2 TYR 44 2HB TYR 44 -0.756 -7.806 -5.684 319 HB3 TYR 44 1HB TYR 44 0.798 -8.147 -6.428 320 HD1 TYR 44 HD2 TYR 44 0.594 -9.301 -8.879 321 HD2 TYR 44 HD1 TYR 44 -2.410 -6.862 -7.070 322 HE1 TYR 44 HE2 TYR 44 -0.350 -8.823 -11.090 323 HE2 TYR 44 HE1 TYR 44 -3.351 -6.382 -9.289 324 HH TYR 44 HH TYR 44 -2.605 -6.378 -11.655 325 H PHE 45 H PHE 45 -2.269 -8.878 -4.672 326 HA PHE 45 HA PHE 45 -4.129 -11.075 -4.684 327 HB2 PHE 45 2HB PHE 45 -4.472 -8.153 -3.852 328 HB3 PHE 45 1HB PHE 45 -5.685 -9.403 -3.595 329 HD1 PHE 45 HD2 PHE 45 -2.023 -8.817 -2.867 330 HD2 PHE 45 HD1 PHE 45 -5.728 -10.394 -1.452 331 HE1 PHE 45 HE2 PHE 45 -0.965 -9.380 -0.723 332 HE2 PHE 45 HE1 PHE 45 -4.666 -10.955 0.692 333 HZ PHE 45 HZ PHE 45 -2.283 -10.451 1.062 334 H ASP 46 H ASP 46 -6.483 -10.764 -5.649 335 HA ASP 46 HA ASP 46 -5.985 -10.434 -8.471 336 HB2 ASP 46 2HB ASP 46 -7.897 -11.719 -8.869 337 HB3 ASP 46 1HB ASP 46 -7.380 -12.340 -7.313 338 HA PRO 47 HA PRO 47 -8.012 -6.456 -8.882 339 HB2 PRO 47 2HB PRO 47 -8.748 -7.198 -11.672 340 HB3 PRO 47 1HB PRO 47 -7.649 -5.926 -11.103 341 HG2 PRO 47 2HG PRO 47 -6.715 -8.117 -12.356 342 HG3 PRO 47 1HG PRO 47 -5.806 -7.341 -11.036 343 HD2 PRO 47 2HD PRO 47 -7.577 -9.784 -10.920 344 HD3 PRO 47 1HD PRO 47 -5.961 -9.530 -10.212 345 H ASP 48 H ASP 48 -9.810 -6.652 -7.558 346 HA ASP 48 HA ASP 48 -12.337 -7.543 -8.812 347 HB2 ASP 48 2HB ASP 48 -11.602 -8.902 -6.806 348 HB3 ASP 48 1HB ASP 48 -11.706 -7.443 -5.826 349 HA PRO 49 HA PRO 49 -12.776 -3.008 -8.646 350 HB2 PRO 49 2HB PRO 49 -15.192 -2.857 -9.962 351 HB3 PRO 49 1HB PRO 49 -13.642 -3.120 -10.787 352 HG2 PRO 49 2HG PRO 49 -15.702 -5.159 -9.981 353 HG3 PRO 49 1HG PRO 49 -14.837 -4.988 -11.528 354 HD2 PRO 49 2HD PRO 49 -14.057 -6.788 -9.685 355 HD3 PRO 49 1HD PRO 49 -12.869 -5.922 -10.687 356 H ASP 50 H ASP 50 -15.105 -5.329 -7.399 357 HA ASP 50 HA ASP 50 -16.750 -3.378 -6.039 358 HB2 ASP 50 2HB ASP 50 -16.737 -6.416 -5.766 359 HB3 ASP 50 1HB ASP 50 -18.019 -5.321 -5.251 360 H TYR 51 H TYR 51 -13.905 -5.222 -5.264 361 HA TYR 51 HA TYR 51 -14.191 -4.920 -2.360 362 HB2 TYR 51 2HB TYR 51 -12.880 -6.826 -3.864 363 HB3 TYR 51 1HB TYR 51 -11.533 -5.765 -3.490 364 HD1 TYR 51 HD2 TYR 51 -11.520 -5.027 -0.816 365 HD2 TYR 51 HD1 TYR 51 -13.198 -8.625 -2.407 366 HE1 TYR 51 HE2 TYR 51 -11.337 -6.104 1.394 367 HE2 TYR 51 HE1 TYR 51 -13.020 -9.682 -0.206 368 HH TYR 51 HH TYR 51 -12.462 -7.985 2.623 369 H ARG 52 H ARG 52 -12.749 -3.415 -5.076 370 HA ARG 52 HA ARG 52 -11.014 -1.533 -3.894 371 HB2 ARG 52 2HB ARG 52 -11.016 -2.122 -6.286 372 HB3 ARG 52 1HB ARG 52 -12.652 -1.509 -6.471 373 HG2 ARG 52 2HG ARG 52 -11.782 0.786 -5.959 374 HG3 ARG 52 1HG ARG 52 -10.153 0.106 -5.913 375 HD2 ARG 52 2HD ARG 52 -10.469 -0.682 -8.263 376 HD3 ARG 52 1HD ARG 52 -12.029 0.144 -8.302 377 HE ARG 52 HE ARG 52 -9.474 1.584 -7.823 378 HH11 ARG 52 1HH1 ARG 52 -12.490 1.282 -9.616 379 HH12 ARG 52 2HH1 ARG 52 -12.254 2.763 -10.495 380 HH21 ARG 52 1HH2 ARG 52 -9.169 3.510 -8.996 381 HH22 ARG 52 2HH2 ARG 52 -10.373 4.027 -10.141 382 H VAL 53 H VAL 53 -11.577 0.129 -2.541 383 HA VAL 53 HA VAL 53 -14.385 1.116 -2.485 384 HB VAL 53 HB VAL 53 -14.144 1.575 -0.101 385 HG11 VAL 53 1HG1 VAL 53 -13.921 -0.700 0.825 386 HG12 VAL 53 2HG1 VAL 53 -13.178 -1.244 -0.682 387 HG13 VAL 53 3HG1 VAL 53 -14.856 -0.700 -0.673 388 HG21 VAL 53 3HG2 VAL 53 -12.124 0.978 1.200 389 HG22 VAL 53 1HG2 VAL 53 -11.773 2.216 -0.008 390 HG23 VAL 53 2HG2 VAL 53 -11.287 0.545 -0.292 391 H GLU 54 H GLU 54 -14.425 3.466 -1.484 392 HA GLU 54 HA GLU 54 -12.183 5.055 -2.593 393 HB2 GLU 54 2HB GLU 54 -13.952 6.710 -3.423 394 HB3 GLU 54 1HB GLU 54 -13.854 5.189 -4.304 395 HG2 GLU 54 2HG GLU 54 -15.819 4.350 -2.990 396 HG3 GLU 54 1HG GLU 54 -15.935 5.930 -2.224 397 H ALA 55 H ALA 55 -11.984 7.226 -1.663 398 HA ALA 55 HA ALA 55 -13.046 7.509 1.070 399 HB1 ALA 55 3HB ALA 55 -11.032 6.099 1.286 400 HB2 ALA 55 1HB ALA 55 -10.769 7.685 2.015 401 HB3 ALA 55 2HB ALA 55 -10.080 7.311 0.432 402 H THR 56 H THR 56 -12.690 9.597 2.005 403 HA THR 56 HA THR 56 -12.007 11.755 0.111 404 HB THR 56 HB THR 56 -13.209 12.051 2.903 405 HG1 THR 56 HG1 THR 56 -14.351 11.180 0.540 406 HG21 THR 56 3HG2 THR 56 -13.214 13.902 0.481 407 HG22 THR 56 1HG2 THR 56 -12.263 14.131 1.949 408 HG23 THR 56 2HG2 THR 56 -14.025 14.221 2.016 409 H VAL 57 H VAL 57 -10.195 12.954 0.365 410 HA VAL 57 HA VAL 57 -8.099 12.075 2.145 411 HB VAL 57 HB VAL 57 -8.118 14.334 0.075 412 HG11 VAL 57 1HG1 VAL 57 -5.764 12.903 1.367 413 HG12 VAL 57 2HG1 VAL 57 -6.257 14.572 1.659 414 HG13 VAL 57 3HG1 VAL 57 -5.654 14.100 0.070 415 HG21 VAL 57 3HG2 VAL 57 -7.079 12.718 -1.468 416 HG22 VAL 57 1HG2 VAL 57 -8.677 12.170 -0.953 417 HG23 VAL 57 2HG2 VAL 57 -7.227 11.444 -0.252 418 H THR 58 H THR 58 -7.557 12.999 4.027 419 HA THR 58 HA THR 58 -8.563 15.698 4.766 420 HB THR 58 HB THR 58 -7.939 13.388 6.672 421 HG1 THR 58 HG1 THR 58 -10.153 13.807 5.119 422 HG21 THR 58 3HG2 THR 58 -9.224 14.719 8.315 423 HG22 THR 58 1HG2 THR 58 -9.435 15.998 7.114 424 HG23 THR 58 2HG2 THR 58 -7.823 15.610 7.722 425 H VAL 59 H VAL 59 -6.765 17.010 4.436 426 HA VAL 59 HA VAL 59 -4.081 15.872 4.874 427 HB VAL 59 HB VAL 59 -4.985 18.316 3.282 428 HG11 VAL 59 1HG1 VAL 59 -2.612 18.757 2.742 429 HG12 VAL 59 2HG1 VAL 59 -2.106 17.487 3.858 430 HG13 VAL 59 3HG1 VAL 59 -2.899 18.938 4.473 431 HG21 VAL 59 3HG2 VAL 59 -5.208 16.152 2.155 432 HG22 VAL 59 1HG2 VAL 59 -3.525 15.757 2.520 433 HG23 VAL 59 2HG2 VAL 59 -3.905 17.079 1.412 434 H HIS 60 H HIS 60 -2.759 16.567 6.395 435 HA HIS 60 HA HIS 60 -3.713 18.467 8.422 436 HB2 HIS 60 2HB HIS 60 -1.436 16.442 8.345 437 HB3 HIS 60 1HB HIS 60 -1.672 17.567 9.685 438 HD1 HIS 60 HD1 HIS 60 -3.425 14.674 7.958 439 HD2 HIS 60 HD2 HIS 60 -3.606 16.830 11.506 440 HE1 HIS 60 HE1 HIS 60 -5.151 13.521 9.369 441 HE2 HIS 60 HE2 HIS 60 -5.331 14.918 11.446 442 H GLU 61 H GLU 61 -2.999 20.482 8.477 443 HA GLU 61 HA GLU 61 -1.338 21.650 6.520 444 HB2 GLU 61 2HB GLU 61 -1.519 23.728 7.824 445 HB3 GLU 61 1HB GLU 61 -3.080 22.925 7.717 446 HG2 GLU 61 2HG GLU 61 -2.844 22.096 10.012 447 HG3 GLU 61 1HG GLU 61 -1.241 22.815 10.123 448 H THR 62 H THR 62 -0.646 20.401 9.735 449 HA THR 62 HA THR 62 2.230 21.027 9.436 450 HB THR 62 HB THR 62 2.347 20.639 11.926 451 HG1 THR 62 HG1 THR 62 0.526 19.378 12.272 452 HG21 THR 62 3HG2 THR 62 1.288 22.744 12.614 453 HG22 THR 62 1HG2 THR 62 0.327 22.773 11.134 454 HG23 THR 62 2HG2 THR 62 2.082 22.957 11.052 455 HA PRO 63 HA PRO 63 2.002 16.500 8.575 456 HB2 PRO 63 2HB PRO 63 4.380 16.310 7.243 457 HB3 PRO 63 1HB PRO 63 2.915 16.942 6.466 458 HG2 PRO 63 2HG PRO 63 5.227 18.451 7.650 459 HG3 PRO 63 1HG PRO 63 4.368 18.733 6.115 460 HD2 PRO 63 2HD PRO 63 3.846 20.190 8.359 461 HD3 PRO 63 1HD PRO 63 2.596 19.821 7.148 462 H GLU 64 H GLU 64 2.503 15.085 10.150 463 HA GLU 64 HA GLU 64 4.707 15.664 12.012 464 HB2 GLU 64 2HB GLU 64 3.461 14.128 13.561 465 HB3 GLU 64 1HB GLU 64 2.539 15.535 13.050 466 HG2 GLU 64 2HG GLU 64 1.455 14.020 11.294 467 HG3 GLU 64 1HG GLU 64 2.201 12.670 12.143 468 H SER 65 H SER 65 5.963 13.847 12.897 469 HA SER 65 HA SER 65 7.043 12.350 10.657 470 HB2 SER 65 2HB SER 65 8.898 11.876 12.348 471 HB3 SER 65 1HB SER 65 8.616 13.576 11.992 472 HG SER 65 HG SER 65 7.800 12.124 14.286 473 H VAL 66 H VAL 66 6.280 10.364 10.203 474 HA VAL 66 HA VAL 66 5.813 8.398 12.381 475 HB VAL 66 HB VAL 66 4.370 8.317 9.684 476 HG11 VAL 66 1HG1 VAL 66 4.466 6.166 10.855 477 HG12 VAL 66 2HG1 VAL 66 2.810 6.772 10.832 478 HG13 VAL 66 3HG1 VAL 66 3.769 6.892 12.309 479 HG21 VAL 66 3HG2 VAL 66 3.679 10.399 10.730 480 HG22 VAL 66 1HG2 VAL 66 3.314 9.566 12.248 481 HG23 VAL 66 2HG2 VAL 66 2.350 9.240 10.804 482 H ASP 67 H ASP 67 7.292 6.761 12.239 483 HA ASP 67 HA ASP 67 9.120 6.611 9.985 484 HB2 ASP 67 2HB ASP 67 8.933 4.954 12.547 485 HB3 ASP 67 1HB ASP 67 10.234 4.824 11.370 486 H LEU 68 H LEU 68 8.861 5.226 8.243 487 HA LEU 68 HA LEU 68 7.290 2.728 8.601 488 HB2 LEU 68 2HB LEU 68 7.238 4.404 6.068 489 HB3 LEU 68 1HB LEU 68 6.320 2.940 6.388 490 HG LEU 68 HG LEU 68 5.917 5.613 7.774 491 HD11 LEU 68 1HD1 LEU 68 5.238 5.594 5.410 492 HD12 LEU 68 2HD1 LEU 68 3.876 5.762 6.504 493 HD13 LEU 68 3HD1 LEU 68 4.188 4.210 5.731 494 HD21 LEU 68 3HD2 LEU 68 4.307 3.048 8.033 495 HD22 LEU 68 1HD2 LEU 68 3.876 4.613 8.731 496 HD23 LEU 68 2HD2 LEU 68 5.321 3.773 9.285 497 H GLU 69 H GLU 69 7.752 1.124 6.754 498 HA GLU 69 HA GLU 69 10.596 0.780 6.457 499 HB2 GLU 69 2HB GLU 69 10.171 -1.371 5.527 500 HB3 GLU 69 1HB GLU 69 8.937 -1.157 6.754 501 HG2 GLU 69 2HG GLU 69 8.311 -0.545 3.861 502 HG3 GLU 69 1HG GLU 69 8.315 -2.204 4.437 503 H THR 70 H THR 70 11.719 0.627 4.517 504 HA THR 70 HA THR 70 10.495 1.605 2.008 505 HB THR 70 HB THR 70 11.575 3.553 3.053 506 HG1 THR 70 HG1 THR 70 13.217 3.929 1.344 507 HG21 THR 70 3HG2 THR 70 14.151 1.929 3.091 508 HG22 THR 70 1HG2 THR 70 13.205 2.392 4.511 509 HG23 THR 70 2HG2 THR 70 13.995 3.631 3.531 510 H SER 71 H SER 71 12.499 1.410 0.246 511 HA SER 71 HA SER 71 13.036 -1.455 0.123 512 HB2 SER 71 2HB SER 71 13.464 0.774 -1.922 513 HB3 SER 71 1HB SER 71 13.720 -0.946 -2.233 514 HG SER 71 HG SER 71 11.250 0.091 -1.310 515 H ASP 72 H ASP 72 14.560 0.441 1.961 516 HA ASP 72 HA ASP 72 17.321 0.119 0.951 517 HB2 ASP 72 2HB ASP 72 16.293 2.174 2.967 518 HB3 ASP 72 1HB ASP 72 17.941 2.060 2.355 519 H ASP 73 H ASP 73 15.322 -1.599 2.639 520 HA ASP 73 HA ASP 73 15.399 -3.169 4.260 521 HB2 ASP 73 2HB ASP 73 18.397 -2.639 4.419 522 HB3 ASP 73 1HB ASP 73 17.556 -4.064 5.029 523 H ARG 74 H ARG 74 15.171 -0.241 4.919 524 HA ARG 74 HA ARG 74 15.984 -0.257 7.760 525 HB2 ARG 74 2HB ARG 74 17.621 0.990 6.227 526 HB3 ARG 74 1HB ARG 74 16.316 2.099 5.829 527 HG2 ARG 74 2HG ARG 74 16.202 2.804 8.183 528 HG3 ARG 74 1HG ARG 74 17.489 1.678 8.597 529 HD2 ARG 74 2HD ARG 74 19.085 2.951 7.351 530 HD3 ARG 74 1HD ARG 74 17.821 3.957 6.621 531 HE ARG 74 HE ARG 74 18.248 3.944 9.550 532 HH11 ARG 74 1HH1 ARG 74 18.268 5.747 6.523 533 HH12 ARG 74 2HH1 ARG 74 18.383 7.288 7.310 534 HH21 ARG 74 1HH2 ARG 74 18.257 5.964 10.559 535 HH22 ARG 74 2HH2 ARG 74 18.376 7.414 9.612 536 H THR 75 H THR 75 14.943 1.961 8.665 537 HA THR 75 HA THR 75 12.138 2.193 7.869 538 HB THR 75 HB THR 75 13.131 2.297 10.775 539 HG1 THR 75 HG1 THR 75 11.804 0.210 9.340 540 HG21 THR 75 3HG2 THR 75 10.323 2.216 9.611 541 HG22 THR 75 1HG2 THR 75 11.107 3.629 10.319 542 HG23 THR 75 2HG2 THR 75 10.734 2.231 11.328 543 H VAL 76 H VAL 76 11.548 4.364 7.863 544 HA VAL 76 HA VAL 76 13.605 6.419 8.302 545 HB VAL 76 HB VAL 76 13.278 7.382 5.975 546 HG11 VAL 76 1HG1 VAL 76 14.922 5.905 4.863 547 HG12 VAL 76 2HG1 VAL 76 14.641 4.669 6.094 548 HG13 VAL 76 3HG1 VAL 76 15.353 6.218 6.547 549 HG21 VAL 76 3HG2 VAL 76 11.238 6.207 5.308 550 HG22 VAL 76 1HG2 VAL 76 12.091 4.662 5.321 551 HG23 VAL 76 2HG2 VAL 76 12.526 5.906 4.144 552 H ARG 77 H ARG 77 12.799 8.550 8.209 553 HA ARG 77 HA ARG 77 10.232 8.798 9.424 554 HB2 ARG 77 2HB ARG 77 12.156 10.187 10.109 555 HB3 ARG 77 1HB ARG 77 12.229 10.927 8.519 556 HG2 ARG 77 2HG ARG 77 9.686 11.177 10.109 557 HG3 ARG 77 1HG ARG 77 11.071 12.148 10.587 558 HD2 ARG 77 2HD ARG 77 9.855 12.170 7.803 559 HD3 ARG 77 1HD ARG 77 9.457 13.321 9.081 560 HE ARG 77 HE ARG 77 12.210 13.393 8.846 561 HH11 ARG 77 1HH1 ARG 77 9.524 14.087 6.684 562 HH12 ARG 77 2HH1 ARG 77 10.408 15.284 5.789 563 HH21 ARG 77 1HH2 ARG 77 13.346 14.950 7.655 564 HH22 ARG 77 2HH2 ARG 77 12.565 15.771 6.337 565 H TYR 78 H TYR 78 8.417 8.805 8.340 566 HA TYR 78 HA TYR 78 8.133 10.173 5.736 567 HB2 TYR 78 2HB TYR 78 6.441 8.114 7.191 568 HB3 TYR 78 1HB TYR 78 5.749 9.098 5.911 569 HD1 TYR 78 HD2 TYR 78 8.850 6.996 6.442 570 HD2 TYR 78 HD1 TYR 78 5.666 8.070 3.806 571 HE1 TYR 78 HE2 TYR 78 9.637 5.338 4.815 572 HE2 TYR 78 HE1 TYR 78 6.453 6.415 2.172 573 HH TYR 78 HH TYR 78 8.691 3.997 2.918 574 H LEU 79 H LEU 79 6.433 11.686 5.512 575 HA LEU 79 HA LEU 79 5.568 13.031 7.987 576 HB2 LEU 79 2HB LEU 79 5.791 14.003 5.116 577 HB3 LEU 79 1HB LEU 79 4.949 14.909 6.361 578 HG LEU 79 HG LEU 79 7.914 14.237 6.322 579 HD11 LEU 79 1HD1 LEU 79 7.276 16.070 4.807 580 HD12 LEU 79 2HD1 LEU 79 8.258 16.649 6.149 581 HD13 LEU 79 3HD1 LEU 79 6.513 16.925 6.150 582 HD21 LEU 79 3HD2 LEU 79 6.333 15.683 8.478 583 HD22 LEU 79 1HD2 LEU 79 8.094 15.553 8.403 584 HD23 LEU 79 2HD2 LEU 79 7.116 14.106 8.626 585 H HIS 80 H HIS 80 3.516 12.964 8.585 586 HA HIS 80 HA HIS 80 1.536 11.535 7.047 587 HB2 HIS 80 2HB HIS 80 1.665 11.322 9.517 588 HB3 HIS 80 1HB HIS 80 1.350 13.042 9.694 589 HD2 HIS 80 HD2 HIS 80 -0.828 10.719 7.383 590 HE1 HIS 80 HE1 HIS 80 -3.119 11.990 10.699 591 HE2 HIS 80 HE2 HIS 80 -3.056 10.475 8.679 592 H VAL 81 H VAL 81 1.084 12.671 5.257 593 HA VAL 81 HA VAL 81 0.500 15.542 5.399 594 HB VAL 81 HB VAL 81 0.521 15.534 2.940 595 HG11 VAL 81 1HG1 VAL 81 2.941 14.129 4.134 596 HG12 VAL 81 2HG1 VAL 81 2.644 15.869 4.112 597 HG13 VAL 81 3HG1 VAL 81 2.917 15.005 2.598 598 HG21 VAL 81 3HG2 VAL 81 1.117 13.512 1.646 599 HG22 VAL 81 1HG2 VAL 81 -0.405 13.291 2.512 600 HG23 VAL 81 2HG2 VAL 81 1.071 12.545 3.124 601 H ALA 82 H ALA 82 -1.120 12.433 4.816 602 HA ALA 82 HA ALA 82 -3.715 13.857 4.666 603 HB1 ALA 82 3HB ALA 82 -4.405 12.495 2.727 604 HB2 ALA 82 1HB ALA 82 -2.791 11.779 2.656 605 HB3 ALA 82 2HB ALA 82 -3.007 13.505 2.354 606 H THR 83 H THR 83 -5.560 12.536 5.110 607 HA THR 83 HA THR 83 -5.119 9.820 6.185 608 HB THR 83 HB THR 83 -6.905 11.958 7.473 609 HG1 THR 83 HG1 THR 83 -4.298 11.556 7.736 610 HG21 THR 83 3HG2 THR 83 -6.262 9.122 8.390 611 HG22 THR 83 1HG2 THR 83 -7.821 9.673 7.773 612 HG23 THR 83 2HG2 THR 83 -7.202 10.304 9.300 613 H LEU 84 H LEU 84 -6.474 8.446 5.156 614 HA LEU 84 HA LEU 84 -8.466 9.568 3.296 615 HB2 LEU 84 2HB LEU 84 -7.373 6.732 3.276 616 HB3 LEU 84 1HB LEU 84 -8.136 7.616 1.961 617 HG LEU 84 HG LEU 84 -5.349 8.087 3.098 618 HD11 LEU 84 1HD1 LEU 84 -6.209 7.098 0.371 619 HD12 LEU 84 2HD1 LEU 84 -5.510 6.124 1.665 620 HD13 LEU 84 3HD1 LEU 84 -4.548 7.385 0.898 621 HD21 LEU 84 3HD2 LEU 84 -5.028 9.812 1.356 622 HD22 LEU 84 1HD2 LEU 84 -6.283 10.269 2.508 623 HD23 LEU 84 2HD2 LEU 84 -6.729 9.679 0.908 624 H SER 85 H SER 85 -10.404 9.654 4.209 625 HA SER 85 HA SER 85 -11.287 7.788 6.277 626 HB2 SER 85 2HB SER 85 -11.518 10.212 6.654 627 HB3 SER 85 1HB SER 85 -12.485 10.380 5.192 628 HG SER 85 HG SER 85 -13.265 8.678 7.305 629 H PHE 86 H PHE 86 -12.509 6.039 5.734 630 HA PHE 86 HA PHE 86 -14.518 6.100 3.633 631 HB2 PHE 86 2HB PHE 86 -13.592 4.152 2.396 632 HB3 PHE 86 1HB PHE 86 -12.511 5.527 2.319 633 HD1 PHE 86 HD1 PHE 86 -10.390 5.528 3.702 634 HD2 PHE 86 HD2 PHE 86 -12.862 2.060 3.355 635 HE1 PHE 86 HE1 PHE 86 -8.526 4.118 4.475 636 HE2 PHE 86 HE2 PHE 86 -11.002 0.661 4.129 637 HZ PHE 86 HZ PHE 86 -8.834 1.685 4.689 638 H ASP 87 H ASP 87 -15.342 3.672 3.419 639 HA ASP 87 HA ASP 87 -15.716 2.527 6.135 640 HB2 ASP 87 2HB ASP 87 -17.924 1.851 5.524 641 HB3 ASP 87 1HB ASP 87 -17.785 3.494 4.920 642 H LEU 88 H LEU 88 -15.568 0.273 6.363 643 HA LEU 88 HA LEU 88 -15.224 -1.471 4.056 644 HB2 LEU 88 2HB LEU 88 -12.894 -0.607 4.507 645 HB3 LEU 88 1HB LEU 88 -12.991 -1.298 6.115 646 HG LEU 88 HG LEU 88 -13.199 -3.584 5.080 647 HD11 LEU 88 1HD1 LEU 88 -12.633 -3.902 2.704 648 HD12 LEU 88 2HD1 LEU 88 -12.608 -2.152 2.469 649 HD13 LEU 88 3HD1 LEU 88 -14.115 -2.966 2.895 650 HD21 LEU 88 3HD2 LEU 88 -10.830 -3.788 4.475 651 HD22 LEU 88 1HD2 LEU 88 -11.035 -2.746 5.883 652 HD23 LEU 88 2HD2 LEU 88 -10.710 -2.035 4.299 653 H ASP 89 H ASP 89 -16.105 -3.427 4.488 654 HA ASP 89 HA ASP 89 -17.052 -5.217 5.498 655 HB2 ASP 89 2HB ASP 89 -15.040 -5.527 6.792 656 HB3 ASP 89 1HB ASP 89 -15.481 -4.244 7.906 657 H GLY 90 H GLY 90 -17.150 -2.983 8.256 658 HA2 GLY 90 2HA GLY 90 -19.902 -2.204 7.902 659 HA3 GLY 90 1HA GLY 90 -19.696 -3.415 9.167 660 H GLU 91 H GLU 91 -17.033 -1.318 8.674 661 HA GLU 91 HA GLU 91 -17.738 0.375 10.996 662 HB2 GLU 91 2HB GLU 91 -15.457 0.038 11.890 663 HB3 GLU 91 1HB GLU 91 -16.317 -1.495 11.772 664 HG2 GLU 91 2HG GLU 91 -15.105 -2.053 9.719 665 HG3 GLU 91 1HG GLU 91 -14.272 -0.501 9.755 666 H SER 92 H SER 92 -16.349 2.308 11.191 667 HA SER 92 HA SER 92 -15.662 3.506 8.624 668 HB2 SER 92 2HB SER 92 -16.938 4.770 10.373 669 HB3 SER 92 1HB SER 92 -15.542 4.670 11.447 670 HG SER 92 HG SER 92 -16.043 6.400 9.422 671 H ARG 93 H ARG 93 -13.627 3.522 7.839 672 HA ARG 93 HA ARG 93 -11.339 2.748 9.568 673 HB2 ARG 93 2HB ARG 93 -11.864 2.095 6.642 674 HB3 ARG 93 1HB ARG 93 -10.386 1.692 7.496 675 HG2 ARG 93 2HG ARG 93 -13.075 0.629 8.381 676 HG3 ARG 93 1HG ARG 93 -12.118 -0.162 7.131 677 HD2 ARG 93 2HD ARG 93 -11.661 -1.276 9.187 678 HD3 ARG 93 1HD ARG 93 -10.232 -0.334 8.773 679 HE ARG 93 HE ARG 93 -12.238 0.520 10.778 680 HH11 ARG 93 1HH1 ARG 93 -8.864 0.132 9.826 681 HH12 ARG 93 2HH1 ARG 93 -8.243 0.845 11.275 682 HH21 ARG 93 1HH2 ARG 93 -11.390 1.441 12.680 683 HH22 ARG 93 2HH2 ARG 93 -9.675 1.587 12.898 684 H ASP 94 H ASP 94 -9.547 3.993 9.443 685 HA ASP 94 HA ASP 94 -9.260 5.968 7.232 686 HB2 ASP 94 2HB ASP 94 -8.122 6.172 10.062 687 HB3 ASP 94 1HB ASP 94 -7.827 7.324 8.765 688 H LEU 95 H LEU 95 -7.538 5.626 5.941 689 HA LEU 95 HA LEU 95 -5.138 4.291 7.080 690 HB2 LEU 95 2HB LEU 95 -6.122 4.269 4.197 691 HB3 LEU 95 1HB LEU 95 -4.487 3.810 4.660 692 HG LEU 95 HG LEU 95 -7.058 2.394 5.453 693 HD11 LEU 95 1HD1 LEU 95 -6.118 0.516 4.193 694 HD12 LEU 95 2HD1 LEU 95 -4.707 1.493 3.772 695 HD13 LEU 95 3HD1 LEU 95 -6.307 1.943 3.176 696 HD21 LEU 95 3HD2 LEU 95 -5.657 0.764 6.645 697 HD22 LEU 95 1HD2 LEU 95 -5.511 2.367 7.362 698 HD23 LEU 95 2HD2 LEU 95 -4.223 1.744 6.329 699 H HIS 96 H HIS 96 -3.417 5.567 7.246 700 HA HIS 96 HA HIS 96 -3.731 8.377 6.517 701 HB2 HIS 96 2HB HIS 96 -1.607 6.916 8.162 702 HB3 HIS 96 1HB HIS 96 -1.709 8.661 7.968 703 HD2 HIS 96 HD2 HIS 96 -5.173 7.182 8.676 704 HE1 HIS 96 HE1 HIS 96 -3.548 8.423 12.363 705 HE2 HIS 96 HE2 HIS 96 -5.660 7.810 11.132 706 H ALA 97 H ALA 97 -2.615 9.296 4.861 707 HA ALA 97 HA ALA 97 -0.939 7.557 3.168 708 HB1 ALA 97 3HB ALA 97 -2.963 8.460 2.098 709 HB2 ALA 97 1HB ALA 97 -1.512 9.131 1.349 710 HB3 ALA 97 2HB ALA 97 -2.455 10.106 2.481 711 H PHE 98 H PHE 98 1.169 7.961 3.103 712 HA PHE 98 HA PHE 98 2.222 10.490 4.259 713 HB2 PHE 98 2HB PHE 98 3.567 7.758 4.378 714 HB3 PHE 98 1HB PHE 98 4.030 9.222 5.230 715 HD1 PHE 98 HD1 PHE 98 2.694 9.988 7.185 716 HD2 PHE 98 HD2 PHE 98 1.920 6.252 5.289 717 HE1 PHE 98 HE1 PHE 98 1.506 9.209 9.183 718 HE2 PHE 98 HE2 PHE 98 0.737 5.474 7.298 719 HZ PHE 98 HZ PHE 98 0.532 6.959 9.248 720 H ARG 99 H ARG 99 4.475 10.899 3.657 721 HA ARG 99 HA ARG 99 5.836 9.402 1.657 722 HB2 ARG 99 2HB ARG 99 6.259 11.250 0.061 723 HB3 ARG 99 1HB ARG 99 4.593 10.721 0.064 724 HG2 ARG 99 2HG ARG 99 4.901 12.976 1.876 725 HG3 ARG 99 1HG ARG 99 5.575 13.385 0.298 726 HD2 ARG 99 2HD ARG 99 2.756 12.428 0.898 727 HD3 ARG 99 1HD ARG 99 3.240 14.034 0.355 728 HE ARG 99 HE ARG 99 3.631 11.624 -1.333 729 HH11 ARG 99 1HH1 ARG 99 2.331 14.879 -0.993 730 HH12 ARG 99 2HH1 ARG 99 1.879 14.999 -2.665 731 HH21 ARG 99 1HH2 ARG 99 3.001 11.799 -3.499 732 HH22 ARG 99 2HH2 ARG 99 2.256 13.262 -4.080 733 H GLN 100 H GLN 100 8.109 10.021 1.579 734 HA GLN 100 HA GLN 100 9.009 10.055 4.192 735 HB2 GLN 100 2HB GLN 100 10.632 10.623 1.688 736 HB3 GLN 100 1HB GLN 100 11.300 10.167 3.255 737 HG2 GLN 100 2HG GLN 100 10.070 7.998 3.111 738 HG3 GLN 100 1HG GLN 100 9.505 8.456 1.506 739 HE21 GLN 100 1HE2 GLN 100 12.748 9.048 2.789 740 HE22 GLN 100 2HE2 GLN 100 13.563 7.996 1.701 741 H ALA 101 H ALA 101 9.992 12.646 1.877 742 HA ALA 101 HA ALA 101 9.752 14.597 4.111 743 HB1 ALA 101 3HB ALA 101 12.093 14.261 3.444 744 HB2 ALA 101 1HB ALA 101 11.558 15.902 3.081 745 HB3 ALA 101 2HB ALA 101 11.706 14.712 1.783 746 H ALA 102 H ALA 102 10.126 15.028 0.574 747 HA ALA 102 HA ALA 102 7.644 16.645 0.513 748 HB1 ALA 102 3HB ALA 102 9.611 18.114 0.883 749 HB2 ALA 102 1HB ALA 102 8.870 18.419 -0.691 750 HB3 ALA 102 2HB ALA 102 10.361 17.480 -0.580 751 H ASP 103 H ASP 103 7.752 14.013 -0.442 752 HA ASP 103 HA ASP 103 8.767 13.704 -3.086 753 HB2 ASP 103 2HB ASP 103 6.632 12.059 -1.650 754 HB3 ASP 103 1HB ASP 103 7.537 11.552 -3.076 755 H GLU 104 H GLU 104 7.801 13.969 -5.040 756 HA GLU 104 HA GLU 104 5.016 14.993 -5.220 757 HB2 GLU 104 2HB GLU 104 7.439 16.043 -6.749 758 HB3 GLU 104 1HB GLU 104 5.771 16.532 -7.041 759 HG2 GLU 104 2HG GLU 104 5.667 17.416 -4.705 760 HG3 GLU 104 1HG GLU 104 7.371 17.016 -4.508 761 H SER 105 H SER 105 6.717 12.384 -5.793 762 HA SER 105 HA SER 105 6.079 11.790 -8.545 763 HB2 SER 105 2HB SER 105 8.063 10.823 -7.374 764 HB3 SER 105 1HB SER 105 6.990 9.957 -6.280 765 HG SER 105 HG SER 105 6.342 8.661 -7.923 766 H ARG 106 H ARG 106 3.919 12.436 -6.404 767 HA ARG 106 HA ARG 106 1.744 11.963 -5.929 768 HB2 ARG 106 2HB ARG 106 1.780 9.963 -8.232 769 HB3 ARG 106 1HB ARG 106 0.390 10.834 -7.593 770 HG2 ARG 106 2HG ARG 106 2.682 11.975 -9.234 771 HG3 ARG 106 1HG ARG 106 0.991 11.826 -9.713 772 HD2 ARG 106 2HD ARG 106 0.326 13.530 -8.156 773 HD3 ARG 106 1HD ARG 106 1.923 13.571 -7.408 774 HE ARG 106 HE ARG 106 1.562 14.350 -10.234 775 HH11 ARG 106 1HH1 ARG 106 2.573 15.245 -6.964 776 HH12 ARG 106 2HH1 ARG 106 3.269 16.751 -7.479 777 HH21 ARG 106 1HH2 ARG 106 2.471 16.361 -10.852 778 HH22 ARG 106 2HH2 ARG 106 3.212 17.377 -9.653 779 H THR 107 H THR 107 4.047 10.296 -4.879 780 HA THR 107 HA THR 107 2.965 7.615 -4.593 781 HB THR 107 HB THR 107 5.593 8.760 -3.526 782 HG1 THR 107 HG1 THR 107 4.847 7.724 -6.053 783 HG21 THR 107 3HG2 THR 107 4.782 5.874 -4.067 784 HG22 THR 107 1HG2 THR 107 4.925 6.608 -2.468 785 HG23 THR 107 2HG2 THR 107 6.356 6.421 -3.482 786 H LEU 108 H LEU 108 1.388 7.557 -3.149 787 HA LEU 108 HA LEU 108 1.725 8.657 -0.415 788 HB2 LEU 108 2HB LEU 108 -0.804 7.770 -1.864 789 HB3 LEU 108 1HB LEU 108 -0.741 8.376 -0.215 790 HG LEU 108 HG LEU 108 -0.069 9.987 -2.711 791 HD11 LEU 108 1HD1 LEU 108 -2.149 11.205 -2.257 792 HD12 LEU 108 2HD1 LEU 108 -2.493 10.138 -0.893 793 HD13 LEU 108 3HD1 LEU 108 -2.465 9.493 -2.536 794 HD21 LEU 108 3HD2 LEU 108 0.023 11.938 -1.200 795 HD22 LEU 108 1HD2 LEU 108 1.257 10.745 -0.794 796 HD23 LEU 108 2HD2 LEU 108 -0.201 10.875 0.193 797 H PHE 109 H PHE 109 2.318 7.160 1.024 798 HA PHE 109 HA PHE 109 2.003 4.289 0.360 799 HB2 PHE 109 2HB PHE 109 4.317 5.299 0.788 800 HB3 PHE 109 1HB PHE 109 3.827 5.568 2.456 801 HD1 PHE 109 HD1 PHE 109 4.551 2.961 -0.094 802 HD2 PHE 109 HD2 PHE 109 3.781 3.729 4.036 803 HE1 PHE 109 HE1 PHE 109 5.280 0.676 0.475 804 HE2 PHE 109 HE2 PHE 109 4.504 1.448 4.605 805 HZ PHE 109 HZ PHE 109 5.257 -0.079 2.821 806 H VAL 110 H VAL 110 0.356 3.292 1.398 807 HA VAL 110 HA VAL 110 -0.409 4.166 4.129 808 HB VAL 110 HB VAL 110 -2.757 3.305 3.669 809 HG11 VAL 110 1HG1 VAL 110 -3.531 5.306 2.456 810 HG12 VAL 110 2HG1 VAL 110 -1.874 5.650 1.953 811 HG13 VAL 110 3HG1 VAL 110 -2.309 5.708 3.660 812 HG21 VAL 110 3HG2 VAL 110 -2.331 1.896 1.699 813 HG22 VAL 110 1HG2 VAL 110 -1.876 3.317 0.754 814 HG23 VAL 110 2HG2 VAL 110 -3.537 3.125 1.324 815 HA PRO 111 HA PRO 111 0.861 -0.218 4.772 816 HB2 PRO 111 2HB PRO 111 1.825 0.132 7.301 817 HB3 PRO 111 1HB PRO 111 2.797 0.539 5.870 818 HG2 PRO 111 2HG PRO 111 1.225 2.365 7.657 819 HG3 PRO 111 1HG PRO 111 2.855 2.580 6.978 820 HD2 PRO 111 2HD PRO 111 0.629 3.751 5.891 821 HD3 PRO 111 1HD PRO 111 2.056 3.307 4.931 822 H PHE 112 H PHE 112 -0.515 -1.741 5.724 823 HA PHE 112 HA PHE 112 -2.325 -0.928 7.864 824 HB2 PHE 112 2HB PHE 112 -4.371 -1.509 6.776 825 HB3 PHE 112 1HB PHE 112 -3.528 -0.424 5.688 826 HD1 PHE 112 HD1 PHE 112 -2.677 -1.248 3.494 827 HD2 PHE 112 HD2 PHE 112 -4.752 -3.854 6.195 828 HE1 PHE 112 HE1 PHE 112 -3.012 -2.883 1.697 829 HE2 PHE 112 HE2 PHE 112 -5.084 -5.471 4.374 830 HZ PHE 112 HZ PHE 112 -4.217 -4.981 2.124 831 H ARG 113 H ARG 113 -3.422 -2.725 8.865 832 HA ARG 113 HA ARG 113 -2.394 -5.414 8.249 833 HB2 ARG 113 2HB ARG 113 -0.897 -4.540 10.011 834 HB3 ARG 113 1HB ARG 113 -2.288 -4.150 11.024 835 HG2 ARG 113 2HG ARG 113 -2.871 -6.573 11.108 836 HG3 ARG 113 1HG ARG 113 -1.427 -6.929 10.156 837 HD2 ARG 113 2HD ARG 113 -1.081 -7.344 12.554 838 HD3 ARG 113 1HD ARG 113 -0.007 -6.081 11.952 839 HE ARG 113 HE ARG 113 -1.587 -4.456 12.947 840 HH11 ARG 113 1HH1 ARG 113 -1.511 -7.717 14.257 841 HH12 ARG 113 2HH1 ARG 113 -2.101 -7.229 15.813 842 HH21 ARG 113 1HH2 ARG 113 -2.322 -3.829 15.001 843 HH22 ARG 113 2HH2 ARG 113 -2.559 -5.024 16.234 844 H ASP 114 H ASP 114 -4.019 -6.889 8.281 845 HA ASP 114 HA ASP 114 -6.626 -6.141 9.450 846 HB2 ASP 114 2HB ASP 114 -7.704 -6.978 7.428 847 HB3 ASP 114 1HB ASP 114 -6.519 -5.762 6.959 848 H LYS 115 H LYS 115 -7.877 -8.649 8.698 849 HA LYS 115 HA LYS 115 -6.720 -10.309 10.813 850 HB2 LYS 115 2HB LYS 115 -9.317 -10.700 9.284 851 HB3 LYS 115 1HB LYS 115 -8.810 -11.621 10.687 852 HG2 LYS 115 2HG LYS 115 -9.571 -8.688 10.626 853 HG3 LYS 115 1HG LYS 115 -10.537 -10.012 11.254 854 HD2 LYS 115 2HD LYS 115 -9.705 -9.364 13.276 855 HD3 LYS 115 1HD LYS 115 -8.276 -10.280 12.799 856 HE2 LYS 115 2HE LYS 115 -7.209 -8.223 11.984 857 HE3 LYS 115 1HE LYS 115 -8.668 -7.299 12.348 858 HZ1 LYS 115 3HZ LYS 115 -7.003 -8.722 14.353 859 HZ2 LYS 115 1HZ LYS 115 -8.377 -7.786 14.676 860 HZ3 LYS 115 2HZ LYS 115 -6.978 -7.055 14.064 861 H THR 116 H THR 116 -6.286 -10.245 7.429 862 HA THR 116 HA THR 116 -5.880 -13.154 7.232 863 HB THR 116 HB THR 116 -5.259 -12.833 4.885 864 HG1 THR 116 HG1 THR 116 -5.863 -10.185 4.630 865 HG21 THR 116 3HG2 THR 116 -7.672 -12.991 5.409 866 HG22 THR 116 1HG2 THR 116 -7.385 -11.972 3.994 867 HG23 THR 116 2HG2 THR 116 -7.757 -11.233 5.552 868 H THR 117 H THR 117 -4.043 -10.189 7.569 869 HA THR 117 HA THR 117 -1.429 -11.180 7.146 870 HB THR 117 HB THR 117 -2.375 -8.921 8.982 871 HG1 THR 117 HG1 THR 117 -2.958 -8.597 6.796 872 HG21 THR 117 3HG2 THR 117 -0.035 -9.622 9.494 873 HG22 THR 117 1HG2 THR 117 -0.096 -8.005 8.783 874 HG23 THR 117 2HG2 THR 117 0.394 -9.388 7.798 875 H GLY 118 H GLY 118 -0.193 -12.497 8.418 876 HA2 GLY 118 2HA GLY 118 0.613 -13.661 10.237 877 HA3 GLY 118 1HA GLY 118 -0.500 -12.792 11.276 878 H GLN 119 H GLN 119 -2.524 -14.005 9.000 879 HA GLN 119 HA GLN 119 -3.056 -16.476 10.556 880 HB2 GLN 119 2HB GLN 119 -5.105 -14.591 9.292 881 HB3 GLN 119 1HB GLN 119 -5.474 -16.046 10.210 882 HG2 GLN 119 2HG GLN 119 -4.104 -13.584 11.343 883 HG3 GLN 119 1HG GLN 119 -5.823 -13.932 11.489 884 HE21 GLN 119 1HE2 GLN 119 -2.642 -14.746 12.619 885 HE22 GLN 119 2HE2 GLN 119 -3.141 -15.733 13.942 886 H GLN 120 H GLN 120 -4.245 -15.027 7.504 887 HA GLN 120 HA GLN 120 -3.965 -17.570 6.045 888 HB2 GLN 120 2HB GLN 120 -5.280 -14.920 5.304 889 HB3 GLN 120 1HB GLN 120 -5.152 -16.268 4.187 890 HG2 GLN 120 2HG GLN 120 -7.390 -16.116 5.162 891 HG3 GLN 120 1HG GLN 120 -6.606 -17.628 5.607 892 HE21 GLN 120 1HE2 GLN 120 -7.477 -14.423 6.805 893 HE22 GLN 120 2HE2 GLN 120 -7.537 -14.862 8.476 894 H SER 121 H SER 121 -2.007 -15.227 6.832 895 HA SER 121 HA SER 121 -0.144 -15.479 4.627 896 HB2 SER 121 2HB SER 121 -1.143 -12.729 5.548 897 HB3 SER 121 1HB SER 121 0.200 -12.994 4.432 898 HG SER 121 HG SER 121 -1.821 -14.314 3.418 899 H TYR 122 H TYR 122 1.950 -14.103 5.443 900 HA TYR 122 HA TYR 122 2.466 -14.966 8.180 901 HB2 TYR 122 2HB TYR 122 4.140 -15.230 6.242 902 HB3 TYR 122 1HB TYR 122 4.418 -13.497 6.356 903 HD1 TYR 122 HD2 TYR 122 4.698 -16.706 8.224 904 HD2 TYR 122 HD1 TYR 122 5.900 -12.609 8.103 905 HE1 TYR 122 HE2 TYR 122 6.331 -17.121 10.003 906 HE2 TYR 122 HE1 TYR 122 7.532 -13.033 9.892 907 HH TYR 122 HH TYR 122 7.951 -14.585 11.657 908 H ASP 123 H ASP 123 3.644 -13.423 9.634 909 HA ASP 123 HA ASP 123 2.020 -10.986 9.944 910 HB2 ASP 123 2HB ASP 123 2.762 -11.025 12.297 911 HB3 ASP 123 1HB ASP 123 2.045 -12.562 11.840 912 H GLY 124 H GLY 124 3.526 -9.346 11.483 913 HA2 GLY 124 2HA GLY 124 5.557 -8.032 11.420 914 HA3 GLY 124 1HA GLY 124 5.820 -8.554 9.759 915 H GLY 125 H GLY 125 3.197 -8.259 8.825 916 HA2 GLY 125 2HA GLY 125 1.438 -6.425 9.108 917 HA3 GLY 125 1HA GLY 125 2.787 -5.324 8.835 918 H ARG 126 H ARG 126 0.952 -4.855 7.128 919 HA ARG 126 HA ARG 126 2.183 -5.718 4.624 920 HB2 ARG 126 2HB ARG 126 -0.055 -7.064 5.125 921 HB3 ARG 126 1HB ARG 126 -0.851 -5.568 4.661 922 HG2 ARG 126 2HG ARG 126 0.839 -5.879 2.523 923 HG3 ARG 126 1HG ARG 126 0.605 -7.568 2.966 924 HD2 ARG 126 2HD ARG 126 -1.485 -5.545 2.127 925 HD3 ARG 126 1HD ARG 126 -1.032 -7.053 1.315 926 HE ARG 126 HE ARG 126 -1.917 -7.491 3.956 927 HH11 ARG 126 1HH1 ARG 126 -3.199 -6.862 0.734 928 HH12 ARG 126 2HH1 ARG 126 -4.716 -7.636 1.029 929 HH21 ARG 126 1HH2 ARG 126 -3.967 -8.503 4.344 930 HH22 ARG 126 2HH2 ARG 126 -5.151 -8.569 3.082 931 H TYR 127 H TYR 127 0.947 -4.320 2.811 932 HA TYR 127 HA TYR 127 0.553 -1.566 3.632 933 HB2 TYR 127 2HB TYR 127 2.493 -0.816 2.327 934 HB3 TYR 127 1HB TYR 127 2.986 -1.932 3.589 935 HD1 TYR 127 HD2 TYR 127 2.513 -4.606 2.342 936 HD2 TYR 127 HD1 TYR 127 4.142 -1.038 0.612 937 HE1 TYR 127 HE2 TYR 127 3.767 -5.942 0.724 938 HE2 TYR 127 HE1 TYR 127 5.396 -2.402 -0.998 939 HH TYR 127 HH TYR 127 4.911 -5.814 -1.327 940 H MET 128 H MET 128 0.088 -0.214 1.841 941 HA MET 128 HA MET 128 -0.667 -1.412 -0.721 942 HB2 MET 128 2HB MET 128 -2.592 -0.599 1.321 943 HB3 MET 128 1HB MET 128 -2.708 0.535 -0.014 944 HG2 MET 128 2HG MET 128 -2.905 -2.465 -0.337 945 HG3 MET 128 1HG MET 128 -4.290 -1.389 -0.151 946 HE1 MET 128 3HE MET 128 -4.275 0.704 -3.375 947 HE2 MET 128 1HE MET 128 -3.494 1.174 -1.861 948 HE3 MET 128 2HE MET 128 -5.053 0.347 -1.827 949 H GLU 129 H GLU 129 -0.250 0.015 -2.408 950 HA GLU 129 HA GLU 129 0.915 2.647 -1.671 951 HB2 GLU 129 2HB GLU 129 2.632 1.081 -2.427 952 HB3 GLU 129 1HB GLU 129 1.730 0.746 -3.897 953 HG2 GLU 129 2HG GLU 129 2.025 3.195 -4.518 954 HG3 GLU 129 1HG GLU 129 3.114 3.339 -3.138 955 H LEU 130 H LEU 130 -0.063 4.322 -2.490 956 HA LEU 130 HA LEU 130 -1.961 4.100 -4.752 957 HB2 LEU 130 2HB LEU 130 -1.695 6.285 -2.656 958 HB3 LEU 130 1HB LEU 130 -3.008 6.081 -3.805 959 HG LEU 130 HG LEU 130 -2.525 3.850 -1.829 960 HD11 LEU 130 1HD1 LEU 130 -3.889 6.448 -1.099 961 HD12 LEU 130 2HD1 LEU 130 -2.356 5.853 -0.455 962 HD13 LEU 130 3HD1 LEU 130 -3.850 4.982 -0.113 963 HD21 LEU 130 3HD2 LEU 130 -4.944 3.609 -1.943 964 HD22 LEU 130 1HD2 LEU 130 -4.273 3.645 -3.572 965 HD23 LEU 130 2HD2 LEU 130 -5.080 5.075 -2.918 966 H GLU 131 H GLU 131 -1.302 5.111 -6.620 967 HA GLU 131 HA GLU 131 0.062 7.711 -6.310 968 HB2 GLU 131 2HB GLU 131 0.542 5.733 -8.584 969 HB3 GLU 131 1HB GLU 131 1.115 7.400 -8.560 970 HG2 GLU 131 2HG GLU 131 2.392 6.836 -6.440 971 HG3 GLU 131 1HG GLU 131 1.959 5.150 -6.709 972 HA PRO 132 HA PRO 132 -4.106 8.606 -8.129 973 HB2 PRO 132 2HB PRO 132 -3.978 11.306 -7.361 974 HB3 PRO 132 1HB PRO 132 -4.633 9.999 -6.338 975 HG2 PRO 132 2HG PRO 132 -1.880 11.200 -6.306 976 HG3 PRO 132 1HG PRO 132 -2.944 10.798 -4.939 977 HD2 PRO 132 2HD PRO 132 -0.934 9.181 -5.594 978 HD3 PRO 132 1HD PRO 132 -2.495 8.505 -5.092 979 H ASP 133 H ASP 133 -4.693 10.238 -9.772 980 HA ASP 133 HA ASP 133 -2.666 10.386 -11.836 981 HB2 ASP 133 2HB ASP 133 -5.147 9.843 -12.205 982 HB3 ASP 133 1HB ASP 133 -5.499 11.534 -11.885 983 H ARG 134 H ARG 134 -3.345 12.270 -9.258 984 HA ARG 134 HA ARG 134 -1.981 14.651 -10.248 985 HB2 ARG 134 2HB ARG 134 -3.715 16.061 -9.062 986 HB3 ARG 134 1HB ARG 134 -4.354 15.219 -10.475 987 HG2 ARG 134 2HG ARG 134 -5.470 13.582 -9.118 988 HG3 ARG 134 1HG ARG 134 -4.631 14.117 -7.662 989 HD2 ARG 134 2HD ARG 134 -5.805 16.209 -7.732 990 HD3 ARG 134 1HD ARG 134 -6.632 15.767 -9.221 991 HE ARG 134 HE ARG 134 -7.306 15.022 -6.541 992 HH11 ARG 134 1HH1 ARG 134 -7.555 13.892 -9.871 993 HH12 ARG 134 2HH1 ARG 134 -8.933 12.887 -9.543 994 HH21 ARG 134 1HH2 ARG 134 -9.073 13.675 -6.127 995 HH22 ARG 134 2HH2 ARG 134 -9.791 12.765 -7.418 996 H ASP 135 H ASP 135 -1.599 16.083 -8.115 997 HA ASP 135 HA ASP 135 -0.962 14.281 -5.858 998 HB2 ASP 135 2HB ASP 135 0.637 16.158 -6.869 999 HB3 ASP 135 1HB ASP 135 -0.295 17.239 -5.843 1000 H LEU 136 H LEU 136 -1.970 14.569 -3.786 1001 HA LEU 136 HA LEU 136 -4.683 15.685 -4.101 1002 HB2 LEU 136 2HB LEU 136 -3.648 13.660 -2.084 1003 HB3 LEU 136 1HB LEU 136 -5.324 14.169 -2.255 1004 HG LEU 136 HG LEU 136 -3.708 12.606 -4.306 1005 HD11 LEU 136 1HD1 LEU 136 -4.400 11.304 -2.318 1006 HD12 LEU 136 2HD1 LEU 136 -5.163 10.739 -3.800 1007 HD13 LEU 136 3HD1 LEU 136 -6.082 11.715 -2.651 1008 HD21 LEU 136 3HD2 LEU 136 -6.608 13.496 -4.466 1009 HD22 LEU 136 1HD2 LEU 136 -5.797 12.405 -5.595 1010 HD23 LEU 136 2HD2 LEU 136 -5.277 14.082 -5.467 1011 H SER 137 H SER 137 -5.588 17.082 -2.733 1012 HA SER 137 HA SER 137 -4.193 17.986 -0.290 1013 HB2 SER 137 2HB SER 137 -5.248 20.267 -0.715 1014 HB3 SER 137 1HB SER 137 -3.999 19.818 -1.873 1015 HG SER 137 HG SER 137 -6.571 19.077 -2.571 1016 H ASP 138 H ASP 138 -6.065 19.291 1.055 1017 HA ASP 138 HA ASP 138 -7.763 17.183 1.935 1018 HB2 ASP 138 2HB ASP 138 -8.535 18.739 3.648 1019 HB3 ASP 138 1HB ASP 138 -6.797 18.906 3.469 1020 H GLY 139 H GLY 139 -9.608 16.568 1.024 1021 HA2 GLY 139 2HA GLY 139 -11.983 17.144 0.671 1022 HA3 GLY 139 1HA GLY 139 -11.453 18.580 -0.194 1023 H ASP 140 H ASP 140 -9.237 16.556 -1.291 1024 HA ASP 140 HA ASP 140 -10.604 15.760 -3.694 1025 HB2 ASP 140 2HB ASP 140 -7.846 15.089 -2.588 1026 HB3 ASP 140 1HB ASP 140 -8.433 14.413 -4.105 1027 H GLU 141 H GLU 141 -10.572 13.417 -4.444 1028 HA GLU 141 HA GLU 141 -11.073 11.509 -2.229 1029 HB2 GLU 141 2HB GLU 141 -12.191 11.513 -5.069 1030 HB3 GLU 141 1HB GLU 141 -12.548 10.315 -3.826 1031 HG2 GLU 141 2HG GLU 141 -13.686 11.966 -2.468 1032 HG3 GLU 141 1HG GLU 141 -13.188 13.265 -3.550 1033 H ILE 142 H ILE 142 -10.545 9.255 -2.748 1034 HA ILE 142 HA ILE 142 -8.418 8.691 -4.643 1035 HB ILE 142 HB ILE 142 -7.159 9.732 -2.775 1036 HG12 ILE 142 2HG1 ILE 142 -5.582 7.845 -2.235 1037 HG13 ILE 142 1HG1 ILE 142 -6.743 6.703 -2.900 1038 HG21 ILE 142 1HG2 ILE 142 -8.750 9.338 -0.961 1039 HG22 ILE 142 2HG2 ILE 142 -7.143 8.773 -0.515 1040 HG23 ILE 142 3HG2 ILE 142 -8.383 7.610 -0.985 1041 HD11 ILE 142 3HD1 ILE 142 -6.461 7.695 -5.113 1042 HD12 ILE 142 1HD1 ILE 142 -4.910 7.188 -4.443 1043 HD13 ILE 142 2HD1 ILE 142 -5.351 8.896 -4.445 1044 H THR 143 H THR 143 -8.149 6.391 -4.847 1045 HA THR 143 HA THR 143 -10.418 4.848 -3.720 1046 HB THR 143 HB THR 143 -8.970 3.980 -6.243 1047 HG1 THR 143 HG1 THR 143 -10.732 6.197 -5.971 1048 HG21 THR 143 3HG2 THR 143 -11.245 3.241 -6.868 1049 HG22 THR 143 1HG2 THR 143 -11.889 3.933 -5.377 1050 HG23 THR 143 2HG2 THR 143 -10.774 2.568 -5.310 1051 H LEU 144 H LEU 144 -9.942 3.134 -2.433 1052 HA LEU 144 HA LEU 144 -7.142 2.339 -1.979 1053 HB2 LEU 144 2HB LEU 144 -9.605 2.412 -0.192 1054 HB3 LEU 144 1HB LEU 144 -8.227 1.418 0.220 1055 HG LEU 144 HG LEU 144 -8.230 3.496 1.502 1056 HD11 LEU 144 1HD1 LEU 144 -5.932 3.439 -0.467 1057 HD12 LEU 144 2HD1 LEU 144 -6.072 2.468 0.996 1058 HD13 LEU 144 3HD1 LEU 144 -5.928 4.220 1.117 1059 HD21 LEU 144 3HD2 LEU 144 -9.407 4.977 -0.053 1060 HD22 LEU 144 1HD2 LEU 144 -8.010 4.988 -1.137 1061 HD23 LEU 144 2HD2 LEU 144 -7.891 5.697 0.476 1062 H ASP 145 H ASP 145 -6.996 0.703 -3.524 1063 HA ASP 145 HA ASP 145 -8.921 -1.536 -3.425 1064 HB2 ASP 145 2HB ASP 145 -7.367 -2.191 -5.577 1065 HB3 ASP 145 1HB ASP 145 -8.813 -1.202 -5.682 1066 H PHE 146 H PHE 146 -8.258 -2.527 -1.591 1067 HA PHE 146 HA PHE 146 -5.561 -3.253 -0.926 1068 HB2 PHE 146 2HB PHE 146 -8.040 -4.652 0.153 1069 HB3 PHE 146 1HB PHE 146 -6.488 -4.402 0.952 1070 HD1 PHE 146 HD2 PHE 146 -5.842 -1.705 0.940 1071 HD2 PHE 146 HD1 PHE 146 -9.772 -3.394 1.087 1072 HE1 PHE 146 HE2 PHE 146 -6.700 0.348 1.949 1073 HE2 PHE 146 HE1 PHE 146 -10.619 -1.319 2.107 1074 HZ PHE 146 HZ PHE 146 -9.078 0.547 2.540 1075 H ASN 147 H ASN 147 -7.912 -4.557 -2.966 1076 HA ASN 147 HA ASN 147 -6.923 -7.241 -3.157 1077 HB2 ASN 147 2HB ASN 147 -8.514 -7.422 -5.038 1078 HB3 ASN 147 1HB ASN 147 -9.282 -6.693 -3.634 1079 HD21 ASN 147 1HD2 ASN 147 -8.049 -6.114 -6.841 1080 HD22 ASN 147 2HD2 ASN 147 -8.826 -4.589 -7.078 1081 H LEU 148 H LEU 148 -5.445 -4.396 -4.065 1082 HA LEU 148 HA LEU 148 -3.891 -5.801 -6.166 1083 HB2 LEU 148 2HB LEU 148 -4.232 -2.804 -5.782 1084 HB3 LEU 148 1HB LEU 148 -3.182 -3.559 -6.972 1085 HG LEU 148 HG LEU 148 -6.211 -3.452 -6.943 1086 HD11 LEU 148 1HD1 LEU 148 -5.877 -2.460 -9.190 1087 HD12 LEU 148 2HD1 LEU 148 -4.130 -2.563 -8.962 1088 HD13 LEU 148 3HD1 LEU 148 -5.099 -1.526 -7.912 1089 HD21 LEU 148 3HD2 LEU 148 -6.254 -4.920 -8.918 1090 HD22 LEU 148 1HD2 LEU 148 -5.628 -5.771 -7.508 1091 HD23 LEU 148 2HD2 LEU 148 -4.519 -5.206 -8.757 1092 H ALA 149 H ALA 149 -3.781 -5.314 -3.018 1093 HA ALA 149 HA ALA 149 -1.361 -4.001 -2.446 1094 HB1 ALA 149 3HB ALA 149 -1.453 -5.135 -0.270 1095 HB2 ALA 149 1HB ALA 149 -2.679 -6.251 -0.883 1096 HB3 ALA 149 2HB ALA 149 -3.047 -4.532 -0.727 1097 H TYR 150 H TYR 150 0.712 -4.882 -1.893 1098 HA TYR 150 HA TYR 150 1.478 -7.162 -3.627 1099 HB2 TYR 150 2HB TYR 150 3.480 -5.288 -2.340 1100 HB3 TYR 150 1HB TYR 150 3.622 -6.192 -3.841 1101 HD1 TYR 150 HD1 TYR 150 2.177 -5.379 -5.864 1102 HD2 TYR 150 HD2 TYR 150 2.807 -3.018 -2.352 1103 HE1 TYR 150 HE1 TYR 150 1.555 -3.346 -7.106 1104 HE2 TYR 150 HE2 TYR 150 2.188 -0.999 -3.595 1105 HH TYR 150 HH TYR 150 2.076 -0.175 -5.875 1106 H SER 151 H SER 151 2.881 -8.821 -2.805 1107 HA SER 151 HA SER 151 2.678 -9.754 -0.233 1108 HB2 SER 151 2HB SER 151 4.982 -10.126 -2.190 1109 HB3 SER 151 1HB SER 151 4.585 -11.195 -0.843 1110 HG SER 151 HG SER 151 3.561 -12.129 -2.487 1111 HA PRO 152 HA PRO 152 5.026 -6.666 1.965 1112 HB2 PRO 152 2HB PRO 152 5.006 -8.308 4.406 1113 HB3 PRO 152 1HB PRO 152 4.044 -6.866 4.036 1114 HG2 PRO 152 2HG PRO 152 2.982 -9.378 4.256 1115 HG3 PRO 152 1HG PRO 152 2.260 -8.091 3.268 1116 HD2 PRO 152 2HD PRO 152 3.957 -10.413 2.402 1117 HD3 PRO 152 1HD PRO 152 2.524 -9.706 1.620 1118 H PHE 153 H PHE 153 7.181 -6.393 1.537 1119 HA PHE 153 HA PHE 153 9.335 -7.935 1.561 1120 HB2 PHE 153 2HB PHE 153 9.181 -5.200 2.903 1121 HB3 PHE 153 1HB PHE 153 10.669 -5.982 2.396 1122 HD1 PHE 153 HD2 PHE 153 11.099 -6.351 -0.083 1123 HD2 PHE 153 HD1 PHE 153 7.856 -3.937 1.326 1124 HE1 PHE 153 HE2 PHE 153 10.931 -5.268 -2.289 1125 HE2 PHE 153 HE1 PHE 153 7.707 -2.856 -0.885 1126 HZ PHE 153 HZ PHE 153 9.248 -3.519 -2.688 1127 H CYS 154 H CYS 154 7.995 -6.536 4.565 1128 HA CYS 154 HA CYS 154 9.870 -7.564 6.376 1129 HB2 CYS 154 2HB CYS 154 8.443 -5.706 6.974 1130 HB3 CYS 154 1HB CYS 154 6.990 -6.683 6.786 1131 HG CYS 154 HG CYS 154 9.105 -7.977 9.018 1132 H ALA 155 H ALA 155 6.680 -8.866 5.384 1133 HA ALA 155 HA ALA 155 6.641 -11.065 7.168 1134 HB1 ALA 155 3HB ALA 155 4.751 -11.882 5.847 1135 HB2 ALA 155 1HB ALA 155 5.147 -10.743 4.552 1136 HB3 ALA 155 2HB ALA 155 4.621 -10.146 6.126 1137 H TYR 156 H TYR 156 8.450 -10.648 4.321 1138 HA TYR 156 HA TYR 156 9.000 -13.562 4.158 1139 HB2 TYR 156 2HB TYR 156 9.113 -11.462 1.961 1140 HB3 TYR 156 1HB TYR 156 9.737 -13.101 1.773 1141 HD1 TYR 156 HD2 TYR 156 8.048 -15.043 2.326 1142 HD2 TYR 156 HD1 TYR 156 6.814 -11.059 1.390 1143 HE1 TYR 156 HE2 TYR 156 5.812 -15.869 1.761 1144 HE2 TYR 156 HE1 TYR 156 4.569 -11.900 0.837 1145 HH TYR 156 HH TYR 156 3.514 -14.079 0.104 1146 H SER 157 H SER 157 10.408 -10.489 4.832 1147 HA SER 157 HA SER 157 12.891 -11.781 5.581 1148 HB2 SER 157 2HB SER 157 12.812 -9.559 3.498 1149 HB3 SER 157 1HB SER 157 14.261 -9.949 4.416 1150 HG SER 157 HG SER 157 12.868 -11.875 2.887 1151 H ASP 158 H ASP 158 13.252 -11.081 7.586 1152 HA ASP 158 HA ASP 158 12.019 -8.698 8.703 1153 HB2 ASP 158 2HB ASP 158 13.958 -10.666 10.003 1154 HB3 ASP 158 1HB ASP 158 13.049 -9.414 10.846 1155 H THR 159 H THR 159 14.829 -9.260 6.970 1156 HA THR 159 HA THR 159 16.679 -7.479 8.130 1157 HB THR 159 HB THR 159 17.248 -9.160 6.336 1158 HG1 THR 159 HG1 THR 159 18.060 -6.466 6.299 1159 HG21 THR 159 3HG2 THR 159 16.115 -7.092 4.418 1160 HG22 THR 159 1HG2 THR 159 15.382 -8.655 4.764 1161 HG23 THR 159 2HG2 THR 159 16.957 -8.581 3.979 1162 H PHE 160 H PHE 160 13.762 -6.922 6.342 1163 HA PHE 160 HA PHE 160 14.279 -4.042 6.020 1164 HB2 PHE 160 2HB PHE 160 11.745 -5.672 5.436 1165 HB3 PHE 160 1HB PHE 160 11.970 -3.964 5.087 1166 HD1 PHE 160 HD2 PHE 160 12.831 -7.399 4.047 1167 HD2 PHE 160 HD1 PHE 160 13.258 -3.238 3.133 1168 HE1 PHE 160 HE2 PHE 160 13.604 -7.969 1.786 1169 HE2 PHE 160 HE1 PHE 160 14.032 -3.824 0.869 1170 HZ PHE 160 HZ PHE 160 14.206 -6.190 0.198 1171 H SER 161 H SER 161 14.199 -3.071 8.013 1172 HA SER 161 HA SER 161 12.826 -4.127 10.266 1173 HB2 SER 161 2HB SER 161 13.848 -1.287 9.802 1174 HB3 SER 161 1HB SER 161 13.420 -1.991 11.367 1175 HG SER 161 HG SER 161 15.125 -3.667 10.281 1176 H CYS 162 H CYS 162 10.716 -3.789 10.979 1177 HA CYS 162 HA CYS 162 8.860 -3.167 8.891 1178 HB2 CYS 162 2HB CYS 162 7.195 -3.910 10.692 1179 HB3 CYS 162 1HB CYS 162 8.439 -5.085 10.288 1180 HG CYS 162 HG CYS 162 9.378 -5.384 12.630 1181 HA PRO 163 HA PRO 163 7.778 1.025 9.848 1182 HB2 PRO 163 2HB PRO 163 5.064 1.117 9.404 1183 HB3 PRO 163 1HB PRO 163 6.247 0.957 8.089 1184 HG2 PRO 163 2HG PRO 163 4.607 -1.171 9.409 1185 HG3 PRO 163 1HG PRO 163 4.948 -0.922 7.685 1186 HD2 PRO 163 2HD PRO 163 6.300 -2.763 9.149 1187 HD3 PRO 163 1HD PRO 163 7.064 -1.869 7.815 1188 H LEU 164 H LEU 164 6.584 2.444 11.270 1189 HA LEU 164 HA LEU 164 5.662 1.285 13.801 1190 HB2 LEU 164 2HB LEU 164 7.368 3.144 13.847 1191 HB3 LEU 164 1HB LEU 164 6.227 4.195 13.036 1192 HG LEU 164 HG LEU 164 6.525 4.548 15.568 1193 HD11 LEU 164 1HD1 LEU 164 4.163 5.042 16.025 1194 HD12 LEU 164 2HD1 LEU 164 3.678 4.090 14.620 1195 HD13 LEU 164 3HD1 LEU 164 4.629 5.560 14.403 1196 HD21 LEU 164 3HD2 LEU 164 5.302 3.090 17.113 1197 HD22 LEU 164 1HD2 LEU 164 6.565 2.196 16.270 1198 HD23 LEU 164 2HD2 LEU 164 4.878 2.004 15.788 1199 HA PRO 165 HA PRO 165 1.861 1.707 11.365 1200 HB2 PRO 165 2HB PRO 165 0.256 0.055 12.824 1201 HB3 PRO 165 1HB PRO 165 1.576 -0.582 11.819 1202 HG2 PRO 165 2HG PRO 165 1.524 -0.114 14.780 1203 HG3 PRO 165 1HG PRO 165 2.151 -1.509 13.873 1204 HD2 PRO 165 2HD PRO 165 3.762 0.504 14.818 1205 HD3 PRO 165 1HD PRO 165 4.152 -0.457 13.376 1206 HA PRO 166 HA PRO 166 -0.243 4.929 13.921 1207 HB2 PRO 166 2HB PRO 166 -1.869 5.819 11.883 1208 HB3 PRO 166 1HB PRO 166 -0.192 6.374 12.063 1209 HG2 PRO 166 2HG PRO 166 -1.286 4.234 10.259 1210 HG3 PRO 166 1HG PRO 166 -0.124 5.527 9.887 1211 HD2 PRO 166 2HD PRO 166 0.706 3.003 10.380 1212 HD3 PRO 166 1HD PRO 166 1.657 4.411 10.907 1213 H GLU 167 H GLU 167 -1.833 4.137 15.230 1214 HA GLU 167 HA GLU 167 -2.849 1.595 15.074 1215 HB2 GLU 167 2HB GLU 167 -4.124 3.869 16.633 1216 HB3 GLU 167 1HB GLU 167 -4.332 2.149 16.952 1217 HG2 GLU 167 2HG GLU 167 -1.897 1.976 17.447 1218 HG3 GLU 167 1HG GLU 167 -1.751 3.718 17.216 1219 H SER 168 H SER 168 -4.263 4.328 13.511 1220 HA SER 168 HA SER 168 -6.929 3.405 13.130 1221 HB2 SER 168 2HB SER 168 -5.278 5.318 11.429 1222 HB3 SER 168 1HB SER 168 -7.038 5.174 11.406 1223 HG SER 168 HG SER 168 -5.361 6.325 13.329 1224 H ASN 169 H ASN 169 -4.032 2.178 11.859 1225 HA ASN 169 HA ASN 169 -5.012 1.596 9.171 1226 HB2 ASN 169 2HB ASN 169 -2.788 1.037 8.550 1227 HB3 ASN 169 1HB ASN 169 -2.631 2.446 9.584 1228 HD21 ASN 169 1HD2 ASN 169 -0.681 0.316 8.896 1229 HD22 ASN 169 2HD2 ASN 169 -0.126 -0.311 10.405 1230 H TRP 170 H TRP 170 -4.984 0.177 12.218 1231 HA TRP 170 HA TRP 170 -4.849 -2.592 11.410 1232 HB2 TRP 170 2HB TRP 170 -5.914 -1.376 13.998 1233 HB3 TRP 170 1HB TRP 170 -5.568 -3.082 13.726 1234 HD1 TRP 170 HD1 TRP 170 -2.639 -2.299 12.236 1235 HE1 TRP 170 HE1 TRP 170 -0.689 -1.732 13.797 1236 HE3 TRP 170 HE3 TRP 170 -5.261 -1.263 16.511 1237 HZ2 TRP 170 HZ2 TRP 170 -0.281 -0.997 16.482 1238 HZ3 TRP 170 HZ3 TRP 170 -4.006 -0.649 18.542 1239 HH2 TRP 170 HH2 TRP 170 -1.563 -0.518 18.528 1240 H LEU 171 H LEU 171 -6.393 -3.131 9.952 1241 HA LEU 171 HA LEU 171 -9.122 -2.106 10.095 1242 HB2 LEU 171 2HB LEU 171 -8.102 -4.284 8.224 1243 HB3 LEU 171 1HB LEU 171 -9.473 -3.213 7.993 1244 HG LEU 171 HG LEU 171 -6.525 -2.474 7.766 1245 HD11 LEU 171 1HD1 LEU 171 -7.390 -3.746 5.849 1246 HD12 LEU 171 2HD1 LEU 171 -7.000 -2.088 5.398 1247 HD13 LEU 171 3HD1 LEU 171 -8.683 -2.562 5.635 1248 HD21 LEU 171 3HD2 LEU 171 -7.705 -0.573 8.729 1249 HD22 LEU 171 1HD2 LEU 171 -8.929 -0.648 7.455 1250 HD23 LEU 171 2HD2 LEU 171 -7.259 -0.232 7.059 1251 H GLU 172 H GLU 172 -10.588 -3.153 11.426 1252 HA GLU 172 HA GLU 172 -9.856 -5.723 12.625 1253 HB2 GLU 172 2HB GLU 172 -10.726 -3.714 13.936 1254 HB3 GLU 172 1HB GLU 172 -12.294 -3.972 13.188 1255 HG2 GLU 172 2HG GLU 172 -12.230 -4.882 15.462 1256 HG3 GLU 172 1HG GLU 172 -12.483 -6.158 14.276 1257 H THR 173 H THR 173 -10.137 -6.301 10.166 1258 HA THR 173 HA THR 173 -12.403 -7.997 9.791 1259 HB THR 173 HB THR 173 -13.495 -5.935 9.079 1260 HG1 THR 173 HG1 THR 173 -14.261 -7.317 7.684 1261 HG21 THR 173 3HG2 THR 173 -12.664 -4.541 7.220 1262 HG22 THR 173 1HG2 THR 173 -11.197 -5.519 7.120 1263 HG23 THR 173 2HG2 THR 173 -11.511 -4.541 8.557 1264 H ALA 174 H ALA 174 -12.131 -9.245 7.748 1265 HA ALA 174 HA ALA 174 -9.269 -9.683 7.174 1266 HB1 ALA 174 3HB ALA 174 -10.564 -11.621 7.973 1267 HB2 ALA 174 1HB ALA 174 -9.995 -11.883 6.323 1268 HB3 ALA 174 2HB ALA 174 -11.683 -11.454 6.618 1269 H VAL 175 H VAL 175 -8.432 -9.231 5.220 1270 HA VAL 175 HA VAL 175 -10.182 -8.289 3.034 1271 HB VAL 175 HB VAL 175 -7.158 -7.916 3.369 1272 HG11 VAL 175 1HG1 VAL 175 -7.770 -8.104 0.994 1273 HG12 VAL 175 2HG1 VAL 175 -7.302 -6.447 1.370 1274 HG13 VAL 175 3HG1 VAL 175 -9.008 -6.862 1.191 1275 HG21 VAL 175 3HG2 VAL 175 -8.425 -6.517 4.947 1276 HG22 VAL 175 1HG2 VAL 175 -9.423 -5.891 3.631 1277 HG23 VAL 175 2HG2 VAL 175 -7.701 -5.506 3.695 1278 H THR 176 H THR 176 -10.856 -10.307 2.407 1279 HA THR 176 HA THR 176 -8.988 -12.388 1.620 1280 HB THR 176 HB THR 176 -11.165 -13.601 0.995 1281 HG1 THR 176 HG1 THR 176 -12.428 -11.619 0.778 1282 HG21 THR 176 3HG2 THR 176 -10.073 -13.962 3.192 1283 HG22 THR 176 1HG2 THR 176 -11.832 -14.030 3.326 1284 HG23 THR 176 2HG2 THR 176 -10.963 -12.589 3.857 1285 H ALA 177 H ALA 177 -7.919 -11.895 -0.213 1286 HA ALA 177 HA ALA 177 -9.428 -11.508 -2.689 1287 HB1 ALA 177 3HB ALA 177 -7.287 -9.529 -1.813 1288 HB2 ALA 177 1HB ALA 177 -9.016 -9.195 -1.920 1289 HB3 ALA 177 2HB ALA 177 -8.093 -9.545 -3.384 1290 H GLY 178 H GLY 178 -8.218 -11.967 -4.538 1291 HA2 GLY 178 2HA GLY 178 -6.686 -12.959 -5.866 1292 HA3 GLY 178 1HA GLY 178 -5.486 -12.618 -4.637 1293 H GLU 179 H GLU 179 -4.852 -14.650 -5.814 1294 HA GLU 179 HA GLU 179 -5.777 -17.136 -4.695 1295 HB2 GLU 179 2HB GLU 179 -4.636 -16.829 -6.950 1296 HB3 GLU 179 1HB GLU 179 -3.140 -16.469 -6.097 1297 HG2 GLU 179 2HG GLU 179 -3.082 -18.714 -5.175 1298 HG3 GLU 179 1HG GLU 179 -4.661 -19.080 -5.868 1299 H ARG 180 H ARG 180 -4.322 -18.413 -3.220 1300 HA ARG 180 HA ARG 180 -3.687 -16.714 -0.932 1301 HB2 ARG 180 2HB ARG 180 -3.899 -19.736 -1.279 1302 HB3 ARG 180 1HB ARG 180 -3.461 -18.980 0.251 1303 HG2 ARG 180 2HG ARG 180 -5.619 -17.943 0.457 1304 HG3 ARG 180 1HG ARG 180 -6.052 -18.373 -1.198 1305 HD2 ARG 180 2HD ARG 180 -5.576 -20.366 1.047 1306 HD3 ARG 180 1HD ARG 180 -7.164 -19.824 0.486 1307 HE ARG 180 HE ARG 180 -5.483 -20.937 -1.590 1308 HH11 ARG 180 1HH1 ARG 180 -7.878 -21.772 0.870 1309 HH12 ARG 180 2HH1 ARG 180 -8.352 -23.239 0.072 1310 HH21 ARG 180 1HH2 ARG 180 -6.129 -22.844 -2.623 1311 HH22 ARG 180 2HH2 ARG 180 -7.358 -23.843 -1.910 1312 H THR 181 H THR 181 -1.788 -17.793 0.469 1313 HA THR 181 HA THR 181 0.637 -17.056 -0.939 1314 HB THR 181 HB THR 181 1.682 -17.451 1.361 1315 HG1 THR 181 HG1 THR 181 0.470 -18.717 2.570 1316 HG21 THR 181 3HG2 THR 181 0.903 -15.196 0.716 1317 HG22 THR 181 1HG2 THR 181 0.605 -15.489 2.432 1318 HG23 THR 181 2HG2 THR 181 -0.726 -15.587 1.276 1319 H ASP 182 H ASP 182 2.668 -18.607 -0.145 1320 HA ASP 182 HA ASP 182 2.215 -20.952 -1.797 1321 HB2 ASP 182 2HB ASP 182 4.317 -19.655 -2.026 1322 HB3 ASP 182 1HB ASP 182 4.772 -20.084 -0.378 1323 H LEU 183 H LEU 183 1.079 -22.526 -0.837 1324 HA LEU 183 HA LEU 183 1.053 -22.998 1.989 1325 HB2 LEU 183 2HB LEU 183 -0.634 -24.612 1.608 1326 HB3 LEU 183 1HB LEU 183 -0.921 -23.346 0.428 1327 HG LEU 183 HG LEU 183 0.477 -25.976 -0.242 1328 HD11 LEU 183 1HD1 LEU 183 -1.625 -26.739 -1.247 1329 HD12 LEU 183 2HD1 LEU 183 -2.441 -25.284 -0.668 1330 HD13 LEU 183 3HD1 LEU 183 -1.804 -26.458 0.485 1331 HD21 LEU 183 3HD2 LEU 183 0.992 -24.171 -1.833 1332 HD22 LEU 183 1HD2 LEU 183 -0.733 -23.897 -2.097 1333 HD23 LEU 183 2HD2 LEU 183 0.007 -25.424 -2.583 1334 H GLU 184 H GLU 184 3.094 -24.181 -0.513 1335 HA GLU 184 HA GLU 184 3.272 -26.910 0.541 1336 HB2 GLU 184 2HB GLU 184 4.400 -27.413 -1.633 1337 HB3 GLU 184 1HB GLU 184 2.783 -26.738 -1.804 1338 HG2 GLU 184 2HG GLU 184 3.787 -24.511 -2.261 1339 HG3 GLU 184 1HG GLU 184 5.388 -25.246 -2.196 1340 H HIS 185 H HIS 185 5.175 -24.029 0.737 1341 HA HIS 185 HA HIS 185 7.746 -25.302 0.833 1342 HB2 HIS 185 2HB HIS 185 8.689 -23.198 1.569 1343 HB3 HIS 185 1HB HIS 185 7.519 -22.880 0.302 1344 HD1 HIS 185 HD1 HIS 185 5.593 -21.334 0.864 1345 HD2 HIS 185 HD2 HIS 185 7.921 -22.248 4.173 1346 HE1 HIS 185 HE1 HIS 185 4.938 -19.676 2.637 1347 HE2 HIS 185 HE2 HIS 185 6.462 -20.157 4.562 Start of MODEL 20 1 H1 MET 1 1H MET 1 -19.339 0.834 -19.504 2 H2 MET 1 2H MET 1 -20.676 1.826 -19.203 3 H3 MET 1 3H MET 1 -19.691 1.323 -17.923 4 HA MET 1 HA MET 1 -18.845 3.086 -20.160 5 HB2 MET 1 2HB MET 1 -20.517 3.985 -18.354 6 HB3 MET 1 1HB MET 1 -19.174 3.882 -17.233 7 HG2 MET 1 2HG MET 1 -19.252 5.585 -19.731 8 HG3 MET 1 1HG MET 1 -19.524 6.158 -18.087 9 HE1 MET 1 3HE MET 1 -16.064 7.787 -18.676 10 HE2 MET 1 1HE MET 1 -17.687 8.003 -18.019 11 HE3 MET 1 2HE MET 1 -17.462 7.740 -19.748 12 H ASP 2 H ASP 2 -17.132 1.435 -20.393 13 HA ASP 2 HA ASP 2 -15.260 0.856 -18.299 14 HB2 ASP 2 2HB ASP 2 -15.136 0.419 -21.311 15 HB3 ASP 2 1HB ASP 2 -13.838 -0.073 -20.219 16 H GLU 3 H GLU 3 -15.610 3.504 -20.472 17 HA GLU 3 HA GLU 3 -12.992 4.453 -20.727 18 HB2 GLU 3 2HB GLU 3 -15.540 6.087 -20.433 19 HB3 GLU 3 1HB GLU 3 -14.022 6.676 -21.106 20 HG2 GLU 3 2HG GLU 3 -14.214 5.099 -22.970 21 HG3 GLU 3 1HG GLU 3 -15.694 4.436 -22.282 22 H ASP 4 H ASP 4 -15.263 4.715 -18.060 23 HA ASP 4 HA ASP 4 -13.377 6.094 -16.288 24 HB2 ASP 4 2HB ASP 4 -15.797 6.654 -16.167 25 HB3 ASP 4 1HB ASP 4 -16.182 4.983 -15.763 26 H THR 5 H THR 5 -15.015 2.910 -16.530 27 HA THR 5 HA THR 5 -14.109 1.846 -14.095 28 HB THR 5 HB THR 5 -15.075 0.324 -16.550 29 HG1 THR 5 HG1 THR 5 -16.373 1.954 -14.745 30 HG21 THR 5 3HG2 THR 5 -15.095 -0.470 -13.614 31 HG22 THR 5 1HG2 THR 5 -14.064 -1.171 -14.865 32 HG23 THR 5 2HG2 THR 5 -15.812 -1.395 -14.933 33 H GLU 6 H GLU 6 -13.040 0.924 -17.424 34 HA GLU 6 HA GLU 6 -10.956 -0.777 -16.500 35 HB2 GLU 6 2HB GLU 6 -10.533 -1.313 -18.719 36 HB3 GLU 6 1HB GLU 6 -12.186 -0.736 -18.851 37 HG2 GLU 6 2HG GLU 6 -11.332 1.462 -19.640 38 HG3 GLU 6 1HG GLU 6 -9.690 0.845 -19.530 39 H ASP 7 H ASP 7 -11.116 2.640 -17.055 40 HA ASP 7 HA ASP 7 -8.425 3.313 -17.515 41 HB2 ASP 7 2HB ASP 7 -10.250 4.946 -17.782 42 HB3 ASP 7 1HB ASP 7 -10.572 4.895 -16.055 43 H TRP 8 H TRP 8 -10.218 3.067 -14.432 44 HA TRP 8 HA TRP 8 -8.263 3.335 -12.542 45 HB2 TRP 8 2HB TRP 8 -10.356 2.870 -11.591 46 HB3 TRP 8 1HB TRP 8 -10.683 1.535 -12.688 47 HD1 TRP 8 HD1 TRP 8 -8.441 2.230 -9.533 48 HE1 TRP 8 HE1 TRP 8 -8.135 -0.003 -8.287 49 HE3 TRP 8 HE3 TRP 8 -10.899 -0.873 -12.778 50 HZ2 TRP 8 HZ2 TRP 8 -8.859 -2.713 -8.620 51 HZ3 TRP 8 HZ3 TRP 8 -11.053 -3.259 -12.234 52 HH2 TRP 8 HH2 TRP 8 -10.053 -4.168 -10.202 53 H GLU 9 H GLU 9 -8.952 0.294 -14.312 54 HA GLU 9 HA GLU 9 -6.805 -1.181 -13.169 55 HB2 GLU 9 2HB GLU 9 -8.779 -2.303 -14.095 56 HB3 GLU 9 1HB GLU 9 -8.430 -1.672 -15.702 57 HG2 GLU 9 2HG GLU 9 -6.354 -2.995 -15.772 58 HG3 GLU 9 1HG GLU 9 -6.696 -3.625 -14.162 59 H THR 10 H THR 10 -7.003 0.983 -15.923 60 HA THR 10 HA THR 10 -4.776 0.000 -17.410 61 HB THR 10 HB THR 10 -6.198 2.708 -17.554 62 HG1 THR 10 HG1 THR 10 -7.559 1.727 -18.883 63 HG21 THR 10 3HG2 THR 10 -4.310 1.397 -19.570 64 HG22 THR 10 1HG2 THR 10 -3.972 2.856 -18.633 65 HG23 THR 10 2HG2 THR 10 -5.244 2.865 -19.852 66 H GLN 11 H GLN 11 -5.138 3.031 -15.472 67 HA GLN 11 HA GLN 11 -2.443 3.766 -15.361 68 HB2 GLN 11 2HB GLN 11 -3.090 5.134 -13.368 69 HB3 GLN 11 1HB GLN 11 -4.228 5.307 -14.699 70 HG2 GLN 11 2HG GLN 11 -5.778 3.736 -13.571 71 HG3 GLN 11 1HG GLN 11 -4.635 3.576 -12.240 72 HE21 GLN 11 1HE2 GLN 11 -6.234 4.282 -10.777 73 HE22 GLN 11 2HE2 GLN 11 -6.719 5.936 -10.677 74 H LEU 12 H LEU 12 -4.274 1.538 -13.384 75 HA LEU 12 HA LEU 12 -2.476 1.361 -11.189 76 HB2 LEU 12 2HB LEU 12 -4.895 1.015 -11.010 77 HB3 LEU 12 1HB LEU 12 -4.790 -0.408 -12.035 78 HG LEU 12 HG LEU 12 -3.544 -1.613 -10.300 79 HD11 LEU 12 1HD1 LEU 12 -2.278 0.238 -9.310 80 HD12 LEU 12 2HD1 LEU 12 -3.149 -0.655 -8.070 81 HD13 LEU 12 3HD1 LEU 12 -3.758 0.909 -8.614 82 HD21 LEU 12 3HD2 LEU 12 -6.070 -0.307 -9.217 83 HD22 LEU 12 1HD2 LEU 12 -5.351 -1.810 -8.632 84 HD23 LEU 12 2HD2 LEU 12 -5.995 -1.724 -10.267 85 H GLN 13 H GLN 13 -3.118 -0.762 -13.971 86 HA GLN 13 HA GLN 13 -1.394 -2.868 -13.191 87 HB2 GLN 13 2HB GLN 13 -1.556 -3.691 -15.494 88 HB3 GLN 13 1HB GLN 13 -3.140 -3.223 -14.895 89 HG2 GLN 13 2HG GLN 13 -2.990 -1.113 -16.182 90 HG3 GLN 13 1HG GLN 13 -1.413 -1.604 -16.790 91 HE21 GLN 13 1HE2 GLN 13 -2.096 -4.383 -17.251 92 HE22 GLN 13 2HE2 GLN 13 -3.183 -4.423 -18.589 93 H ALA 14 H ALA 14 -0.928 0.082 -15.067 94 HA ALA 14 HA ALA 14 1.674 -0.374 -16.033 95 HB1 ALA 14 3HB ALA 14 0.200 1.375 -16.909 96 HB2 ALA 14 1HB ALA 14 1.743 2.061 -16.396 97 HB3 ALA 14 2HB ALA 14 0.309 2.254 -15.386 98 H ASN 15 H ASN 15 0.528 1.179 -13.045 99 HA ASN 15 HA ASN 15 2.932 2.010 -11.906 100 HB2 ASN 15 2HB ASN 15 0.409 0.998 -10.514 101 HB3 ASN 15 1HB ASN 15 1.722 1.834 -9.687 102 HD21 ASN 15 1HD2 ASN 15 -1.131 2.569 -10.018 103 HD22 ASN 15 2HD2 ASN 15 -1.121 4.144 -10.729 104 H ARG 16 H ARG 16 1.244 -1.088 -11.434 105 HA ARG 16 HA ARG 16 3.336 -2.140 -9.707 106 HB2 ARG 16 2HB ARG 16 1.911 -4.150 -9.503 107 HB3 ARG 16 1HB ARG 16 1.005 -2.674 -9.193 108 HG2 ARG 16 2HG ARG 16 0.014 -2.774 -11.431 109 HG3 ARG 16 1HG ARG 16 0.954 -4.219 -11.803 110 HD2 ARG 16 2HD ARG 16 -0.245 -5.444 -10.005 111 HD3 ARG 16 1HD ARG 16 -1.189 -3.991 -9.661 112 HE ARG 16 HE ARG 16 -2.080 -4.164 -11.955 113 HH11 ARG 16 1HH1 ARG 16 -0.817 -7.090 -10.473 114 HH12 ARG 16 2HH1 ARG 16 -1.785 -8.142 -11.458 115 HH21 ARG 16 1HH2 ARG 16 -3.326 -5.545 -13.230 116 HH22 ARG 16 2HH2 ARG 16 -3.200 -7.260 -13.021 117 H ASP 17 H ASP 17 2.829 -2.158 -13.121 118 HA ASP 17 HA ASP 17 3.814 -4.798 -13.710 119 HB2 ASP 17 2HB ASP 17 2.244 -3.543 -15.214 120 HB3 ASP 17 1HB ASP 17 3.528 -2.401 -15.583 121 H GLU 18 H GLU 18 5.160 -1.514 -14.173 122 HA GLU 18 HA GLU 18 7.833 -2.345 -14.667 123 HB2 GLU 18 2HB GLU 18 8.468 0.006 -14.129 124 HB3 GLU 18 1HB GLU 18 7.152 -0.111 -15.292 125 HG2 GLU 18 2HG GLU 18 5.517 0.510 -13.648 126 HG3 GLU 18 1HG GLU 18 6.688 0.375 -12.336 127 H LYS 19 H LYS 19 6.033 -2.234 -11.719 128 HA LYS 19 HA LYS 19 8.416 -2.327 -10.044 129 HB2 LYS 19 2HB LYS 19 5.462 -2.413 -9.345 130 HB3 LYS 19 1HB LYS 19 6.754 -2.578 -8.147 131 HG2 LYS 19 2HG LYS 19 7.663 -0.378 -8.809 132 HG3 LYS 19 1HG LYS 19 6.376 -0.205 -10.003 133 HD2 LYS 19 2HD LYS 19 4.696 -0.153 -8.197 134 HD3 LYS 19 1HD LYS 19 5.975 -0.376 -6.994 135 HE2 LYS 19 2HE LYS 19 7.007 1.765 -7.707 136 HE3 LYS 19 1HE LYS 19 5.717 1.983 -8.893 137 HZ1 LYS 19 3HZ LYS 19 4.125 2.158 -7.153 138 HZ2 LYS 19 1HZ LYS 19 5.385 3.233 -6.813 139 HZ3 LYS 19 2HZ LYS 19 5.270 1.764 -5.971 140 H ASP 20 H ASP 20 6.785 -4.567 -11.890 141 HA ASP 20 HA ASP 20 7.316 -6.957 -10.487 142 HB2 ASP 20 2HB ASP 20 6.015 -6.867 -12.596 143 HB3 ASP 20 1HB ASP 20 7.472 -6.439 -13.487 144 H ARG 21 H ARG 21 9.397 -4.745 -12.270 145 HA ARG 21 HA ARG 21 11.786 -6.428 -11.842 146 HB2 ARG 21 2HB ARG 21 12.979 -4.960 -13.350 147 HB3 ARG 21 1HB ARG 21 11.454 -5.384 -14.108 148 HG2 ARG 21 2HG ARG 21 10.529 -3.187 -13.560 149 HG3 ARG 21 1HG ARG 21 11.995 -2.764 -12.683 150 HD2 ARG 21 2HD ARG 21 12.014 -1.683 -14.858 151 HD3 ARG 21 1HD ARG 21 13.281 -2.914 -14.810 152 HE ARG 21 HE ARG 21 11.330 -4.311 -15.913 153 HH11 ARG 21 1HH1 ARG 21 12.396 -1.057 -16.731 154 HH12 ARG 21 2HH1 ARG 21 11.897 -1.189 -18.386 155 HH21 ARG 21 1HH2 ARG 21 10.597 -4.430 -18.036 156 HH22 ARG 21 2HH2 ARG 21 10.874 -3.106 -19.128 157 H PHE 22 H PHE 22 10.091 -4.121 -10.120 158 HA PHE 22 HA PHE 22 12.197 -2.699 -8.827 159 HB2 PHE 22 2HB PHE 22 9.734 -2.117 -8.799 160 HB3 PHE 22 1HB PHE 22 9.467 -3.442 -7.685 161 HD1 PHE 22 HD1 PHE 22 10.782 -0.023 -8.066 162 HD2 PHE 22 HD2 PHE 22 10.183 -3.245 -5.322 163 HE1 PHE 22 HE1 PHE 22 11.134 1.514 -6.180 164 HE2 PHE 22 HE2 PHE 22 10.532 -1.702 -3.439 165 HZ PHE 22 HZ PHE 22 11.009 0.680 -3.862 166 H PHE 23 H PHE 23 10.376 -5.628 -7.908 167 HA PHE 23 HA PHE 23 12.044 -6.288 -5.642 168 HB2 PHE 23 2HB PHE 23 9.699 -7.599 -7.027 169 HB3 PHE 23 1HB PHE 23 10.694 -8.587 -5.967 170 HD1 PHE 23 HD2 PHE 23 9.186 -5.117 -5.787 171 HD2 PHE 23 HD1 PHE 23 9.780 -8.889 -3.853 172 HE1 PHE 23 HE2 PHE 23 7.900 -4.333 -3.838 173 HE2 PHE 23 HE1 PHE 23 8.504 -8.093 -1.910 174 HZ PHE 23 HZ PHE 23 7.563 -5.820 -1.896 175 H SER 24 H SER 24 12.638 -6.601 -8.933 176 HA SER 24 HA SER 24 14.228 -9.084 -8.634 177 HB2 SER 24 2HB SER 24 13.016 -7.928 -11.175 178 HB3 SER 24 1HB SER 24 13.846 -9.479 -11.018 179 HG SER 24 HG SER 24 11.312 -9.110 -10.761 180 H GLU 25 H GLU 25 14.345 -5.758 -9.952 181 HA GLU 25 HA GLU 25 17.160 -6.173 -10.811 182 HB2 GLU 25 2HB GLU 25 14.975 -4.571 -12.223 183 HB3 GLU 25 1HB GLU 25 16.675 -4.540 -12.675 184 HG2 GLU 25 2HG GLU 25 14.868 -6.965 -12.752 185 HG3 GLU 25 1HG GLU 25 15.363 -6.006 -14.144 186 H HIS 26 H HIS 26 14.781 -3.814 -9.600 187 HA HIS 26 HA HIS 26 16.535 -1.601 -9.208 188 HB2 HIS 26 2HB HIS 26 14.203 -1.082 -9.128 189 HB3 HIS 26 1HB HIS 26 13.848 -2.399 -8.021 190 HD2 HIS 26 HD2 HIS 26 15.179 1.287 -7.916 191 HE1 HIS 26 HE1 HIS 26 14.344 -0.019 -3.979 192 HE2 HIS 26 HE2 HIS 26 15.074 1.938 -5.409 193 H ARG 27 H ARG 27 15.270 -4.070 -7.062 194 HA ARG 27 HA ARG 27 17.848 -4.194 -5.653 195 HB2 ARG 27 2HB ARG 27 15.098 -3.845 -4.462 196 HB3 ARG 27 1HB ARG 27 16.166 -4.968 -3.635 197 HG2 ARG 27 2HG ARG 27 16.794 -2.050 -4.206 198 HG3 ARG 27 1HG ARG 27 16.287 -2.717 -2.652 199 HD2 ARG 27 2HD ARG 27 18.325 -4.260 -2.800 200 HD3 ARG 27 1HD ARG 27 18.850 -3.270 -4.158 201 HE ARG 27 HE ARG 27 18.955 -1.368 -2.610 202 HH11 ARG 27 1HH1 ARG 27 18.922 -4.597 -1.209 203 HH12 ARG 27 2HH1 ARG 27 19.723 -4.102 0.247 204 HH21 ARG 27 1HH2 ARG 27 20.020 -0.741 -0.678 205 HH22 ARG 27 2HH2 ARG 27 20.344 -1.932 0.550 206 H GLN 28 H GLN 28 18.560 -6.218 -5.198 207 HA GLN 28 HA GLN 28 17.542 -8.525 -6.445 208 HB2 GLN 28 2HB GLN 28 19.099 -9.787 -4.958 209 HB3 GLN 28 1HB GLN 28 19.881 -8.424 -5.745 210 HG2 GLN 28 2HG GLN 28 19.575 -7.119 -3.606 211 HG3 GLN 28 1HG GLN 28 19.002 -8.605 -2.852 212 HE21 GLN 28 1HE2 GLN 28 21.778 -6.919 -4.117 213 HE22 GLN 28 2HE2 GLN 28 22.977 -8.014 -3.519 214 H SER 29 H SER 29 16.285 -10.189 -5.647 215 HA SER 29 HA SER 29 13.948 -9.373 -4.492 216 HB2 SER 29 2HB SER 29 14.945 -12.241 -4.619 217 HB3 SER 29 1HB SER 29 13.261 -11.724 -4.506 218 HG SER 29 HG SER 29 13.894 -10.480 -6.542 219 HA PRO 30 HA PRO 30 14.757 -9.621 0.039 220 HB2 PRO 30 2HB PRO 30 12.200 -8.845 0.763 221 HB3 PRO 30 1HB PRO 30 13.452 -7.683 0.282 222 HG2 PRO 30 2HG PRO 30 11.234 -8.842 -1.372 223 HG3 PRO 30 1HG PRO 30 11.786 -7.156 -1.256 224 HD2 PRO 30 2HD PRO 30 12.510 -8.720 -3.316 225 HD3 PRO 30 1HD PRO 30 13.627 -7.517 -2.635 226 H ILE 31 H ILE 31 12.034 -10.887 -1.811 227 HA ILE 31 HA ILE 31 11.143 -12.925 -0.081 228 HB ILE 31 HB ILE 31 11.079 -13.030 -3.144 229 HG12 ILE 31 2HG1 ILE 31 10.190 -10.830 -2.386 230 HG13 ILE 31 1HG1 ILE 31 8.940 -11.823 -3.116 231 HG21 ILE 31 1HG2 ILE 31 9.017 -14.369 -2.842 232 HG22 ILE 31 2HG2 ILE 31 9.202 -14.264 -1.090 233 HG23 ILE 31 3HG2 ILE 31 10.401 -15.127 -2.053 234 HD11 ILE 31 3HD1 ILE 31 8.108 -12.370 -0.838 235 HD12 ILE 31 1HD1 ILE 31 8.058 -10.646 -1.209 236 HD13 ILE 31 2HD1 ILE 31 9.327 -11.284 -0.169 237 HA PRO 32 HA PRO 32 15.021 -15.202 -0.236 238 HB2 PRO 32 2HB PRO 32 13.577 -17.526 0.985 239 HB3 PRO 32 1HB PRO 32 14.900 -16.548 1.653 240 HG2 PRO 32 2HG PRO 32 12.405 -16.360 2.617 241 HG3 PRO 32 1HG PRO 32 13.476 -14.941 2.515 242 HD2 PRO 32 2HD PRO 32 11.250 -15.760 0.652 243 HD3 PRO 32 1HD PRO 32 11.626 -14.157 1.316 244 HA PRO 33 HA PRO 33 15.004 -17.562 -3.982 245 HB2 PRO 33 2HB PRO 33 17.075 -19.380 -3.500 246 HB3 PRO 33 1HB PRO 33 17.312 -17.684 -3.957 247 HG2 PRO 33 2HG PRO 33 17.389 -18.924 -1.230 248 HG3 PRO 33 1HG PRO 33 18.481 -17.719 -1.955 249 HD2 PRO 33 2HD PRO 33 16.575 -16.971 -0.232 250 HD3 PRO 33 1HD PRO 33 16.971 -15.961 -1.640 251 H GLU 34 H GLU 34 14.460 -19.205 -0.961 252 HA GLU 34 HA GLU 34 13.638 -21.745 -2.046 253 HB2 GLU 34 2HB GLU 34 12.968 -20.500 0.665 254 HB3 GLU 34 1HB GLU 34 12.836 -22.201 0.235 255 HG2 GLU 34 2HG GLU 34 15.394 -20.600 0.508 256 HG3 GLU 34 1HG GLU 34 14.798 -21.839 1.608 257 H GLU 35 H GLU 35 11.940 -18.928 -0.656 258 HA GLU 35 HA GLU 35 9.319 -19.790 -1.126 259 HB2 GLU 35 2HB GLU 35 10.579 -17.142 -0.439 260 HB3 GLU 35 1HB GLU 35 8.872 -17.183 -0.854 261 HG2 GLU 35 2HG GLU 35 9.362 -17.247 1.595 262 HG3 GLU 35 1HG GLU 35 8.334 -18.550 1.007 263 H ARG 36 H ARG 36 11.484 -17.861 -3.207 264 HA ARG 36 HA ARG 36 9.342 -17.536 -5.170 265 HB2 ARG 36 2HB ARG 36 10.821 -15.917 -6.225 266 HB3 ARG 36 1HB ARG 36 10.619 -15.555 -4.515 267 HG2 ARG 36 2HG ARG 36 12.833 -16.551 -4.051 268 HG3 ARG 36 1HG ARG 36 13.029 -16.894 -5.774 269 HD2 ARG 36 2HD ARG 36 12.830 -14.176 -4.453 270 HD3 ARG 36 1HD ARG 36 14.235 -14.864 -5.263 271 HE ARG 36 HE ARG 36 12.194 -13.355 -6.450 272 HH11 ARG 36 1HH1 ARG 36 14.065 -16.257 -7.222 273 HH12 ARG 36 2HH1 ARG 36 13.866 -16.041 -8.929 274 HH21 ARG 36 1HH2 ARG 36 11.922 -13.163 -8.667 275 HH22 ARG 36 2HH2 ARG 36 12.666 -14.307 -9.736 276 H ASP 37 H ASP 37 11.554 -19.936 -4.643 277 HA ASP 37 HA ASP 37 12.914 -20.560 -6.897 278 HB2 ASP 37 2HB ASP 37 12.937 -21.931 -4.860 279 HB3 ASP 37 1HB ASP 37 11.333 -22.557 -5.236 280 H ASP 38 H ASP 38 9.433 -21.052 -6.549 281 HA ASP 38 HA ASP 38 9.208 -21.602 -9.446 282 HB2 ASP 38 2HB ASP 38 7.382 -23.181 -9.067 283 HB3 ASP 38 1HB ASP 38 8.804 -23.703 -8.178 284 H PHE 39 H PHE 39 8.447 -19.444 -7.021 285 HA PHE 39 HA PHE 39 6.130 -18.321 -8.524 286 HB2 PHE 39 2HB PHE 39 6.886 -17.996 -5.578 287 HB3 PHE 39 1HB PHE 39 5.591 -17.100 -6.366 288 HD1 PHE 39 HD2 PHE 39 3.932 -18.815 -7.764 289 HD2 PHE 39 HD1 PHE 39 6.122 -19.766 -4.214 290 HE1 PHE 39 HE2 PHE 39 2.316 -20.589 -7.240 291 HE2 PHE 39 HE1 PHE 39 4.495 -21.542 -3.700 292 HZ PHE 39 HZ PHE 39 2.592 -21.957 -5.210 293 H ASP 40 H ASP 40 6.535 -16.354 -9.522 294 HA ASP 40 HA ASP 40 9.055 -14.980 -9.171 295 HB2 ASP 40 2HB ASP 40 8.168 -13.248 -10.708 296 HB3 ASP 40 1HB ASP 40 8.010 -14.863 -11.369 297 H GLY 41 H GLY 41 9.425 -14.189 -7.180 298 HA2 GLY 41 2HA GLY 41 7.355 -13.828 -5.296 299 HA3 GLY 41 1HA GLY 41 9.056 -13.491 -5.047 300 H LEU 42 H LEU 42 5.994 -12.208 -5.781 301 HA LEU 42 HA LEU 42 6.708 -9.673 -4.578 302 HB2 LEU 42 2HB LEU 42 6.932 -9.600 -7.263 303 HB3 LEU 42 1HB LEU 42 5.184 -9.516 -7.212 304 HG LEU 42 HG LEU 42 7.156 -7.490 -6.078 305 HD11 LEU 42 1HD1 LEU 42 5.160 -7.235 -8.348 306 HD12 LEU 42 2HD1 LEU 42 6.913 -7.384 -8.504 307 HD13 LEU 42 3HD1 LEU 42 6.218 -5.957 -7.742 308 HD21 LEU 42 3HD2 LEU 42 5.243 -6.077 -5.448 309 HD22 LEU 42 1HD2 LEU 42 5.250 -7.589 -4.544 310 HD23 LEU 42 2HD2 LEU 42 4.127 -7.371 -5.888 311 H SER 43 H SER 43 5.432 -10.938 -2.990 312 HA SER 43 HA SER 43 2.928 -12.060 -3.565 313 HB2 SER 43 2HB SER 43 4.025 -11.193 -0.858 314 HB3 SER 43 1HB SER 43 2.696 -12.326 -1.123 315 HG SER 43 HG SER 43 4.180 -13.680 -2.225 316 H TYR 44 H TYR 44 1.175 -11.005 -4.168 317 HA TYR 44 HA TYR 44 -0.159 -9.240 -2.353 318 HB2 TYR 44 2HB TYR 44 -0.529 -7.331 -3.812 319 HB3 TYR 44 1HB TYR 44 1.195 -7.573 -3.635 320 HD1 TYR 44 HD2 TYR 44 2.521 -8.490 -5.608 321 HD2 TYR 44 HD1 TYR 44 -1.566 -7.337 -5.995 322 HE1 TYR 44 HE2 TYR 44 2.788 -8.352 -8.047 323 HE2 TYR 44 HE1 TYR 44 -1.307 -7.191 -8.426 324 HH TYR 44 HH TYR 44 1.500 -8.365 -10.054 325 H PHE 45 H PHE 45 -2.211 -8.395 -4.079 326 HA PHE 45 HA PHE 45 -3.533 -11.006 -4.649 327 HB2 PHE 45 2HB PHE 45 -5.043 -8.612 -3.555 328 HB3 PHE 45 1HB PHE 45 -5.531 -10.292 -3.551 329 HD1 PHE 45 HD1 PHE 45 -3.026 -11.500 -2.251 330 HD2 PHE 45 HD2 PHE 45 -5.328 -8.031 -1.282 331 HE1 PHE 45 HE1 PHE 45 -2.361 -11.704 0.107 332 HE2 PHE 45 HE2 PHE 45 -4.651 -8.235 1.062 333 HZ PHE 45 HZ PHE 45 -3.169 -10.069 1.766 334 H ASP 46 H ASP 46 -5.549 -10.595 -6.201 335 HA ASP 46 HA ASP 46 -4.444 -9.040 -8.419 336 HB2 ASP 46 2HB ASP 46 -5.951 -10.153 -9.888 337 HB3 ASP 46 1HB ASP 46 -5.409 -11.379 -8.760 338 HA PRO 47 HA PRO 47 -6.829 -5.262 -7.571 339 HB2 PRO 47 2HB PRO 47 -6.710 -5.086 -10.597 340 HB3 PRO 47 1HB PRO 47 -6.340 -3.844 -9.377 341 HG2 PRO 47 2HG PRO 47 -4.371 -5.095 -10.629 342 HG3 PRO 47 1HG PRO 47 -4.246 -4.742 -8.891 343 HD2 PRO 47 2HD PRO 47 -4.817 -7.352 -10.254 344 HD3 PRO 47 1HD PRO 47 -3.886 -7.030 -8.774 345 H ASP 48 H ASP 48 -8.896 -5.632 -7.002 346 HA ASP 48 HA ASP 48 -10.740 -6.966 -8.916 347 HB2 ASP 48 2HB ASP 48 -9.897 -8.434 -7.027 348 HB3 ASP 48 1HB ASP 48 -10.696 -7.354 -5.893 349 HA PRO 49 HA PRO 49 -13.277 -3.236 -8.173 350 HB2 PRO 49 2HB PRO 49 -15.530 -4.264 -9.495 351 HB3 PRO 49 1HB PRO 49 -14.203 -3.387 -10.277 352 HG2 PRO 49 2HG PRO 49 -14.660 -6.338 -10.088 353 HG3 PRO 49 1HG PRO 49 -14.080 -5.369 -11.463 354 HD2 PRO 49 2HD PRO 49 -12.379 -6.803 -9.968 355 HD3 PRO 49 1HD PRO 49 -11.914 -5.210 -10.611 356 H ASP 50 H ASP 50 -13.902 -6.507 -7.152 357 HA ASP 50 HA ASP 50 -16.311 -6.179 -5.686 358 HB2 ASP 50 2HB ASP 50 -15.451 -8.391 -6.306 359 HB3 ASP 50 1HB ASP 50 -14.040 -8.169 -5.281 360 H TYR 51 H TYR 51 -12.909 -5.995 -4.633 361 HA TYR 51 HA TYR 51 -13.694 -4.975 -1.974 362 HB2 TYR 51 2HB TYR 51 -11.296 -6.391 -3.047 363 HB3 TYR 51 1HB TYR 51 -10.914 -5.112 -1.903 364 HD1 TYR 51 HD2 TYR 51 -12.284 -5.115 0.327 365 HD2 TYR 51 HD1 TYR 51 -11.833 -8.552 -2.168 366 HE1 TYR 51 HE2 TYR 51 -12.851 -6.554 2.214 367 HE2 TYR 51 HE1 TYR 51 -12.405 -10.001 -0.270 368 HH TYR 51 HH TYR 51 -13.662 -8.768 2.683 369 H ARG 52 H ARG 52 -13.586 -3.572 -4.738 370 HA ARG 52 HA ARG 52 -11.773 -1.347 -4.245 371 HB2 ARG 52 2HB ARG 52 -12.177 -2.460 -6.509 372 HB3 ARG 52 1HB ARG 52 -13.779 -1.739 -6.500 373 HG2 ARG 52 2HG ARG 52 -12.692 0.516 -6.390 374 HG3 ARG 52 1HG ARG 52 -11.125 -0.281 -6.551 375 HD2 ARG 52 2HD ARG 52 -11.726 0.464 -8.731 376 HD3 ARG 52 1HD ARG 52 -11.978 -1.285 -8.731 377 HE ARG 52 HE ARG 52 -14.341 0.227 -8.067 378 HH11 ARG 52 1HH1 ARG 52 -12.528 -1.082 -10.776 379 HH12 ARG 52 2HH1 ARG 52 -13.891 -1.081 -11.841 380 HH21 ARG 52 1HH2 ARG 52 -16.104 0.250 -9.467 381 HH22 ARG 52 2HH2 ARG 52 -15.932 -0.320 -11.096 382 H VAL 53 H VAL 53 -12.494 0.105 -2.794 383 HA VAL 53 HA VAL 53 -15.323 0.983 -2.795 384 HB VAL 53 HB VAL 53 -15.135 1.530 -0.431 385 HG11 VAL 53 1HG1 VAL 53 -14.052 -1.286 -0.874 386 HG12 VAL 53 2HG1 VAL 53 -15.749 -0.804 -0.895 387 HG13 VAL 53 3HG1 VAL 53 -14.828 -0.706 0.604 388 HG21 VAL 53 3HG2 VAL 53 -12.222 0.635 -0.523 389 HG22 VAL 53 1HG2 VAL 53 -13.108 1.110 0.929 390 HG23 VAL 53 2HG2 VAL 53 -12.795 2.295 -0.338 391 H GLU 54 H GLU 54 -15.502 3.355 -2.147 392 HA GLU 54 HA GLU 54 -13.283 4.931 -3.314 393 HB2 GLU 54 2HB GLU 54 -14.948 6.730 -3.597 394 HB3 GLU 54 1HB GLU 54 -15.458 5.250 -4.396 395 HG2 GLU 54 2HG GLU 54 -17.021 4.784 -2.536 396 HG3 GLU 54 1HG GLU 54 -16.503 6.264 -1.732 397 H ALA 55 H ALA 55 -12.533 6.824 -2.233 398 HA ALA 55 HA ALA 55 -13.259 7.283 0.569 399 HB1 ALA 55 3HB ALA 55 -10.398 6.679 -0.288 400 HB2 ALA 55 1HB ALA 55 -11.422 5.616 0.679 401 HB3 ALA 55 2HB ALA 55 -10.914 7.176 1.327 402 H THR 56 H THR 56 -12.799 9.406 1.225 403 HA THR 56 HA THR 56 -11.929 11.287 -0.884 404 HB THR 56 HB THR 56 -13.182 12.005 1.810 405 HG1 THR 56 HG1 THR 56 -14.428 10.591 0.205 406 HG21 THR 56 3HG2 THR 56 -13.814 14.093 0.668 407 HG22 THR 56 1HG2 THR 56 -13.038 13.531 -0.825 408 HG23 THR 56 2HG2 THR 56 -12.068 13.877 0.605 409 H VAL 57 H VAL 57 -10.099 12.427 -0.694 410 HA VAL 57 HA VAL 57 -8.009 11.541 1.051 411 HB VAL 57 HB VAL 57 -8.004 13.862 -0.960 412 HG11 VAL 57 1HG1 VAL 57 -5.667 12.249 0.132 413 HG12 VAL 57 2HG1 VAL 57 -6.074 13.909 0.570 414 HG13 VAL 57 3HG1 VAL 57 -5.572 13.536 -1.079 415 HG21 VAL 57 3HG2 VAL 57 -8.727 11.784 -2.061 416 HG22 VAL 57 1HG2 VAL 57 -7.295 10.946 -1.460 417 HG23 VAL 57 2HG2 VAL 57 -7.127 12.266 -2.622 418 H THR 58 H THR 58 -7.213 12.553 2.846 419 HA THR 58 HA THR 58 -8.119 15.285 3.575 420 HB THR 58 HB THR 58 -7.547 12.988 5.520 421 HG1 THR 58 HG1 THR 58 -9.647 13.145 4.080 422 HG21 THR 58 3HG2 THR 58 -8.618 14.495 7.193 423 HG22 THR 58 1HG2 THR 58 -8.696 15.768 5.970 424 HG23 THR 58 2HG2 THR 58 -7.132 15.170 6.528 425 H VAL 59 H VAL 59 -6.258 16.348 2.900 426 HA VAL 59 HA VAL 59 -3.610 15.163 3.276 427 HB VAL 59 HB VAL 59 -4.498 17.752 1.892 428 HG11 VAL 59 1HG1 VAL 59 -2.149 18.029 1.142 429 HG12 VAL 59 2HG1 VAL 59 -1.660 16.658 2.141 430 HG13 VAL 59 3HG1 VAL 59 -2.269 18.128 2.900 431 HG21 VAL 59 3HG2 VAL 59 -5.015 15.671 0.683 432 HG22 VAL 59 1HG2 VAL 59 -3.326 15.164 0.801 433 HG23 VAL 59 2HG2 VAL 59 -3.761 16.583 -0.158 434 H HIS 60 H HIS 60 -2.344 15.643 4.945 435 HA HIS 60 HA HIS 60 -3.167 17.554 6.985 436 HB2 HIS 60 2HB HIS 60 -1.020 15.390 6.865 437 HB3 HIS 60 1HB HIS 60 -1.149 16.517 8.222 438 HD1 HIS 60 HD1 HIS 60 -3.115 13.762 6.505 439 HD2 HIS 60 HD2 HIS 60 -3.213 16.002 10.008 440 HE1 HIS 60 HE1 HIS 60 -4.984 12.801 7.874 441 HE2 HIS 60 HE2 HIS 60 -5.143 14.292 9.889 442 H GLU 61 H GLU 61 -2.441 19.507 7.063 443 HA GLU 61 HA GLU 61 -0.588 20.624 5.189 444 HB2 GLU 61 2HB GLU 61 -1.047 22.769 6.325 445 HB3 GLU 61 1HB GLU 61 -2.544 21.899 6.018 446 HG2 GLU 61 2HG GLU 61 -2.525 21.122 8.404 447 HG3 GLU 61 1HG GLU 61 -1.112 22.135 8.682 448 H THR 62 H THR 62 -0.414 19.485 8.482 449 HA THR 62 HA THR 62 2.486 20.030 8.599 450 HB THR 62 HB THR 62 2.202 19.855 11.121 451 HG1 THR 62 HG1 THR 62 -0.068 20.285 11.803 452 HG21 THR 62 3HG2 THR 62 2.339 22.092 10.052 453 HG22 THR 62 1HG2 THR 62 1.266 22.111 11.450 454 HG23 THR 62 2HG2 THR 62 0.587 22.081 9.823 455 HA PRO 63 HA PRO 63 2.149 15.434 8.309 456 HB2 PRO 63 2HB PRO 63 4.534 14.997 7.088 457 HB3 PRO 63 1HB PRO 63 3.139 15.627 6.188 458 HG2 PRO 63 2HG PRO 63 5.488 17.122 7.306 459 HG3 PRO 63 1HG PRO 63 4.717 17.265 5.709 460 HD2 PRO 63 2HD PRO 63 4.182 18.982 7.776 461 HD3 PRO 63 1HD PRO 63 3.003 18.602 6.502 462 H GLU 64 H GLU 64 2.817 13.980 9.872 463 HA GLU 64 HA GLU 64 5.030 14.718 11.671 464 HB2 GLU 64 2HB GLU 64 4.105 12.986 13.184 465 HB3 GLU 64 1HB GLU 64 2.915 14.208 12.761 466 HG2 GLU 64 2HG GLU 64 1.822 12.689 11.208 467 HG3 GLU 64 1HG GLU 64 3.064 11.465 11.473 468 H SER 65 H SER 65 6.430 12.938 12.456 469 HA SER 65 HA SER 65 7.543 11.457 10.190 470 HB2 SER 65 2HB SER 65 9.453 11.093 11.886 471 HB3 SER 65 1HB SER 65 9.164 12.748 11.364 472 HG SER 65 HG SER 65 9.325 12.887 13.525 473 H VAL 66 H VAL 66 6.747 9.504 9.868 474 HA VAL 66 HA VAL 66 6.138 7.686 12.124 475 HB VAL 66 HB VAL 66 5.007 7.557 9.278 476 HG11 VAL 66 1HG1 VAL 66 3.363 5.972 10.216 477 HG12 VAL 66 2HG1 VAL 66 4.141 6.082 11.796 478 HG13 VAL 66 3HG1 VAL 66 5.013 5.384 10.431 479 HG21 VAL 66 3HG2 VAL 66 3.683 8.727 11.762 480 HG22 VAL 66 1HG2 VAL 66 2.879 8.446 10.214 481 HG23 VAL 66 2HG2 VAL 66 4.194 9.614 10.323 482 H ASP 67 H ASP 67 7.552 6.042 12.320 483 HA ASP 67 HA ASP 67 9.693 5.624 10.400 484 HB2 ASP 67 2HB ASP 67 9.075 4.161 13.013 485 HB3 ASP 67 1HB ASP 67 10.572 4.031 12.095 486 H LEU 68 H LEU 68 9.241 4.432 8.634 487 HA LEU 68 HA LEU 68 7.858 1.809 8.904 488 HB2 LEU 68 2HB LEU 68 7.778 3.566 6.405 489 HB3 LEU 68 1HB LEU 68 6.883 2.082 6.690 490 HG LEU 68 HG LEU 68 6.415 4.724 8.130 491 HD11 LEU 68 1HD1 LEU 68 5.680 4.787 5.788 492 HD12 LEU 68 2HD1 LEU 68 4.337 4.901 6.918 493 HD13 LEU 68 3HD1 LEU 68 4.652 3.381 6.078 494 HD21 LEU 68 3HD2 LEU 68 4.400 3.672 9.100 495 HD22 LEU 68 1HD2 LEU 68 5.865 2.835 9.615 496 HD23 LEU 68 2HD2 LEU 68 4.840 2.130 8.362 497 H GLU 69 H GLU 69 8.558 0.495 6.654 498 HA GLU 69 HA GLU 69 11.514 0.735 6.459 499 HB2 GLU 69 2HB GLU 69 11.670 -1.613 6.006 500 HB3 GLU 69 1HB GLU 69 10.651 -1.421 7.422 501 HG2 GLU 69 2HG GLU 69 8.648 -1.882 6.094 502 HG3 GLU 69 1HG GLU 69 9.604 -1.955 4.618 503 H THR 70 H THR 70 12.508 0.243 4.459 504 HA THR 70 HA THR 70 10.864 0.643 2.013 505 HB THR 70 HB THR 70 12.316 2.614 2.600 506 HG1 THR 70 HG1 THR 70 11.864 2.391 0.464 507 HG21 THR 70 3HG2 THR 70 14.229 1.392 3.640 508 HG22 THR 70 1HG2 THR 70 14.750 2.500 2.371 509 HG23 THR 70 2HG2 THR 70 14.675 0.768 2.049 510 H SER 71 H SER 71 12.591 -0.031 0.054 511 HA SER 71 HA SER 71 12.954 -2.909 0.384 512 HB2 SER 71 2HB SER 71 13.316 -2.786 -2.133 513 HB3 SER 71 1HB SER 71 11.760 -2.159 -1.588 514 HG SER 71 HG SER 71 14.064 -0.637 -2.281 515 H ASP 72 H ASP 72 14.951 -0.948 1.628 516 HA ASP 72 HA ASP 72 17.401 -1.619 0.148 517 HB2 ASP 72 2HB ASP 72 16.428 1.216 0.697 518 HB3 ASP 72 1HB ASP 72 18.143 0.863 0.485 519 H ASP 73 H ASP 73 16.449 -2.734 2.425 520 HA ASP 73 HA ASP 73 17.165 -3.649 4.349 521 HB2 ASP 73 2HB ASP 73 19.790 -2.175 3.930 522 HB3 ASP 73 1HB ASP 73 19.531 -3.604 4.922 523 H ARG 74 H ARG 74 16.594 -0.374 4.306 524 HA ARG 74 HA ARG 74 17.745 0.173 6.979 525 HB2 ARG 74 2HB ARG 74 18.560 1.480 4.895 526 HB3 ARG 74 1HB ARG 74 16.977 2.247 4.868 527 HG2 ARG 74 2HG ARG 74 17.406 3.170 7.129 528 HG3 ARG 74 1HG ARG 74 18.997 2.407 7.129 529 HD2 ARG 74 2HD ARG 74 18.059 4.552 5.185 530 HD3 ARG 74 1HD ARG 74 19.134 4.803 6.560 531 HE ARG 74 HE ARG 74 20.375 2.876 5.040 532 HH11 ARG 74 1HH1 ARG 74 19.339 6.201 4.451 533 HH12 ARG 74 2HH1 ARG 74 20.579 6.504 3.277 534 HH21 ARG 74 1HH2 ARG 74 21.964 3.283 3.478 535 HH22 ARG 74 2HH2 ARG 74 22.075 4.840 2.722 536 H THR 75 H THR 75 16.512 1.939 8.162 537 HA THR 75 HA THR 75 13.580 1.466 8.129 538 HB THR 75 HB THR 75 15.303 2.293 10.529 539 HG1 THR 75 HG1 THR 75 15.199 -0.039 9.602 540 HG21 THR 75 3HG2 THR 75 13.197 1.933 11.838 541 HG22 THR 75 1HG2 THR 75 12.316 1.680 10.322 542 HG23 THR 75 2HG2 THR 75 13.045 3.249 10.676 543 H VAL 76 H VAL 76 12.431 3.323 7.722 544 HA VAL 76 HA VAL 76 14.013 5.743 7.144 545 HB VAL 76 HB VAL 76 12.781 5.879 4.913 546 HG11 VAL 76 1HG1 VAL 76 14.327 4.340 3.743 547 HG12 VAL 76 2HG1 VAL 76 14.711 3.554 5.278 548 HG13 VAL 76 3HG1 VAL 76 15.147 5.243 5.018 549 HG21 VAL 76 3HG2 VAL 76 11.844 3.813 3.954 550 HG22 VAL 76 1HG2 VAL 76 10.979 4.252 5.428 551 HG23 VAL 76 2HG2 VAL 76 12.163 2.945 5.458 552 H ARG 77 H ARG 77 13.020 7.599 7.344 553 HA ARG 77 HA ARG 77 10.545 7.807 8.809 554 HB2 ARG 77 2HB ARG 77 12.587 9.196 9.230 555 HB3 ARG 77 1HB ARG 77 12.415 9.942 7.654 556 HG2 ARG 77 2HG ARG 77 10.336 10.216 9.851 557 HG3 ARG 77 1HG ARG 77 11.697 11.314 9.672 558 HD2 ARG 77 2HD ARG 77 9.327 10.947 7.835 559 HD3 ARG 77 1HD ARG 77 9.872 12.421 8.638 560 HE ARG 77 HE ARG 77 11.111 11.135 6.287 561 HH11 ARG 77 1HH1 ARG 77 10.782 14.018 8.283 562 HH12 ARG 77 2HH1 ARG 77 11.704 15.002 7.195 563 HH21 ARG 77 1HH2 ARG 77 12.352 12.417 4.930 564 HH22 ARG 77 2HH2 ARG 77 12.590 14.095 5.295 565 H TYR 78 H TYR 78 8.632 7.877 7.857 566 HA TYR 78 HA TYR 78 8.232 9.093 5.188 567 HB2 TYR 78 2HB TYR 78 6.666 7.088 6.839 568 HB3 TYR 78 1HB TYR 78 5.828 8.067 5.641 569 HD1 TYR 78 HD2 TYR 78 8.872 5.828 5.875 570 HD2 TYR 78 HD1 TYR 78 5.601 7.193 3.510 571 HE1 TYR 78 HE2 TYR 78 9.455 4.213 4.105 572 HE2 TYR 78 HE1 TYR 78 6.179 5.595 1.752 573 HH TYR 78 HH TYR 78 8.362 3.040 2.233 574 H LEU 79 H LEU 79 6.815 10.810 4.978 575 HA LEU 79 HA LEU 79 5.986 12.215 7.439 576 HB2 LEU 79 2HB LEU 79 6.342 13.172 4.577 577 HB3 LEU 79 1HB LEU 79 5.547 14.144 5.805 578 HG LEU 79 HG LEU 79 8.448 13.225 5.857 579 HD11 LEU 79 1HD1 LEU 79 7.287 16.020 5.580 580 HD12 LEU 79 2HD1 LEU 79 8.029 15.078 4.287 581 HD13 LEU 79 3HD1 LEU 79 9.004 15.603 5.655 582 HD21 LEU 79 3HD2 LEU 79 6.931 14.864 7.923 583 HD22 LEU 79 1HD2 LEU 79 8.673 14.560 7.924 584 HD23 LEU 79 2HD2 LEU 79 7.547 13.224 8.137 585 H HIS 80 H HIS 80 3.881 12.495 7.949 586 HA HIS 80 HA HIS 80 1.896 10.921 6.578 587 HB2 HIS 80 2HB HIS 80 1.978 11.113 9.056 588 HB3 HIS 80 1HB HIS 80 1.638 12.835 8.939 589 HD2 HIS 80 HD2 HIS 80 -0.507 10.406 6.787 590 HE1 HIS 80 HE1 HIS 80 -2.793 11.693 10.099 591 HE2 HIS 80 HE2 HIS 80 -2.766 10.235 8.029 592 H VAL 81 H VAL 81 1.487 11.734 4.612 593 HA VAL 81 HA VAL 81 1.116 14.584 4.155 594 HB VAL 81 HB VAL 81 1.025 14.023 1.761 595 HG11 VAL 81 1HG1 VAL 81 3.305 12.629 3.217 596 HG12 VAL 81 2HG1 VAL 81 3.234 14.331 2.756 597 HG13 VAL 81 3HG1 VAL 81 3.315 13.083 1.509 598 HG21 VAL 81 3HG2 VAL 81 -0.210 11.885 1.921 599 HG22 VAL 81 1HG2 VAL 81 1.215 11.104 2.611 600 HG23 VAL 81 2HG2 VAL 81 1.247 11.709 0.956 601 H ALA 82 H ALA 82 -0.898 11.686 4.301 602 HA ALA 82 HA ALA 82 -3.319 13.298 4.202 603 HB1 ALA 82 3HB ALA 82 -2.835 13.037 1.793 604 HB2 ALA 82 1HB ALA 82 -4.308 12.172 2.241 605 HB3 ALA 82 2HB ALA 82 -2.803 11.284 1.979 606 H THR 83 H THR 83 -5.277 12.002 4.465 607 HA THR 83 HA THR 83 -4.980 9.197 5.282 608 HB THR 83 HB THR 83 -6.698 11.252 6.784 609 HG1 THR 83 HG1 THR 83 -4.750 9.888 8.163 610 HG21 THR 83 3HG2 THR 83 -7.150 9.405 8.365 611 HG22 THR 83 1HG2 THR 83 -6.210 8.293 7.366 612 HG23 THR 83 2HG2 THR 83 -7.717 8.980 6.752 613 H LEU 84 H LEU 84 -6.484 7.979 4.322 614 HA LEU 84 HA LEU 84 -8.341 9.223 2.426 615 HB2 LEU 84 2HB LEU 84 -7.437 6.311 2.543 616 HB3 LEU 84 1HB LEU 84 -8.237 7.128 1.209 617 HG LEU 84 HG LEU 84 -5.364 7.508 2.143 618 HD11 LEU 84 1HD1 LEU 84 -4.754 6.716 -0.106 619 HD12 LEU 84 2HD1 LEU 84 -6.462 6.502 -0.497 620 HD13 LEU 84 3HD1 LEU 84 -5.716 5.521 0.765 621 HD21 LEU 84 3HD2 LEU 84 -6.790 9.127 -0.001 622 HD22 LEU 84 1HD2 LEU 84 -5.057 9.167 0.334 623 HD23 LEU 84 2HD2 LEU 84 -6.201 9.733 1.548 624 H SER 85 H SER 85 -10.229 9.548 3.408 625 HA SER 85 HA SER 85 -11.144 7.896 5.636 626 HB2 SER 85 2HB SER 85 -11.050 10.386 5.823 627 HB3 SER 85 1HB SER 85 -12.222 10.522 4.514 628 HG SER 85 HG SER 85 -12.731 10.322 7.053 629 H PHE 86 H PHE 86 -12.720 6.384 5.395 630 HA PHE 86 HA PHE 86 -14.813 6.539 3.402 631 HB2 PHE 86 2HB PHE 86 -14.259 4.391 2.284 632 HB3 PHE 86 1HB PHE 86 -12.997 5.579 2.035 633 HD1 PHE 86 HD1 PHE 86 -10.789 5.330 3.198 634 HD2 PHE 86 HD2 PHE 86 -13.799 2.307 3.446 635 HE1 PHE 86 HE1 PHE 86 -9.105 3.710 3.955 636 HE2 PHE 86 HE2 PHE 86 -12.114 0.696 4.207 637 HZ PHE 86 HZ PHE 86 -9.763 1.391 4.464 638 H ASP 87 H ASP 87 -15.863 4.087 3.481 639 HA ASP 87 HA ASP 87 -15.839 3.077 6.252 640 HB2 ASP 87 2HB ASP 87 -18.292 2.867 6.302 641 HB3 ASP 87 1HB ASP 87 -17.808 4.544 6.119 642 H LEU 88 H LEU 88 -16.250 0.903 6.475 643 HA LEU 88 HA LEU 88 -16.674 -0.852 4.197 644 HB2 LEU 88 2HB LEU 88 -14.224 -0.354 4.073 645 HB3 LEU 88 1HB LEU 88 -14.035 -0.860 5.741 646 HG LEU 88 HG LEU 88 -14.749 -3.193 5.038 647 HD11 LEU 88 1HD1 LEU 88 -14.460 -2.097 2.216 648 HD12 LEU 88 2HD1 LEU 88 -15.956 -2.648 2.972 649 HD13 LEU 88 3HD1 LEU 88 -14.664 -3.800 2.649 650 HD21 LEU 88 3HD2 LEU 88 -12.564 -3.791 4.050 651 HD22 LEU 88 1HD2 LEU 88 -12.383 -2.650 5.383 652 HD23 LEU 88 2HD2 LEU 88 -12.245 -2.087 3.716 653 H ASP 89 H ASP 89 -17.658 -2.730 4.904 654 HA ASP 89 HA ASP 89 -18.356 -4.479 6.193 655 HB2 ASP 89 2HB ASP 89 -15.923 -4.667 6.754 656 HB3 ASP 89 1HB ASP 89 -16.173 -3.611 8.135 657 H GLY 90 H GLY 90 -19.429 -1.710 6.532 658 HA2 GLY 90 2HA GLY 90 -21.263 -0.848 7.650 659 HA3 GLY 90 1HA GLY 90 -21.209 -2.210 8.758 660 H GLU 91 H GLU 91 -18.202 -0.606 8.529 661 HA GLU 91 HA GLU 91 -18.799 1.202 10.795 662 HB2 GLU 91 2HB GLU 91 -16.717 0.614 11.895 663 HB3 GLU 91 1HB GLU 91 -17.652 -0.852 11.657 664 HG2 GLU 91 2HG GLU 91 -16.184 -1.698 10.058 665 HG3 GLU 91 1HG GLU 91 -15.522 -0.118 9.651 666 H SER 92 H SER 92 -17.177 2.953 11.039 667 HA SER 92 HA SER 92 -16.333 4.122 8.529 668 HB2 SER 92 2HB SER 92 -17.265 5.523 10.337 669 HB3 SER 92 1HB SER 92 -15.973 5.021 11.431 670 HG SER 92 HG SER 92 -15.765 6.560 9.061 671 H ARG 93 H ARG 93 -14.344 3.872 7.624 672 HA ARG 93 HA ARG 93 -12.083 2.924 9.260 673 HB2 ARG 93 2HB ARG 93 -12.988 1.884 6.553 674 HB3 ARG 93 1HB ARG 93 -11.380 1.583 7.185 675 HG2 ARG 93 2HG ARG 93 -13.927 0.711 8.583 676 HG3 ARG 93 1HG ARG 93 -13.010 -0.310 7.474 677 HD2 ARG 93 2HD ARG 93 -12.381 -0.915 9.704 678 HD3 ARG 93 1HD ARG 93 -11.021 -0.048 8.999 679 HE ARG 93 HE ARG 93 -12.960 1.181 10.867 680 HH11 ARG 93 1HH1 ARG 93 -9.598 0.691 9.893 681 HH12 ARG 93 2HH1 ARG 93 -8.970 1.736 11.123 682 HH21 ARG 93 1HH2 ARG 93 -12.102 2.568 12.437 683 HH22 ARG 93 2HH2 ARG 93 -10.386 2.796 12.558 684 H ASP 94 H ASP 94 -10.123 3.752 8.783 685 HA ASP 94 HA ASP 94 -9.808 5.588 6.491 686 HB2 ASP 94 2HB ASP 94 -8.756 7.283 7.892 687 HB3 ASP 94 1HB ASP 94 -10.359 6.929 8.516 688 H LEU 95 H LEU 95 -7.857 5.547 5.538 689 HA LEU 95 HA LEU 95 -5.660 3.927 6.728 690 HB2 LEU 95 2HB LEU 95 -6.487 4.122 3.795 691 HB3 LEU 95 1HB LEU 95 -4.979 3.403 4.341 692 HG LEU 95 HG LEU 95 -7.787 2.369 4.849 693 HD11 LEU 95 1HD1 LEU 95 -5.436 1.126 3.387 694 HD12 LEU 95 2HD1 LEU 95 -6.863 1.843 2.635 695 HD13 LEU 95 3HD1 LEU 95 -7.027 0.390 3.618 696 HD21 LEU 95 3HD2 LEU 95 -5.187 1.353 6.049 697 HD22 LEU 95 1HD2 LEU 95 -6.738 0.510 6.120 698 HD23 LEU 95 2HD2 LEU 95 -6.545 2.064 6.922 699 H HIS 96 H HIS 96 -3.750 5.013 6.943 700 HA HIS 96 HA HIS 96 -3.757 7.842 6.138 701 HB2 HIS 96 2HB HIS 96 -1.879 6.279 7.970 702 HB3 HIS 96 1HB HIS 96 -1.776 8.011 7.652 703 HD2 HIS 96 HD2 HIS 96 -4.311 5.510 9.349 704 HE1 HIS 96 HE1 HIS 96 -4.849 9.396 10.919 705 HE2 HIS 96 HE2 HIS 96 -5.754 7.043 10.845 706 H ALA 97 H ALA 97 -2.574 8.561 4.520 707 HA ALA 97 HA ALA 97 -0.843 6.732 2.992 708 HB1 ALA 97 3HB ALA 97 -1.159 8.376 1.151 709 HB2 ALA 97 1HB ALA 97 -2.145 9.384 2.217 710 HB3 ALA 97 2HB ALA 97 -2.704 7.775 1.754 711 H PHE 98 H PHE 98 1.310 7.075 2.996 712 HA PHE 98 HA PHE 98 2.406 9.624 4.032 713 HB2 PHE 98 2HB PHE 98 3.725 6.898 4.469 714 HB3 PHE 98 1HB PHE 98 4.105 8.427 5.244 715 HD1 PHE 98 HD1 PHE 98 2.484 9.341 6.980 716 HD2 PHE 98 HD2 PHE 98 2.207 5.358 5.481 717 HE1 PHE 98 HE1 PHE 98 1.160 8.697 8.944 718 HE2 PHE 98 HE2 PHE 98 0.884 4.713 7.454 719 HZ PHE 98 HZ PHE 98 0.355 6.382 9.184 720 H ARG 99 H ARG 99 4.490 10.127 3.276 721 HA ARG 99 HA ARG 99 5.524 8.777 0.880 722 HB2 ARG 99 2HB ARG 99 4.702 11.728 0.993 723 HB3 ARG 99 1HB ARG 99 5.654 11.017 -0.305 724 HG2 ARG 99 2HG ARG 99 3.837 9.701 -1.075 725 HG3 ARG 99 1HG ARG 99 2.928 9.937 0.412 726 HD2 ARG 99 2HD ARG 99 1.807 11.270 -1.089 727 HD3 ARG 99 1HD ARG 99 2.855 12.428 -0.279 728 HE ARG 99 HE ARG 99 4.197 11.524 -2.556 729 HH11 ARG 99 1HH1 ARG 99 1.285 13.387 -1.833 730 HH12 ARG 99 2HH1 ARG 99 1.348 14.280 -3.316 731 HH21 ARG 99 1HH2 ARG 99 4.261 12.702 -4.472 732 HH22 ARG 99 2HH2 ARG 99 3.041 13.889 -4.817 733 H GLN 100 H GLN 100 7.745 8.892 0.827 734 HA GLN 100 HA GLN 100 9.034 8.706 3.171 735 HB2 GLN 100 2HB GLN 100 10.077 9.262 0.395 736 HB3 GLN 100 1HB GLN 100 11.217 9.142 1.723 737 HG2 GLN 100 2HG GLN 100 9.237 6.919 1.243 738 HG3 GLN 100 1HG GLN 100 10.686 7.041 0.256 739 HE21 GLN 100 1HE2 GLN 100 10.634 7.913 3.707 740 HE22 GLN 100 2HE2 GLN 100 11.622 6.608 4.204 741 H ALA 101 H ALA 101 10.191 11.424 1.148 742 HA ALA 101 HA ALA 101 10.151 13.174 3.546 743 HB1 ALA 101 3HB ALA 101 12.452 12.613 2.867 744 HB2 ALA 101 1HB ALA 101 12.123 14.329 2.622 745 HB3 ALA 101 2HB ALA 101 12.140 13.227 1.243 746 H ALA 102 H ALA 102 10.635 13.794 0.059 747 HA ALA 102 HA ALA 102 8.340 15.660 0.055 748 HB1 ALA 102 3HB ALA 102 10.493 16.848 0.350 749 HB2 ALA 102 1HB ALA 102 9.770 17.221 -1.216 750 HB3 ALA 102 2HB ALA 102 11.122 16.090 -1.114 751 H ASP 103 H ASP 103 8.149 12.999 -0.831 752 HA ASP 103 HA ASP 103 8.798 12.411 -3.490 753 HB2 ASP 103 2HB ASP 103 8.039 10.686 -1.927 754 HB3 ASP 103 1HB ASP 103 6.476 11.465 -1.760 755 H GLU 104 H GLU 104 8.042 13.223 -5.366 756 HA GLU 104 HA GLU 104 5.385 14.535 -5.486 757 HB2 GLU 104 2HB GLU 104 7.765 14.996 -7.349 758 HB3 GLU 104 1HB GLU 104 6.219 15.840 -7.397 759 HG2 GLU 104 2HG GLU 104 6.755 16.608 -4.995 760 HG3 GLU 104 1HG GLU 104 8.392 16.039 -5.309 761 H SER 105 H SER 105 6.828 11.654 -6.119 762 HA SER 105 HA SER 105 5.785 10.984 -8.718 763 HB2 SER 105 2HB SER 105 7.781 9.857 -7.814 764 HB3 SER 105 1HB SER 105 6.857 9.255 -6.442 765 HG SER 105 HG SER 105 5.740 7.904 -7.793 766 H ARG 106 H ARG 106 4.255 11.440 -5.740 767 HA ARG 106 HA ARG 106 2.102 11.305 -5.095 768 HB2 ARG 106 2HB ARG 106 1.624 10.213 -7.897 769 HB3 ARG 106 1HB ARG 106 0.352 10.718 -6.787 770 HG2 ARG 106 2HG ARG 106 1.065 13.025 -6.890 771 HG3 ARG 106 1HG ARG 106 2.541 12.586 -7.749 772 HD2 ARG 106 2HD ARG 106 1.191 11.851 -9.684 773 HD3 ARG 106 1HD ARG 106 -0.283 12.337 -8.832 774 HE ARG 106 HE ARG 106 1.222 14.598 -8.811 775 HH11 ARG 106 1HH1 ARG 106 0.173 12.483 -11.416 776 HH12 ARG 106 2HH1 ARG 106 0.149 13.754 -12.592 777 HH21 ARG 106 1HH2 ARG 106 1.182 16.247 -10.373 778 HH22 ARG 106 2HH2 ARG 106 0.720 15.878 -12.004 779 H THR 107 H THR 107 4.089 9.120 -4.828 780 HA THR 107 HA THR 107 2.638 6.637 -4.930 781 HB THR 107 HB THR 107 5.324 7.266 -3.618 782 HG1 THR 107 HG1 THR 107 4.552 6.680 -6.282 783 HG21 THR 107 3HG2 THR 107 4.143 4.612 -4.553 784 HG22 THR 107 1HG2 THR 107 4.398 5.090 -2.874 785 HG23 THR 107 2HG2 THR 107 5.782 4.847 -3.941 786 H LEU 108 H LEU 108 0.879 6.812 -3.613 787 HA LEU 108 HA LEU 108 0.989 7.746 -0.866 788 HB2 LEU 108 2HB LEU 108 -1.291 6.435 -2.415 789 HB3 LEU 108 1HB LEU 108 -1.431 7.197 -0.836 790 HG LEU 108 HG LEU 108 -0.756 8.628 -3.434 791 HD11 LEU 108 1HD1 LEU 108 -3.094 7.876 -3.352 792 HD12 LEU 108 2HD1 LEU 108 -2.987 9.630 -3.239 793 HD13 LEU 108 3HD1 LEU 108 -3.310 8.677 -1.790 794 HD21 LEU 108 3HD2 LEU 108 -0.979 10.723 -2.123 795 HD22 LEU 108 1HD2 LEU 108 0.354 9.726 -1.539 796 HD23 LEU 108 2HD2 LEU 108 -1.167 9.776 -0.644 797 H PHE 109 H PHE 109 1.759 6.476 0.623 798 HA PHE 109 HA PHE 109 1.777 3.544 0.319 799 HB2 PHE 109 2HB PHE 109 3.916 4.943 0.653 800 HB3 PHE 109 1HB PHE 109 3.332 5.304 2.272 801 HD1 PHE 109 HD1 PHE 109 4.200 2.455 0.022 802 HD2 PHE 109 HD2 PHE 109 3.886 3.822 4.053 803 HE1 PHE 109 HE1 PHE 109 5.351 0.428 0.804 804 HE2 PHE 109 HE2 PHE 109 5.022 1.781 4.836 805 HZ PHE 109 HZ PHE 109 5.763 0.082 3.210 806 H VAL 110 H VAL 110 -0.125 2.799 1.209 807 HA VAL 110 HA VAL 110 -0.979 3.883 3.841 808 HB VAL 110 HB VAL 110 -3.312 3.082 3.370 809 HG11 VAL 110 1HG1 VAL 110 -2.758 5.439 3.064 810 HG12 VAL 110 2HG1 VAL 110 -3.956 4.936 1.875 811 HG13 VAL 110 3HG1 VAL 110 -2.268 5.139 1.395 812 HG21 VAL 110 3HG2 VAL 110 -2.912 1.399 1.631 813 HG22 VAL 110 1HG2 VAL 110 -2.343 2.646 0.518 814 HG23 VAL 110 2HG2 VAL 110 -4.033 2.623 1.038 815 HA PRO 111 HA PRO 111 0.164 -0.411 5.054 816 HB2 PRO 111 2HB PRO 111 0.629 0.939 7.686 817 HB3 PRO 111 1HB PRO 111 1.736 -0.075 6.736 818 HG2 PRO 111 2HG PRO 111 2.119 2.580 6.999 819 HG3 PRO 111 1HG PRO 111 2.569 1.693 5.524 820 HD2 PRO 111 2HD PRO 111 0.144 3.406 6.030 821 HD3 PRO 111 1HD PRO 111 1.183 3.310 4.591 822 H PHE 112 H PHE 112 -1.576 -1.613 5.646 823 HA PHE 112 HA PHE 112 -3.384 -0.573 7.723 824 HB2 PHE 112 2HB PHE 112 -5.323 -1.563 6.728 825 HB3 PHE 112 1HB PHE 112 -4.559 -0.579 5.498 826 HD1 PHE 112 HD1 PHE 112 -3.417 -1.665 3.558 827 HD2 PHE 112 HD2 PHE 112 -5.592 -3.965 6.435 828 HE1 PHE 112 HE1 PHE 112 -3.536 -3.542 1.985 829 HE2 PHE 112 HE2 PHE 112 -5.695 -5.846 4.853 830 HZ PHE 112 HZ PHE 112 -4.668 -5.633 2.621 831 H ARG 113 H ARG 113 -4.544 -2.383 8.796 832 HA ARG 113 HA ARG 113 -3.167 -4.979 8.807 833 HB2 ARG 113 2HB ARG 113 -1.996 -3.581 10.500 834 HB3 ARG 113 1HB ARG 113 -3.533 -3.201 11.270 835 HG2 ARG 113 2HG ARG 113 -3.824 -5.645 11.765 836 HG3 ARG 113 1HG ARG 113 -2.207 -5.925 11.113 837 HD2 ARG 113 2HD ARG 113 -1.267 -4.424 12.843 838 HD3 ARG 113 1HD ARG 113 -2.885 -4.182 13.510 839 HE ARG 113 HE ARG 113 -1.300 -6.663 13.570 840 HH11 ARG 113 1HH1 ARG 113 -4.084 -4.867 14.711 841 HH12 ARG 113 2HH1 ARG 113 -4.449 -6.007 15.959 842 HH21 ARG 113 1HH2 ARG 113 -1.802 -8.158 15.175 843 HH22 ARG 113 2HH2 ARG 113 -3.154 -7.884 16.226 844 H ASP 114 H ASP 114 -4.815 -6.474 8.671 845 HA ASP 114 HA ASP 114 -7.505 -5.655 9.621 846 HB2 ASP 114 2HB ASP 114 -8.505 -6.627 7.687 847 HB3 ASP 114 1HB ASP 114 -7.161 -5.681 7.068 848 H LYS 115 H LYS 115 -8.717 -8.214 9.240 849 HA LYS 115 HA LYS 115 -7.700 -9.454 11.668 850 HB2 LYS 115 2HB LYS 115 -10.083 -10.312 9.990 851 HB3 LYS 115 1HB LYS 115 -9.708 -10.833 11.630 852 HG2 LYS 115 2HG LYS 115 -10.530 -8.052 10.752 853 HG3 LYS 115 1HG LYS 115 -11.498 -9.195 11.670 854 HD2 LYS 115 2HD LYS 115 -8.941 -7.859 12.661 855 HD3 LYS 115 1HD LYS 115 -10.582 -7.369 13.086 856 HE2 LYS 115 2HE LYS 115 -9.291 -10.021 13.729 857 HE3 LYS 115 1HE LYS 115 -9.578 -8.711 14.865 858 HZ1 LYS 115 3HZ LYS 115 -11.975 -8.995 14.457 859 HZ2 LYS 115 1HZ LYS 115 -11.260 -10.386 15.110 860 HZ3 LYS 115 2HZ LYS 115 -11.638 -10.320 13.459 861 H THR 116 H THR 116 -7.398 -10.126 8.239 862 HA THR 116 HA THR 116 -6.735 -12.924 8.522 863 HB THR 116 HB THR 116 -5.925 -12.884 6.230 864 HG1 THR 116 HG1 THR 116 -6.367 -10.156 5.820 865 HG21 THR 116 3HG2 THR 116 -7.882 -12.051 4.996 866 HG22 THR 116 1HG2 THR 116 -8.405 -11.137 6.411 867 HG23 THR 116 2HG2 THR 116 -8.380 -12.905 6.458 868 H THR 117 H THR 117 -5.052 -9.873 8.745 869 HA THR 117 HA THR 117 -2.360 -10.592 8.489 870 HB THR 117 HB THR 117 -3.619 -8.454 10.281 871 HG1 THR 117 HG1 THR 117 -3.943 -8.463 7.857 872 HG21 THR 117 3HG2 THR 117 -1.431 -7.288 10.101 873 HG22 THR 117 1HG2 THR 117 -0.760 -8.683 9.259 874 HG23 THR 117 2HG2 THR 117 -1.277 -8.832 10.942 875 H GLY 118 H GLY 118 -1.246 -12.044 9.633 876 HA2 GLY 118 2HA GLY 118 -0.329 -13.006 11.600 877 HA3 GLY 118 1HA GLY 118 -1.756 -12.527 12.506 878 H GLN 119 H GLN 119 -3.716 -13.566 10.688 879 HA GLN 119 HA GLN 119 -3.694 -16.350 11.516 880 HB2 GLN 119 2HB GLN 119 -5.789 -14.786 9.937 881 HB3 GLN 119 1HB GLN 119 -6.007 -16.411 10.574 882 HG2 GLN 119 2HG GLN 119 -5.541 -13.938 12.267 883 HG3 GLN 119 1HG GLN 119 -7.119 -14.643 11.934 884 HE21 GLN 119 1HE2 GLN 119 -5.824 -14.215 14.510 885 HE22 GLN 119 2HE2 GLN 119 -5.690 -15.765 15.262 886 H GLN 120 H GLN 120 -4.871 -15.215 8.350 887 HA GLN 120 HA GLN 120 -3.301 -17.322 6.992 888 HB2 GLN 120 2HB GLN 120 -5.045 -16.966 5.099 889 HB3 GLN 120 1HB GLN 120 -5.549 -17.843 6.528 890 HG2 GLN 120 2HG GLN 120 -6.104 -14.892 6.264 891 HG3 GLN 120 1HG GLN 120 -7.143 -16.081 5.485 892 HE21 GLN 120 1HE2 GLN 120 -7.893 -14.228 7.593 893 HE22 GLN 120 2HE2 GLN 120 -8.417 -15.175 8.933 894 H SER 121 H SER 121 -2.880 -14.276 7.659 895 HA SER 121 HA SER 121 -1.176 -13.887 5.278 896 HB2 SER 121 2HB SER 121 -2.711 -11.667 6.727 897 HB3 SER 121 1HB SER 121 -1.510 -11.402 5.461 898 HG SER 121 HG SER 121 -4.004 -11.617 5.051 899 H TYR 122 H TYR 122 0.737 -12.525 5.849 900 HA TYR 122 HA TYR 122 2.009 -13.305 8.247 901 HB2 TYR 122 2HB TYR 122 3.351 -12.747 6.291 902 HB3 TYR 122 1HB TYR 122 2.704 -11.110 6.242 903 HD1 TYR 122 HD2 TYR 122 4.604 -13.377 8.605 904 HD2 TYR 122 HD1 TYR 122 4.037 -9.393 7.171 905 HE1 TYR 122 HE2 TYR 122 6.422 -12.596 10.046 906 HE2 TYR 122 HE1 TYR 122 5.859 -8.618 8.624 907 HH TYR 122 HH TYR 122 6.993 -9.314 10.673 908 H ASP 123 H ASP 123 2.510 -12.132 10.114 909 HA ASP 123 HA ASP 123 0.459 -10.383 11.113 910 HB2 ASP 123 2HB ASP 123 1.696 -10.483 13.253 911 HB3 ASP 123 1HB ASP 123 1.485 -12.086 12.565 912 H GLY 124 H GLY 124 1.743 -8.593 12.784 913 HA2 GLY 124 2HA GLY 124 2.631 -6.471 12.843 914 HA3 GLY 124 1HA GLY 124 3.490 -6.815 11.345 915 H GLY 125 H GLY 125 2.441 -6.476 9.355 916 HA2 GLY 125 2HA GLY 125 -0.314 -5.727 9.112 917 HA3 GLY 125 1HA GLY 125 0.763 -4.337 8.962 918 H ARG 126 H ARG 126 -0.676 -4.775 6.858 919 HA ARG 126 HA ARG 126 1.209 -5.794 4.807 920 HB2 ARG 126 2HB ARG 126 -1.860 -5.935 4.759 921 HB3 ARG 126 1HB ARG 126 -0.828 -6.300 3.380 922 HG2 ARG 126 2HG ARG 126 -0.813 -7.838 5.997 923 HG3 ARG 126 1HG ARG 126 -1.690 -8.325 4.546 924 HD2 ARG 126 2HD ARG 126 1.331 -8.026 4.778 925 HD3 ARG 126 1HD ARG 126 0.444 -9.552 4.750 926 HE ARG 126 HE ARG 126 1.036 -7.801 2.495 927 HH11 ARG 126 1HH1 ARG 126 -0.900 -10.542 3.593 928 HH12 ARG 126 2HH1 ARG 126 -1.220 -11.112 1.991 929 HH21 ARG 126 1HH2 ARG 126 0.609 -8.588 0.388 930 HH22 ARG 126 2HH2 ARG 126 -0.364 -10.004 0.178 931 H TYR 127 H TYR 127 1.693 -4.167 3.303 932 HA TYR 127 HA TYR 127 0.246 -1.604 3.684 933 HB2 TYR 127 2HB TYR 127 2.208 -0.501 2.655 934 HB3 TYR 127 1HB TYR 127 2.631 -1.398 4.104 935 HD1 TYR 127 HD2 TYR 127 3.939 -3.548 3.904 936 HD2 TYR 127 HD1 TYR 127 3.212 -1.076 0.494 937 HE1 TYR 127 HE2 TYR 127 5.747 -4.654 2.685 938 HE2 TYR 127 HE1 TYR 127 5.031 -2.210 -0.709 939 HH TYR 127 HH TYR 127 6.511 -5.074 0.496 940 H MET 128 H MET 128 -1.045 -0.940 2.211 941 HA MET 128 HA MET 128 -1.093 -2.072 -0.505 942 HB2 MET 128 2HB MET 128 -3.140 -1.822 1.225 943 HB3 MET 128 1HB MET 128 -3.189 -0.174 0.621 944 HG2 MET 128 2HG MET 128 -3.297 -2.551 -1.228 945 HG3 MET 128 1HG MET 128 -4.738 -1.875 -0.473 946 HE1 MET 128 3HE MET 128 -5.361 1.393 -2.233 947 HE2 MET 128 1HE MET 128 -4.850 1.055 -0.580 948 HE3 MET 128 2HE MET 128 -6.042 0.017 -1.364 949 H GLU 129 H GLU 129 -0.908 -0.617 -2.339 950 HA GLU 129 HA GLU 129 0.095 2.107 -1.714 951 HB2 GLU 129 2HB GLU 129 1.987 0.547 -1.974 952 HB3 GLU 129 1HB GLU 129 1.380 0.036 -3.542 953 HG2 GLU 129 2HG GLU 129 1.796 2.308 -4.431 954 HG3 GLU 129 1HG GLU 129 2.420 2.802 -2.854 955 H LEU 130 H LEU 130 -0.757 3.656 -2.923 956 HA LEU 130 HA LEU 130 -2.054 3.044 -5.524 957 HB2 LEU 130 2HB LEU 130 -2.877 5.510 -3.967 958 HB3 LEU 130 1HB LEU 130 -3.793 4.538 -5.100 959 HG LEU 130 HG LEU 130 -3.808 2.738 -3.172 960 HD11 LEU 130 1HD1 LEU 130 -3.773 3.701 -0.902 961 HD12 LEU 130 2HD1 LEU 130 -3.234 5.248 -1.561 962 HD13 LEU 130 3HD1 LEU 130 -2.200 3.822 -1.687 963 HD21 LEU 130 3HD2 LEU 130 -5.468 5.260 -2.918 964 HD22 LEU 130 1HD2 LEU 130 -5.870 3.671 -2.262 965 HD23 LEU 130 2HD2 LEU 130 -5.805 3.913 -4.005 966 H GLU 131 H GLU 131 -1.638 4.538 -7.197 967 HA GLU 131 HA GLU 131 -0.013 6.931 -6.620 968 HB2 GLU 131 2HB GLU 131 0.583 4.971 -8.895 969 HB3 GLU 131 1HB GLU 131 1.341 6.550 -8.686 970 HG2 GLU 131 2HG GLU 131 2.240 5.759 -6.481 971 HG3 GLU 131 1HG GLU 131 1.588 4.163 -6.836 972 HA PRO 132 HA PRO 132 -3.718 8.235 -9.040 973 HB2 PRO 132 2HB PRO 132 -3.634 10.882 -8.248 974 HB3 PRO 132 1HB PRO 132 -4.327 9.587 -7.240 975 HG2 PRO 132 2HG PRO 132 -1.566 10.769 -7.124 976 HG3 PRO 132 1HG PRO 132 -2.710 10.472 -5.794 977 HD2 PRO 132 2HD PRO 132 -0.716 8.760 -6.284 978 HD3 PRO 132 1HD PRO 132 -2.315 8.162 -5.787 979 H ASP 133 H ASP 133 -4.031 9.554 -10.835 980 HA ASP 133 HA ASP 133 -1.702 9.995 -12.525 981 HB2 ASP 133 2HB ASP 133 -3.763 8.848 -13.347 982 HB3 ASP 133 1HB ASP 133 -4.684 10.325 -13.092 983 H ARG 134 H ARG 134 -3.239 11.748 -10.244 984 HA ARG 134 HA ARG 134 -2.306 14.347 -11.199 985 HB2 ARG 134 2HB ARG 134 -4.410 15.418 -10.366 986 HB3 ARG 134 1HB ARG 134 -4.695 14.369 -11.753 987 HG2 ARG 134 2HG ARG 134 -5.833 12.760 -10.498 988 HG3 ARG 134 1HG ARG 134 -5.053 13.228 -8.985 989 HD2 ARG 134 2HD ARG 134 -6.349 15.241 -8.897 990 HD3 ARG 134 1HD ARG 134 -7.105 14.908 -10.452 991 HE ARG 134 HE ARG 134 -7.636 13.626 -7.869 992 HH11 ARG 134 1HH1 ARG 134 -8.452 13.811 -11.290 993 HH12 ARG 134 2HH1 ARG 134 -9.938 12.941 -11.086 994 HH21 ARG 134 1HH2 ARG 134 -9.536 12.508 -7.621 995 HH22 ARG 134 2HH2 ARG 134 -10.560 12.194 -8.995 996 H ASP 135 H ASP 135 -2.189 15.897 -9.298 997 HA ASP 135 HA ASP 135 -1.344 14.521 -6.869 998 HB2 ASP 135 2HB ASP 135 -0.017 16.441 -7.619 999 HB3 ASP 135 1HB ASP 135 -1.436 17.483 -7.565 1000 H LEU 136 H LEU 136 -2.475 14.485 -4.947 1001 HA LEU 136 HA LEU 136 -5.357 15.108 -5.138 1002 HB2 LEU 136 2HB LEU 136 -3.926 13.231 -3.213 1003 HB3 LEU 136 1HB LEU 136 -5.665 13.436 -3.362 1004 HG LEU 136 HG LEU 136 -3.783 12.151 -5.370 1005 HD11 LEU 136 1HD1 LEU 136 -4.476 10.738 -3.472 1006 HD12 LEU 136 2HD1 LEU 136 -5.107 10.141 -5.002 1007 HD13 LEU 136 3HD1 LEU 136 -6.170 11.008 -3.891 1008 HD21 LEU 136 3HD2 LEU 136 -5.736 11.769 -6.829 1009 HD22 LEU 136 1HD2 LEU 136 -5.382 13.487 -6.650 1010 HD23 LEU 136 2HD2 LEU 136 -6.728 12.767 -5.764 1011 H SER 137 H SER 137 -6.323 16.471 -3.795 1012 HA SER 137 HA SER 137 -4.846 17.663 -1.517 1013 HB2 SER 137 2HB SER 137 -6.251 19.714 -1.920 1014 HB3 SER 137 1HB SER 137 -5.206 19.331 -3.288 1015 HG SER 137 HG SER 137 -6.896 18.976 -4.481 1016 H ASP 138 H ASP 138 -6.424 18.521 0.188 1017 HA ASP 138 HA ASP 138 -8.175 16.469 1.071 1018 HB2 ASP 138 2HB ASP 138 -8.812 18.057 2.885 1019 HB3 ASP 138 1HB ASP 138 -7.075 17.897 2.702 1020 H GLY 139 H GLY 139 -10.065 15.992 0.225 1021 HA2 GLY 139 2HA GLY 139 -12.440 16.707 -0.012 1022 HA3 GLY 139 1HA GLY 139 -11.854 18.130 -0.863 1023 H ASP 140 H ASP 140 -9.751 16.369 -2.150 1024 HA ASP 140 HA ASP 140 -11.137 15.532 -4.523 1025 HB2 ASP 140 2HB ASP 140 -8.654 16.335 -4.255 1026 HB3 ASP 140 1HB ASP 140 -8.307 14.701 -3.727 1027 H GLU 141 H GLU 141 -11.146 13.192 -5.307 1028 HA GLU 141 HA GLU 141 -11.535 11.296 -3.048 1029 HB2 GLU 141 2HB GLU 141 -12.651 11.120 -5.885 1030 HB3 GLU 141 1HB GLU 141 -13.054 10.069 -4.525 1031 HG2 GLU 141 2HG GLU 141 -14.114 11.938 -3.353 1032 HG3 GLU 141 1HG GLU 141 -13.626 13.040 -4.645 1033 H ILE 142 H ILE 142 -11.076 9.002 -3.555 1034 HA ILE 142 HA ILE 142 -8.971 8.405 -5.441 1035 HB ILE 142 HB ILE 142 -7.678 9.421 -3.608 1036 HG12 ILE 142 2HG1 ILE 142 -6.108 7.536 -3.101 1037 HG13 ILE 142 1HG1 ILE 142 -7.305 6.386 -3.682 1038 HG21 ILE 142 1HG2 ILE 142 -7.620 8.466 -1.333 1039 HG22 ILE 142 2HG2 ILE 142 -8.927 7.361 -1.762 1040 HG23 ILE 142 3HG2 ILE 142 -9.214 9.100 -1.746 1041 HD11 ILE 142 3HD1 ILE 142 -7.108 7.331 -5.939 1042 HD12 ILE 142 1HD1 ILE 142 -5.549 6.784 -5.324 1043 HD13 ILE 142 2HD1 ILE 142 -5.929 8.505 -5.347 1044 H THR 143 H THR 143 -8.812 6.202 -5.837 1045 HA THR 143 HA THR 143 -11.056 4.533 -4.944 1046 HB THR 143 HB THR 143 -9.028 4.149 -7.202 1047 HG1 THR 143 HG1 THR 143 -10.577 5.983 -7.287 1048 HG21 THR 143 3HG2 THR 143 -10.031 2.020 -6.511 1049 HG22 THR 143 1HG2 THR 143 -10.657 2.516 -8.082 1050 HG23 THR 143 2HG2 THR 143 -11.647 2.723 -6.634 1051 H LEU 144 H LEU 144 -10.766 2.722 -3.626 1052 HA LEU 144 HA LEU 144 -8.043 2.057 -2.678 1053 HB2 LEU 144 2HB LEU 144 -10.581 2.682 -1.134 1054 HB3 LEU 144 1HB LEU 144 -9.492 1.486 -0.470 1055 HG LEU 144 HG LEU 144 -9.253 3.773 0.529 1056 HD11 LEU 144 1HD1 LEU 144 -6.814 3.796 0.599 1057 HD12 LEU 144 2HD1 LEU 144 -6.738 2.761 -0.828 1058 HD13 LEU 144 3HD1 LEU 144 -7.417 2.139 0.676 1059 HD21 LEU 144 3HD2 LEU 144 -8.126 5.558 -0.698 1060 HD22 LEU 144 1HD2 LEU 144 -9.635 5.122 -1.497 1061 HD23 LEU 144 2HD2 LEU 144 -8.095 4.573 -2.162 1062 H ASP 145 H ASP 145 -8.022 0.202 -4.123 1063 HA ASP 145 HA ASP 145 -9.773 -1.991 -3.162 1064 HB2 ASP 145 2HB ASP 145 -8.999 -3.314 -5.142 1065 HB3 ASP 145 1HB ASP 145 -9.943 -1.898 -5.533 1066 H PHE 146 H PHE 146 -8.988 -2.825 -1.483 1067 HA PHE 146 HA PHE 146 -6.365 -2.684 -0.481 1068 HB2 PHE 146 2HB PHE 146 -8.455 -4.698 0.439 1069 HB3 PHE 146 1HB PHE 146 -7.173 -3.955 1.402 1070 HD1 PHE 146 HD2 PHE 146 -7.241 -1.254 1.368 1071 HD2 PHE 146 HD1 PHE 146 -10.620 -3.796 0.711 1072 HE1 PHE 146 HE2 PHE 146 -8.745 0.598 1.925 1073 HE2 PHE 146 HE1 PHE 146 -12.121 -1.928 1.265 1074 HZ PHE 146 HZ PHE 146 -11.188 0.267 1.872 1075 H ASN 147 H ASN 147 -7.315 -4.636 -2.899 1076 HA ASN 147 HA ASN 147 -5.855 -7.029 -2.411 1077 HB2 ASN 147 2HB ASN 147 -7.035 -5.871 -4.970 1078 HB3 ASN 147 1HB ASN 147 -6.345 -7.491 -4.829 1079 HD21 ASN 147 1HD2 ASN 147 -8.301 -8.513 -5.321 1080 HD22 ASN 147 2HD2 ASN 147 -9.653 -8.521 -4.247 1081 H LEU 148 H LEU 148 -4.839 -3.915 -3.270 1082 HA LEU 148 HA LEU 148 -2.468 -4.709 -4.792 1083 HB2 LEU 148 2HB LEU 148 -3.129 -1.991 -3.603 1084 HB3 LEU 148 1HB LEU 148 -2.058 -2.332 -4.953 1085 HG LEU 148 HG LEU 148 -5.054 -2.816 -5.007 1086 HD11 LEU 148 1HD1 LEU 148 -3.617 -0.425 -6.176 1087 HD12 LEU 148 2HD1 LEU 148 -4.615 -0.420 -4.720 1088 HD13 LEU 148 3HD1 LEU 148 -5.351 -0.792 -6.281 1089 HD21 LEU 148 3HD2 LEU 148 -3.061 -2.769 -7.288 1090 HD22 LEU 148 1HD2 LEU 148 -4.803 -3.044 -7.416 1091 HD23 LEU 148 2HD2 LEU 148 -3.789 -4.213 -6.577 1092 H ALA 149 H ALA 149 -2.988 -5.531 -1.849 1093 HA ALA 149 HA ALA 149 -1.049 -4.115 -0.283 1094 HB1 ALA 149 3HB ALA 149 -3.114 -4.943 0.749 1095 HB2 ALA 149 1HB ALA 149 -1.702 -5.672 1.518 1096 HB3 ALA 149 2HB ALA 149 -2.665 -6.606 0.369 1097 H TYR 150 H TYR 150 0.998 -4.469 -0.529 1098 HA TYR 150 HA TYR 150 2.121 -7.029 -1.418 1099 HB2 TYR 150 2HB TYR 150 3.725 -4.543 -0.712 1100 HB3 TYR 150 1HB TYR 150 4.187 -5.864 -1.780 1101 HD1 TYR 150 HD1 TYR 150 2.066 -6.132 -3.694 1102 HD2 TYR 150 HD2 TYR 150 3.537 -2.541 -1.933 1103 HE1 TYR 150 HE1 TYR 150 1.223 -4.856 -5.601 1104 HE2 TYR 150 HE2 TYR 150 2.718 -1.265 -3.857 1105 HH TYR 150 HH TYR 150 2.042 -1.517 -6.098 1106 H SER 151 H SER 151 3.543 -8.245 -0.131 1107 HA SER 151 HA SER 151 3.156 -8.077 2.717 1108 HB2 SER 151 2HB SER 151 4.861 -9.970 1.042 1109 HB3 SER 151 1HB SER 151 4.489 -10.165 2.757 1110 HG SER 151 HG SER 151 3.089 -11.368 1.344 1111 HA PRO 152 HA PRO 152 6.719 -5.521 3.571 1112 HB2 PRO 152 2HB PRO 152 7.068 -6.014 6.248 1113 HB3 PRO 152 1HB PRO 152 5.701 -5.078 5.614 1114 HG2 PRO 152 2HG PRO 152 5.788 -7.923 6.502 1115 HG3 PRO 152 1HG PRO 152 4.526 -6.697 6.757 1116 HD2 PRO 152 2HD PRO 152 4.383 -8.657 4.820 1117 HD3 PRO 152 1HD PRO 152 3.547 -7.091 4.704 1118 H PHE 153 H PHE 153 8.970 -5.590 3.698 1119 HA PHE 153 HA PHE 153 10.111 -7.932 2.637 1120 HB2 PHE 153 2HB PHE 153 11.643 -5.524 3.701 1121 HB3 PHE 153 1HB PHE 153 12.111 -6.612 2.401 1122 HD1 PHE 153 HD2 PHE 153 11.132 -6.328 0.149 1123 HD2 PHE 153 HD1 PHE 153 10.052 -3.686 3.309 1124 HE1 PHE 153 HE2 PHE 153 10.193 -4.762 -1.490 1125 HE2 PHE 153 HE1 PHE 153 9.105 -2.114 1.671 1126 HZ PHE 153 HZ PHE 153 9.173 -2.652 -0.734 1127 H CYS 154 H CYS 154 9.992 -6.612 5.858 1128 HA CYS 154 HA CYS 154 12.128 -7.734 7.203 1129 HB2 CYS 154 2HB CYS 154 10.725 -7.559 9.226 1130 HB3 CYS 154 1HB CYS 154 10.498 -6.148 8.190 1131 HG CYS 154 HG CYS 154 8.352 -8.779 8.591 1132 H ALA 155 H ALA 155 9.024 -9.241 6.397 1133 HA ALA 155 HA ALA 155 9.163 -11.604 7.933 1134 HB1 ALA 155 3HB ALA 155 7.787 -11.161 5.261 1135 HB2 ALA 155 1HB ALA 155 7.112 -10.791 6.846 1136 HB3 ALA 155 2HB ALA 155 7.436 -12.465 6.404 1137 H TYR 156 H TYR 156 10.631 -10.741 4.912 1138 HA TYR 156 HA TYR 156 11.210 -13.528 4.173 1139 HB2 TYR 156 2HB TYR 156 11.055 -10.988 2.489 1140 HB3 TYR 156 1HB TYR 156 11.432 -12.596 1.872 1141 HD1 TYR 156 HD2 TYR 156 9.656 -14.420 1.987 1142 HD2 TYR 156 HD1 TYR 156 8.745 -10.342 2.872 1143 HE1 TYR 156 HE2 TYR 156 7.269 -14.905 1.722 1144 HE2 TYR 156 HE1 TYR 156 6.356 -10.834 2.620 1145 HH TYR 156 HH TYR 156 4.952 -12.609 1.325 1146 H SER 157 H SER 157 12.670 -10.471 5.039 1147 HA SER 157 HA SER 157 15.335 -11.717 4.974 1148 HB2 SER 157 2HB SER 157 14.683 -8.915 3.973 1149 HB3 SER 157 1HB SER 157 16.310 -9.574 4.156 1150 HG SER 157 HG SER 157 14.368 -10.865 2.562 1151 H ASP 158 H ASP 158 16.215 -11.603 6.912 1152 HA ASP 158 HA ASP 158 14.970 -10.430 9.170 1153 HB2 ASP 158 2HB ASP 158 17.797 -11.570 8.936 1154 HB3 ASP 158 1HB ASP 158 16.928 -11.288 10.444 1155 H THR 159 H THR 159 17.386 -9.222 7.006 1156 HA THR 159 HA THR 159 18.575 -7.277 8.759 1157 HB THR 159 HB THR 159 19.813 -8.304 6.844 1158 HG1 THR 159 HG1 THR 159 20.489 -6.288 7.740 1159 HG21 THR 159 3HG2 THR 159 19.462 -7.517 4.549 1160 HG22 THR 159 1HG2 THR 159 18.108 -6.509 5.077 1161 HG23 THR 159 2HG2 THR 159 17.985 -8.266 5.155 1162 H PHE 160 H PHE 160 15.493 -7.280 7.578 1163 HA PHE 160 HA PHE 160 15.294 -4.333 7.315 1164 HB2 PHE 160 2HB PHE 160 13.428 -6.549 6.327 1165 HB3 PHE 160 1HB PHE 160 13.014 -4.840 6.316 1166 HD1 PHE 160 HD2 PHE 160 15.552 -7.244 4.945 1167 HD2 PHE 160 HD1 PHE 160 13.465 -3.561 4.374 1168 HE1 PHE 160 HE2 PHE 160 16.439 -7.092 2.655 1169 HE2 PHE 160 HE1 PHE 160 14.352 -3.426 2.090 1170 HZ PHE 160 HZ PHE 160 15.833 -5.185 1.219 1171 H SER 161 H SER 161 13.310 -3.480 8.435 1172 HA SER 161 HA SER 161 12.375 -5.135 10.725 1173 HB2 SER 161 2HB SER 161 13.027 -2.144 10.794 1174 HB3 SER 161 1HB SER 161 12.390 -3.097 12.138 1175 HG SER 161 HG SER 161 14.601 -4.267 11.142 1176 H CYS 162 H CYS 162 10.103 -5.014 11.098 1177 HA CYS 162 HA CYS 162 8.536 -4.353 8.806 1178 HB2 CYS 162 2HB CYS 162 6.620 -5.158 10.250 1179 HB3 CYS 162 1HB CYS 162 7.960 -6.295 10.147 1180 HG CYS 162 HG CYS 162 8.413 -4.326 12.731 1181 HA PRO 163 HA PRO 163 7.203 -0.205 10.005 1182 HB2 PRO 163 2HB PRO 163 4.717 -0.572 8.412 1183 HB3 PRO 163 1HB PRO 163 6.102 0.482 8.078 1184 HG2 PRO 163 2HG PRO 163 5.545 -1.679 6.562 1185 HG3 PRO 163 1HG PRO 163 7.212 -1.118 6.841 1186 HD2 PRO 163 2HD PRO 163 5.723 -3.357 8.210 1187 HD3 PRO 163 1HD PRO 163 7.386 -3.332 7.578 1188 H LEU 164 H LEU 164 6.402 0.084 12.061 1189 HA LEU 164 HA LEU 164 4.345 -1.416 13.288 1190 HB2 LEU 164 2HB LEU 164 6.213 -0.088 14.388 1191 HB3 LEU 164 1HB LEU 164 5.352 1.380 13.984 1192 HG LEU 164 HG LEU 164 5.158 0.623 16.401 1193 HD11 LEU 164 1HD1 LEU 164 3.512 2.216 15.503 1194 HD12 LEU 164 2HD1 LEU 164 2.775 1.133 16.681 1195 HD13 LEU 164 3HD1 LEU 164 2.497 0.876 14.957 1196 HD21 LEU 164 3HD2 LEU 164 3.637 -1.226 16.978 1197 HD22 LEU 164 1HD2 LEU 164 5.004 -1.807 16.029 1198 HD23 LEU 164 2HD2 LEU 164 3.424 -1.605 15.269 1199 HA PRO 165 HA PRO 165 1.110 0.946 11.067 1200 HB2 PRO 165 2HB PRO 165 -0.906 -0.859 11.249 1201 HB3 PRO 165 1HB PRO 165 0.477 -1.132 10.169 1202 HG2 PRO 165 2HG PRO 165 -0.107 -2.342 12.828 1203 HG3 PRO 165 1HG PRO 165 0.630 -3.080 11.390 1204 HD2 PRO 165 2HD PRO 165 2.037 -2.089 13.617 1205 HD3 PRO 165 1HD PRO 165 2.740 -2.442 12.024 1206 HA PRO 166 HA PRO 166 -0.586 2.908 14.861 1207 HB2 PRO 166 2HB PRO 166 -2.217 4.698 13.432 1208 HB3 PRO 166 1HB PRO 166 -0.519 4.990 13.854 1209 HG2 PRO 166 2HG PRO 166 -1.679 3.992 11.281 1210 HG3 PRO 166 1HG PRO 166 -0.368 5.166 11.552 1211 HD2 PRO 166 2HD PRO 166 0.187 2.644 10.844 1212 HD3 PRO 166 1HD PRO 166 1.212 3.502 12.015 1213 H GLU 167 H GLU 167 -2.614 2.916 15.903 1214 HA GLU 167 HA GLU 167 -4.231 0.647 15.499 1215 HB2 GLU 167 2HB GLU 167 -4.933 3.072 17.195 1216 HB3 GLU 167 1HB GLU 167 -5.563 1.436 17.376 1217 HG2 GLU 167 2HG GLU 167 -3.357 0.627 18.046 1218 HG3 GLU 167 1HG GLU 167 -2.675 2.238 17.810 1219 H SER 168 H SER 168 -4.473 3.776 14.185 1220 HA SER 168 HA SER 168 -7.248 3.993 13.679 1221 HB2 SER 168 2HB SER 168 -6.379 5.795 12.052 1222 HB3 SER 168 1HB SER 168 -5.953 5.983 13.755 1223 HG SER 168 HG SER 168 -4.166 6.264 12.264 1224 H ASN 169 H ASN 169 -4.586 2.476 11.878 1225 HA ASN 169 HA ASN 169 -6.228 2.181 9.454 1226 HB2 ASN 169 2HB ASN 169 -4.227 1.422 8.311 1227 HB3 ASN 169 1HB ASN 169 -3.860 2.902 9.176 1228 HD21 ASN 169 1HD2 ASN 169 -1.644 2.330 8.914 1229 HD22 ASN 169 2HD2 ASN 169 -0.887 1.197 9.960 1230 H TRP 170 H TRP 170 -6.063 0.627 12.288 1231 HA TRP 170 HA TRP 170 -5.829 -2.127 11.450 1232 HB2 TRP 170 2HB TRP 170 -6.734 -0.890 14.085 1233 HB3 TRP 170 1HB TRP 170 -6.644 -2.624 13.806 1234 HD1 TRP 170 HD1 TRP 170 -3.648 -1.314 12.172 1235 HE1 TRP 170 HE1 TRP 170 -1.607 -1.423 13.723 1236 HE3 TRP 170 HE3 TRP 170 -6.036 -2.138 16.614 1237 HZ2 TRP 170 HZ2 TRP 170 -1.062 -1.815 16.455 1238 HZ3 TRP 170 HZ3 TRP 170 -4.680 -2.364 18.655 1239 HH2 TRP 170 HH2 TRP 170 -2.243 -2.203 18.580 1240 H LEU 171 H LEU 171 -7.359 -2.741 10.052 1241 HA LEU 171 HA LEU 171 -10.110 -1.814 10.159 1242 HB2 LEU 171 2HB LEU 171 -8.988 -3.994 8.343 1243 HB3 LEU 171 1HB LEU 171 -10.392 -2.982 8.071 1244 HG LEU 171 HG LEU 171 -7.479 -2.118 7.887 1245 HD11 LEU 171 1HD1 LEU 171 -9.569 -2.407 5.701 1246 HD12 LEU 171 2HD1 LEU 171 -8.203 -3.488 5.983 1247 HD13 LEU 171 3HD1 LEU 171 -7.915 -1.823 5.485 1248 HD21 LEU 171 3HD2 LEU 171 -8.780 -0.244 8.751 1249 HD22 LEU 171 1HD2 LEU 171 -9.957 -0.421 7.445 1250 HD23 LEU 171 2HD2 LEU 171 -8.299 0.064 7.085 1251 H GLU 172 H GLU 172 -11.548 -2.864 11.539 1252 HA GLU 172 HA GLU 172 -10.863 -5.493 12.632 1253 HB2 GLU 172 2HB GLU 172 -11.775 -3.526 14.024 1254 HB3 GLU 172 1HB GLU 172 -13.334 -3.804 13.252 1255 HG2 GLU 172 2HG GLU 172 -13.455 -6.050 14.217 1256 HG3 GLU 172 1HG GLU 172 -11.837 -5.876 14.901 1257 H THR 173 H THR 173 -11.094 -5.928 10.135 1258 HA THR 173 HA THR 173 -13.473 -7.513 9.673 1259 HB THR 173 HB THR 173 -14.183 -5.356 8.761 1260 HG1 THR 173 HG1 THR 173 -14.848 -7.133 7.575 1261 HG21 THR 173 3HG2 THR 173 -13.037 -4.245 6.893 1262 HG22 THR 173 1HG2 THR 173 -11.717 -5.415 6.980 1263 HG23 THR 173 2HG2 THR 173 -11.999 -4.296 8.316 1264 H ALA 174 H ALA 174 -13.085 -9.162 8.164 1265 HA ALA 174 HA ALA 174 -10.268 -9.760 7.629 1266 HB1 ALA 174 3HB ALA 174 -11.701 -11.525 8.604 1267 HB2 ALA 174 1HB ALA 174 -11.090 -12.001 7.016 1268 HB3 ALA 174 2HB ALA 174 -12.759 -11.454 7.195 1269 H VAL 175 H VAL 175 -9.378 -9.280 5.733 1270 HA VAL 175 HA VAL 175 -11.018 -8.611 3.366 1271 HB VAL 175 HB VAL 175 -8.036 -8.082 3.889 1272 HG11 VAL 175 1HG1 VAL 175 -9.773 -7.176 1.557 1273 HG12 VAL 175 2HG1 VAL 175 -8.456 -8.347 1.488 1274 HG13 VAL 175 3HG1 VAL 175 -8.109 -6.656 1.849 1275 HG21 VAL 175 3HG2 VAL 175 -10.382 -6.135 3.953 1276 HG22 VAL 175 1HG2 VAL 175 -8.679 -5.688 4.110 1277 HG23 VAL 175 2HG2 VAL 175 -9.447 -6.688 5.342 1278 H THR 176 H THR 176 -11.545 -10.744 2.803 1279 HA THR 176 HA THR 176 -9.542 -12.772 2.366 1280 HB THR 176 HB THR 176 -11.533 -14.045 1.371 1281 HG1 THR 176 HG1 THR 176 -12.659 -11.854 0.995 1282 HG21 THR 176 3HG2 THR 176 -11.896 -12.927 4.180 1283 HG22 THR 176 1HG2 THR 176 -10.922 -14.332 3.741 1284 HG23 THR 176 2HG2 THR 176 -12.674 -14.379 3.543 1285 H ALA 177 H ALA 177 -8.105 -12.029 0.841 1286 HA ALA 177 HA ALA 177 -8.977 -11.928 -1.946 1287 HB1 ALA 177 3HB ALA 177 -9.188 -9.584 -1.203 1288 HB2 ALA 177 1HB ALA 177 -7.868 -9.757 -2.361 1289 HB3 ALA 177 2HB ALA 177 -7.516 -9.600 -0.638 1290 H GLY 178 H GLY 178 -7.387 -12.505 -3.361 1291 HA2 GLY 178 2HA GLY 178 -5.530 -13.542 -4.174 1292 HA3 GLY 178 1HA GLY 178 -4.667 -12.385 -3.188 1293 H GLU 179 H GLU 179 -2.972 -13.677 -2.661 1294 HA GLU 179 HA GLU 179 -3.358 -16.438 -1.886 1295 HB2 GLU 179 2HB GLU 179 -0.798 -14.823 -2.222 1296 HB3 GLU 179 1HB GLU 179 -0.872 -16.560 -1.940 1297 HG2 GLU 179 2HG GLU 179 -1.843 -15.052 -4.378 1298 HG3 GLU 179 1HG GLU 179 -0.493 -16.182 -4.288 1299 H ARG 180 H ARG 180 -2.635 -17.403 -0.056 1300 HA ARG 180 HA ARG 180 -2.886 -16.003 2.443 1301 HB2 ARG 180 2HB ARG 180 -2.644 -18.289 3.405 1302 HB3 ARG 180 1HB ARG 180 -3.839 -18.243 2.114 1303 HG2 ARG 180 2HG ARG 180 -2.132 -19.169 0.536 1304 HG3 ARG 180 1HG ARG 180 -0.995 -19.290 1.877 1305 HD2 ARG 180 2HD ARG 180 -2.435 -20.918 2.992 1306 HD3 ARG 180 1HD ARG 180 -3.660 -20.753 1.730 1307 HE ARG 180 HE ARG 180 -1.177 -22.242 1.608 1308 HH11 ARG 180 1HH1 ARG 180 -3.738 -20.822 -0.342 1309 HH12 ARG 180 2HH1 ARG 180 -3.407 -21.832 -1.708 1310 HH21 ARG 180 1HH2 ARG 180 -0.736 -23.507 -0.227 1311 HH22 ARG 180 2HH2 ARG 180 -1.724 -23.343 -1.645 1312 H THR 181 H THR 181 -1.312 -16.693 4.252 1313 HA THR 181 HA THR 181 1.343 -15.776 3.775 1314 HB THR 181 HB THR 181 0.259 -15.505 5.982 1315 HG1 THR 181 HG1 THR 181 2.448 -17.232 6.461 1316 HG21 THR 181 3HG2 THR 181 0.500 -18.522 6.271 1317 HG22 THR 181 1HG2 THR 181 -1.009 -17.617 6.105 1318 HG23 THR 181 2HG2 THR 181 -0.003 -17.403 7.539 1319 H ASP 182 H ASP 182 3.312 -17.044 4.253 1320 HA ASP 182 HA ASP 182 4.804 -18.658 3.672 1321 HB2 ASP 182 2HB ASP 182 2.587 -20.510 4.679 1322 HB3 ASP 182 1HB ASP 182 4.249 -21.007 4.378 1323 H LEU 183 H LEU 183 3.970 -17.693 1.506 1324 HA LEU 183 HA LEU 183 2.193 -18.836 -0.227 1325 HB2 LEU 183 2HB LEU 183 3.302 -17.680 -2.059 1326 HB3 LEU 183 1HB LEU 183 3.223 -16.655 -0.642 1327 HG LEU 183 HG LEU 183 5.754 -18.168 -1.409 1328 HD11 LEU 183 1HD1 LEU 183 6.615 -16.120 -2.446 1329 HD12 LEU 183 2HD1 LEU 183 5.070 -15.309 -2.176 1330 HD13 LEU 183 3HD1 LEU 183 5.168 -16.681 -3.283 1331 HD21 LEU 183 3HD2 LEU 183 6.911 -16.520 0.008 1332 HD22 LEU 183 1HD2 LEU 183 5.698 -17.405 0.930 1333 HD23 LEU 183 2HD2 LEU 183 5.371 -15.753 0.402 1334 H GLU 184 H GLU 184 5.511 -19.911 0.316 1335 HA GLU 184 HA GLU 184 5.526 -21.710 -1.970 1336 HB2 GLU 184 2HB GLU 184 7.556 -20.429 -0.955 1337 HB3 GLU 184 1HB GLU 184 7.584 -21.683 0.271 1338 HG2 GLU 184 2HG GLU 184 7.736 -22.314 -2.689 1339 HG3 GLU 184 1HG GLU 184 9.159 -21.911 -1.748 1340 H HIS 185 H HIS 185 3.602 -22.794 -1.312 1341 HA HIS 185 HA HIS 185 4.033 -25.420 -0.733 1342 HB2 HIS 185 2HB HIS 185 4.354 -24.944 1.655 1343 HB3 HIS 185 1HB HIS 185 2.862 -24.013 1.722 1344 HD1 HIS 185 HD1 HIS 185 3.855 -27.587 0.825 1345 HD2 HIS 185 HD2 HIS 185 0.807 -25.492 2.713 1346 HE1 HIS 185 HE1 HIS 185 2.209 -29.329 1.565 1347 HE2 HIS 185 HE2 HIS 185 0.291 -28.021 2.528
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