NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
8656 | 1mm4 | 5557 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 1H MET 1 -33.664 -22.511 26.496 2 2H MET 1 2H MET 1 -34.140 -21.140 25.581 3 H MET 1 H MET 1 -33.960 -22.241 26.481 4 3H MET 1 3H MET 1 -32.485 -21.387 25.963 5 HA MET 1 HA MET 1 -32.702 -23.540 24.723 6 1HB MET 1 1HB MET 1 -35.329 -22.877 24.722 7 2HB MET 1 2HB MET 1 -34.848 -22.234 23.158 8 1HG MET 1 1HG MET 1 -34.581 -24.268 22.254 9 2HG MET 1 2HG MET 1 -33.901 -24.951 23.729 10 1HE MET 1 1HE MET 1 -37.446 -24.602 21.680 11 2HE MET 1 2HE MET 1 -37.503 -26.332 22.018 12 3HE MET 1 3HE MET 1 -36.037 -25.611 21.354 13 H ASN 2 H ASN 2 -33.253 -20.126 24.057 14 HA ASN 2 HA ASN 2 -31.601 -20.260 21.655 15 1HB ASN 2 1HB ASN 2 -33.835 -18.813 22.178 16 2HB ASN 2 2HB ASN 2 -32.592 -17.636 22.593 17 1HD2 ASN 2 1HD2 ASN 2 -30.943 -17.213 20.959 18 2HD2 ASN 2 2HD2 ASN 2 -31.391 -17.281 19.291 19 H ALA 3 H ALA 3 -31.677 -18.595 24.790 20 HA ALA 3 HA ALA 3 -29.273 -17.183 24.505 21 1HB ALA 3 1HB ALA 3 -29.309 -17.005 26.964 22 2HB ALA 3 2HB ALA 3 -30.615 -18.190 27.010 23 3HB ALA 3 3HB ALA 3 -30.869 -16.627 26.234 24 H ASP 4 H ASP 4 -29.871 -20.523 25.113 25 HA ASP 4 HA ASP 4 -27.333 -21.090 26.327 26 1HB ASP 4 1HB ASP 4 -29.668 -22.433 26.276 27 2HB ASP 4 2HB ASP 4 -28.828 -23.264 24.971 28 HD2 ASP 4 HD2 ASP 4 -26.933 -23.488 28.449 29 H GLU 5 H GLU 5 -28.751 -21.896 23.156 30 HA GLU 5 HA GLU 5 -26.258 -22.750 22.065 31 1HB GLU 5 1HB GLU 5 -29.027 -22.381 21.073 32 2HB GLU 5 2HB GLU 5 -27.751 -22.316 19.865 33 1HG GLU 5 1HG GLU 5 -27.301 -24.513 20.022 34 2HG GLU 5 2HG GLU 5 -27.595 -24.560 21.760 35 HE2 GLU 5 HE2 GLU 5 -30.695 -25.129 19.339 36 H TRP 6 H TRP 6 -27.902 -19.709 22.318 37 HA TRP 6 HA TRP 6 -26.426 -18.397 20.237 38 1HB TRP 6 1HB TRP 6 -28.676 -17.645 20.951 39 2HB TRP 6 2HB TRP 6 -28.010 -17.194 22.518 40 HD1 TRP 6 HD1 TRP 6 -26.869 -14.860 22.710 41 HE1 TRP 6 HE1 TRP 6 -26.486 -12.911 21.074 42 HE3 TRP 6 HE3 TRP 6 -28.178 -17.190 18.351 43 HZ2 TRP 6 HZ2 TRP 6 -26.709 -12.425 18.302 44 HZ3 TRP 6 HZ3 TRP 6 -28.066 -15.913 16.251 45 HH2 TRP 6 HH2 TRP 6 -27.347 -13.579 16.229 46 H MET 7 H MET 7 -26.039 -18.909 23.667 47 HA MET 7 HA MET 7 -24.156 -16.911 24.226 48 1HB MET 7 1HB MET 7 -25.240 -19.227 25.547 49 2HB MET 7 2HB MET 7 -23.503 -19.157 25.805 50 1HG MET 7 1HG MET 7 -25.329 -16.824 26.295 51 2HG MET 7 2HG MET 7 -24.927 -18.016 27.531 52 1HE MET 7 1HE MET 7 -24.091 -15.429 28.801 53 2HE MET 7 2HE MET 7 -22.421 -15.861 29.172 54 3HE MET 7 3HE MET 7 -23.689 -17.084 29.262 55 H THR 8 H THR 8 -23.751 -20.220 23.041 56 HA THR 8 HA THR 8 -20.963 -20.356 23.150 57 HB THR 8 HB THR 8 -21.163 -22.125 21.439 58 HG1 THR 8 HG1 THR 8 -22.753 -22.024 20.102 59 1HG2 THR 8 1HG2 THR 8 -22.243 -23.671 22.725 60 2HG2 THR 8 2HG2 THR 8 -23.537 -22.558 23.174 61 3HG2 THR 8 3HG2 THR 8 -21.944 -22.405 23.916 62 H THR 9 H THR 9 -23.095 -18.833 20.843 63 HA THR 9 HA THR 9 -21.212 -18.487 18.758 64 HB THR 9 HB THR 9 -23.356 -16.463 19.129 65 HG1 THR 9 HG1 THR 9 -23.876 -19.208 18.650 66 1HG2 THR 9 1HG2 THR 9 -23.422 -16.395 16.895 67 2HG2 THR 9 2HG2 THR 9 -23.271 -18.145 16.731 68 3HG2 THR 9 3HG2 THR 9 -21.836 -17.158 17.009 69 H PHE 10 H PHE 10 -22.260 -16.370 21.409 70 HA PHE 10 HA PHE 10 -20.462 -14.263 20.688 71 1HB PHE 10 1HB PHE 10 -22.481 -14.751 22.765 72 2HB PHE 10 2HB PHE 10 -21.116 -13.781 23.311 73 HD1 PHE 10 HD1 PHE 10 -23.795 -13.991 20.774 74 HD2 PHE 10 HD2 PHE 10 -20.899 -11.529 22.685 75 HE1 PHE 10 HE1 PHE 10 -24.789 -12.006 19.713 76 HE2 PHE 10 HE2 PHE 10 -21.888 -9.539 21.628 77 HZ PHE 10 HZ PHE 10 -23.836 -9.776 20.141 78 H ARG 11 H ARG 11 -20.415 -16.930 22.990 79 HA ARG 11 HA ARG 11 -18.172 -16.193 24.478 80 1HB ARG 11 1HB ARG 11 -19.884 -18.388 24.363 81 2HB ARG 11 2HB ARG 11 -18.298 -19.060 24.009 82 1HG ARG 11 1HG ARG 11 -18.422 -17.199 26.288 83 2HG ARG 11 2HG ARG 11 -19.267 -18.735 26.490 84 1HD ARG 11 1HD ARG 11 -17.312 -19.981 26.200 85 2HD ARG 11 2HD ARG 11 -16.454 -18.633 25.458 86 HE ARG 11 HE ARG 11 -15.823 -17.964 27.542 87 1HH1 ARG 11 1HH1 ARG 11 -18.613 -20.036 27.857 88 2HH1 ARG 11 2HH1 ARG 11 -18.564 -20.049 29.588 89 1HH2 ARG 11 1HH2 ARG 11 -15.757 -17.979 29.818 90 2HH2 ARG 11 2HH2 ARG 11 -16.943 -18.881 30.701 91 H GLU 12 H GLU 12 -18.439 -17.617 21.303 92 HA GLU 12 HA GLU 12 -15.708 -18.424 21.094 93 1HB GLU 12 1HB GLU 12 -17.925 -19.019 19.678 94 2HB GLU 12 2HB GLU 12 -17.223 -17.798 18.625 95 1HG GLU 12 1HG GLU 12 -16.077 -19.488 17.743 96 2HG GLU 12 2HG GLU 12 -15.064 -19.365 19.180 97 HE2 GLU 12 HE2 GLU 12 -17.311 -22.546 18.708 98 H ASN 13 H ASN 13 -17.480 -15.488 20.448 99 HA ASN 13 HA ASN 13 -15.429 -14.241 18.891 100 1HB ASN 13 1HB ASN 13 -17.839 -13.113 20.327 101 2HB ASN 13 2HB ASN 13 -16.769 -12.157 19.307 102 1HD2 ASN 13 1HD2 ASN 13 -18.607 -11.698 18.008 103 2HD2 ASN 13 2HD2 ASN 13 -19.173 -12.849 16.851 104 H ILE 14 H ILE 14 -16.431 -14.093 22.285 105 HA ILE 14 HA ILE 14 -14.585 -12.092 23.061 106 HB ILE 14 HB ILE 14 -15.763 -14.236 24.828 107 1HG1 ILE 14 1HG1 ILE 14 -17.560 -13.136 23.614 108 2HG1 ILE 14 2HG1 ILE 14 -17.561 -12.591 25.289 109 1HG2 ILE 14 1HG2 ILE 14 -15.614 -12.060 26.373 110 2HG2 ILE 14 2HG2 ILE 14 -14.263 -11.731 25.288 111 3HG2 ILE 14 3HG2 ILE 14 -14.297 -13.224 26.226 112 1HD1 ILE 14 1HD1 ILE 14 -16.620 -11.099 22.861 113 2HD1 ILE 14 2HD1 ILE 14 -16.280 -10.573 24.510 114 3HD1 ILE 14 3HD1 ILE 14 -17.948 -10.692 23.947 115 H ALA 15 H ALA 15 -14.360 -15.563 22.727 116 HA ALA 15 HA ALA 15 -11.961 -15.896 24.219 117 1HB ALA 15 1HB ALA 15 -12.977 -17.914 24.011 118 2HB ALA 15 2HB ALA 15 -11.905 -18.028 22.615 119 3HB ALA 15 3HB ALA 15 -13.593 -17.563 22.396 120 H GLN 16 H GLN 16 -12.672 -15.352 20.800 121 HA GLN 16 HA GLN 16 -10.008 -15.671 19.882 122 1HB GLN 16 1HB GLN 16 -11.996 -15.819 18.415 123 2HB GLN 16 2HB GLN 16 -12.267 -14.096 18.632 124 1HG GLN 16 1HG GLN 16 -10.791 -13.574 17.062 125 2HG GLN 16 2HG GLN 16 -9.571 -14.645 17.750 126 1HE2 GLN 16 1HE2 GLN 16 -10.002 -17.019 17.330 127 2HE2 GLN 16 2HE2 GLN 16 -10.513 -17.437 15.734 128 H THR 17 H THR 17 -11.949 -12.786 20.637 129 HA THR 17 HA THR 17 -9.986 -10.881 20.041 130 HB THR 17 HB THR 17 -12.310 -10.254 20.345 131 HG1 THR 17 HG1 THR 17 -11.977 -8.450 21.669 132 1HG2 THR 17 1HG2 THR 17 -13.451 -10.241 22.412 133 2HG2 THR 17 2HG2 THR 17 -12.003 -10.733 23.292 134 3HG2 THR 17 3HG2 THR 17 -12.799 -11.866 22.199 135 H TRP 18 H TRP 18 -10.605 -12.744 22.958 136 HA TRP 18 HA TRP 18 -8.908 -11.331 24.699 137 1HB TRP 18 1HB TRP 18 -10.638 -13.092 25.310 138 2HB TRP 18 2HB TRP 18 -9.445 -14.297 24.835 139 HD1 TRP 18 HD1 TRP 18 -7.517 -14.832 26.526 140 HE1 TRP 18 HE1 TRP 18 -7.013 -14.093 28.939 141 HE3 TRP 18 HE3 TRP 18 -10.872 -10.994 26.916 142 HZ2 TRP 18 HZ2 TRP 18 -7.918 -12.140 30.766 143 HZ3 TRP 18 HZ3 TRP 18 -10.990 -9.740 29.030 144 HH2 TRP 18 HH2 TRP 18 -9.543 -10.304 30.915 145 H GLN 19 H GLN 19 -8.304 -13.928 22.406 146 HA GLN 19 HA GLN 19 -5.570 -14.286 23.237 147 1HB GLN 19 1HB GLN 19 -7.438 -15.594 21.433 148 2HB GLN 19 2HB GLN 19 -5.841 -15.433 20.713 149 1HG GLN 19 1HG GLN 19 -4.938 -16.961 22.069 150 2HG GLN 19 2HG GLN 19 -5.819 -16.377 23.480 151 1HE2 GLN 19 1HE2 GLN 19 -7.464 -17.546 24.209 152 2HE2 GLN 19 2HE2 GLN 19 -8.194 -18.875 23.382 153 H GLN 20 H GLN 20 -7.288 -12.388 20.885 154 HA GLN 20 HA GLN 20 -6.631 -10.754 19.449 155 1HB GLN 20 1HB GLN 20 -4.054 -10.879 21.028 156 2HB GLN 20 2HB GLN 20 -4.492 -9.604 19.900 157 1HG GLN 20 1HG GLN 20 -6.641 -9.580 21.535 158 2HG GLN 20 2HG GLN 20 -5.378 -10.081 22.657 159 1HE2 GLN 20 1HE2 GLN 20 -6.987 -7.493 21.674 160 2HE2 GLN 20 2HE2 GLN 20 -5.785 -6.266 21.858 161 HA PRO 21 HA PRO 21 -4.832 -12.728 15.952 162 1HB PRO 21 1HB PRO 21 -3.562 -10.095 15.370 163 2HB PRO 21 2HB PRO 21 -4.561 -11.117 14.331 164 1HG PRO 21 1HG PRO 21 -5.568 -8.914 15.434 165 2HG PRO 21 2HG PRO 21 -6.542 -10.389 15.295 166 1HD PRO 21 1HD PRO 21 -5.203 -9.218 17.691 167 2HD PRO 21 2HD PRO 21 -6.750 -10.081 17.569 168 H GLU 22 H GLU 22 -2.575 -12.640 14.708 169 HA GLU 22 HA GLU 22 -0.379 -12.447 16.637 170 1HB GLU 22 1HB GLU 22 0.478 -14.662 15.687 171 2HB GLU 22 2HB GLU 22 -0.864 -14.740 16.821 172 1HG GLU 22 1HG GLU 22 -2.262 -15.590 15.299 173 2HG GLU 22 2HG GLU 22 -1.674 -14.530 14.019 174 HE2 GLU 22 HE2 GLU 22 0.015 -18.093 14.443 175 H HIS 23 H HIS 23 -0.369 -10.486 15.077 176 HA HIS 23 HA HIS 23 1.788 -10.910 13.237 177 1HB HIS 23 1HB HIS 23 -0.800 -11.141 12.189 178 2HB HIS 23 2HB HIS 23 -0.265 -9.529 11.728 179 HD1 HIS 23 HD1 HIS 23 0.193 -13.098 10.949 180 HD2 HIS 23 HD2 HIS 23 2.094 -9.506 10.087 181 HE1 HIS 23 HE1 HIS 23 1.728 -13.596 9.022 182 HE2 HIS 23 HE2 HIS 23 2.932 -11.429 8.574 183 H TYR 24 H TYR 24 3.025 -9.131 13.117 184 HA TYR 24 HA TYR 24 1.847 -6.569 13.969 185 1HB TYR 24 1HB TYR 24 3.841 -8.064 15.310 186 2HB TYR 24 2HB TYR 24 4.649 -6.671 14.599 187 HD1 TYR 24 HD1 TYR 24 5.001 -5.070 16.223 188 HD2 TYR 24 HD2 TYR 24 1.278 -7.128 16.154 189 HE1 TYR 24 HE1 TYR 24 4.193 -3.658 18.066 190 HE2 TYR 24 HE2 TYR 24 0.459 -5.721 17.996 191 HH TYR 24 HH TYR 24 2.273 -4.057 19.986 192 H ASP 25 H ASP 25 1.763 -5.395 12.157 193 HA ASP 25 HA ASP 25 4.009 -5.506 10.276 194 1HB ASP 25 1HB ASP 25 1.326 -4.168 9.888 195 2HB ASP 25 2HB ASP 25 2.534 -4.509 8.652 196 HD2 ASP 25 HD2 ASP 25 -0.013 -7.312 9.630 197 H LEU 26 H LEU 26 5.200 -3.721 9.723 198 HA LEU 26 HA LEU 26 4.596 -1.207 11.120 199 1HB LEU 26 1HB LEU 26 7.070 -2.848 11.238 200 2HB LEU 26 2HB LEU 26 7.263 -1.106 11.178 201 HG LEU 26 HG LEU 26 5.525 -1.155 13.155 202 1HD1 LEU 26 1HD1 LEU 26 6.654 -3.935 13.112 203 2HD1 LEU 26 2HD1 LEU 26 4.970 -3.431 13.251 204 3HD1 LEU 26 3HD1 LEU 26 6.080 -3.178 14.597 205 1HD2 LEU 26 1HD2 LEU 26 7.271 -0.636 14.488 206 2HD2 LEU 26 2HD2 LEU 26 8.165 -0.690 12.970 207 3HD2 LEU 26 3HD2 LEU 26 8.176 -2.084 14.049 208 H TYR 27 H TYR 27 4.373 0.366 9.686 209 HA TYR 27 HA TYR 27 5.523 0.089 7.029 210 1HB TYR 27 1HB TYR 27 3.132 1.126 7.964 211 2HB TYR 27 2HB TYR 27 4.066 2.565 7.567 212 HD1 TYR 27 HD1 TYR 27 4.757 3.001 5.259 213 HD2 TYR 27 HD2 TYR 27 2.389 -0.395 6.242 214 HE1 TYR 27 HE1 TYR 27 4.199 2.708 2.882 215 HE2 TYR 27 HE2 TYR 27 1.826 -0.697 3.868 216 HH TYR 27 HH TYR 27 1.735 0.596 1.818 217 H ILE 28 H ILE 28 7.522 0.794 6.698 218 HA ILE 28 HA ILE 28 8.355 3.300 8.005 219 HB ILE 28 HB ILE 28 10.709 2.382 7.862 220 1HG1 ILE 28 1HG1 ILE 28 9.613 -0.370 7.917 221 2HG1 ILE 28 2HG1 ILE 28 9.633 0.422 6.344 222 1HG2 ILE 28 1HG2 ILE 28 8.964 2.347 9.866 223 2HG2 ILE 28 2HG2 ILE 28 10.580 1.653 10.010 224 3HG2 ILE 28 3HG2 ILE 28 9.197 0.608 9.690 225 1HD1 ILE 28 1HD1 ILE 28 12.124 0.966 7.108 226 2HD1 ILE 28 2HD1 ILE 28 11.680 -0.523 6.273 227 3HD1 ILE 28 3HD1 ILE 28 11.868 -0.518 8.027 228 HA PRO 29 HA PRO 29 8.882 4.955 3.921 229 1HB PRO 29 1HB PRO 29 11.193 6.376 5.151 230 2HB PRO 29 2HB PRO 29 9.831 7.027 4.232 231 1HG PRO 29 1HG PRO 29 9.944 7.312 6.876 232 2HG PRO 29 2HG PRO 29 8.404 6.981 6.060 233 1HD PRO 29 1HD PRO 29 10.147 5.143 7.642 234 2HD PRO 29 2HD PRO 29 8.376 5.215 7.543 235 H ALA 30 H ALA 30 10.242 4.735 2.142 236 HA ALA 30 HA ALA 30 12.291 2.700 2.417 237 1HB ALA 30 1HB ALA 30 10.703 3.833 0.198 238 2HB ALA 30 2HB ALA 30 11.143 2.161 0.543 239 3HB ALA 30 3HB ALA 30 12.316 3.242 -0.207 240 H ILE 31 H ILE 31 14.268 3.335 2.988 241 HA ILE 31 HA ILE 31 15.376 5.750 1.709 242 HB ILE 31 HB ILE 31 16.845 5.942 3.754 243 1HG1 ILE 31 1HG1 ILE 31 14.801 4.468 5.323 244 2HG1 ILE 31 2HG1 ILE 31 15.944 3.489 4.408 245 1HG2 ILE 31 1HG2 ILE 31 13.967 6.534 3.558 246 2HG2 ILE 31 2HG2 ILE 31 15.335 7.614 3.830 247 3HG2 ILE 31 3HG2 ILE 31 14.673 6.674 5.167 248 1HD1 ILE 31 1HD1 ILE 31 17.686 5.109 5.558 249 2HD1 ILE 31 2HD1 ILE 31 17.076 3.664 6.362 250 3HD1 ILE 31 3HD1 ILE 31 16.393 5.243 6.748 251 H THR 32 H THR 32 17.805 5.743 1.671 252 HA THR 32 HA THR 32 19.170 3.230 1.787 253 HB THR 32 HB THR 32 18.811 4.453 -0.952 254 HG1 THR 32 HG1 THR 32 17.266 3.024 -1.329 255 1HG2 THR 32 1HG2 THR 32 20.339 2.146 0.091 256 2HG2 THR 32 2HG2 THR 32 20.712 3.256 -1.228 257 3HG2 THR 32 3HG2 THR 32 19.534 1.965 -1.467 258 H TRP 33 H TRP 33 20.931 3.968 2.791 259 HA TRP 33 HA TRP 33 21.990 6.564 2.488 260 1HB TRP 33 1HB TRP 33 23.230 4.050 3.620 261 2HB TRP 33 2HB TRP 33 23.954 5.650 3.741 262 HD1 TRP 33 HD1 TRP 33 21.089 3.543 5.135 263 HE1 TRP 33 HE1 TRP 33 20.149 4.707 7.229 264 HE3 TRP 33 HE3 TRP 33 23.667 7.949 4.841 265 HZ2 TRP 33 HZ2 TRP 33 20.460 7.166 8.579 266 HZ3 TRP 33 HZ3 TRP 33 23.288 9.654 6.574 267 HH2 TRP 33 HH2 TRP 33 21.717 9.270 8.403 268 H HIS 34 H HIS 34 23.872 3.629 1.819 269 HA HIS 34 HA HIS 34 25.341 3.098 0.172 270 1HB HIS 34 1HB HIS 34 23.247 4.652 -1.220 271 2HB HIS 34 2HB HIS 34 24.784 4.524 -2.071 272 HD1 HIS 34 HD1 HIS 34 24.988 2.527 -3.508 273 HD2 HIS 34 HD2 HIS 34 22.290 1.924 -0.405 274 HE1 HIS 34 HE1 HIS 34 24.031 0.232 -3.886 275 HE2 HIS 34 HE2 HIS 34 22.465 -0.145 -1.949 276 H ALA 35 H ALA 35 24.805 6.431 -0.911 277 HA ALA 35 HA ALA 35 26.204 8.213 -1.109 278 1HB ALA 35 1HB ALA 35 28.010 7.358 1.058 279 2HB ALA 35 2HB ALA 35 26.307 7.522 1.490 280 3HB ALA 35 3HB ALA 35 27.180 8.894 0.807 281 H ARG 36 H ARG 36 28.356 8.874 -1.771 282 HA ARG 36 HA ARG 36 29.599 6.922 -3.431 283 1HB ARG 36 1HB ARG 36 30.014 9.809 -2.836 284 2HB ARG 36 2HB ARG 36 31.361 8.926 -3.541 285 1HG ARG 36 1HG ARG 36 28.618 8.873 -4.753 286 2HG ARG 36 2HG ARG 36 29.795 10.131 -5.135 287 1HD ARG 36 1HD ARG 36 30.712 7.320 -5.306 288 2HD ARG 36 2HD ARG 36 29.582 7.871 -6.541 289 HE ARG 36 HE ARG 36 32.334 8.551 -6.324 290 1HH1 ARG 36 1HH1 ARG 36 29.231 9.813 -7.301 291 2HH1 ARG 36 2HH1 ARG 36 29.904 10.940 -8.430 292 1HH2 ARG 36 1HH2 ARG 36 33.223 10.033 -7.808 293 2HH2 ARG 36 2HH2 ARG 36 32.171 11.065 -8.719 294 H PHE 37 H PHE 37 30.457 8.469 -0.376 295 HA PHE 37 HA PHE 37 32.459 6.372 0.050 296 1HB PHE 37 1HB PHE 37 33.485 8.591 -0.759 297 2HB PHE 37 2HB PHE 37 33.036 9.226 0.820 298 HD1 PHE 37 HD1 PHE 37 34.669 9.221 2.419 299 HD2 PHE 37 HD2 PHE 37 34.728 6.207 -0.584 300 HE1 PHE 37 HE1 PHE 37 36.748 8.314 3.375 301 HE2 PHE 37 HE2 PHE 37 36.806 5.294 0.366 302 HZ PHE 37 HZ PHE 37 37.818 6.347 2.348 303 H ALA 38 H ALA 38 32.209 5.421 1.959 304 HA ALA 38 HA ALA 38 30.181 6.105 3.757 305 1HB ALA 38 1HB ALA 38 31.314 3.856 3.461 306 2HB ALA 38 2HB ALA 38 30.954 4.342 5.117 307 3HB ALA 38 3HB ALA 38 32.598 4.479 4.495 308 H TYR 39 H TYR 39 30.352 8.256 4.388 309 HA TYR 39 HA TYR 39 32.738 9.301 5.580 310 1HB TYR 39 1HB TYR 39 31.213 11.234 6.186 311 2HB TYR 39 2HB TYR 39 31.341 10.873 4.468 312 HD1 TYR 39 HD1 TYR 39 29.181 10.354 7.446 313 HD2 TYR 39 HD2 TYR 39 29.422 10.413 3.199 314 HE1 TYR 39 HE1 TYR 39 26.733 10.168 7.309 315 HE2 TYR 39 HE2 TYR 39 26.975 10.228 3.051 316 HH TYR 39 HH TYR 39 25.007 10.681 4.417 317 H ASP 40 H ASP 40 33.345 9.282 7.653 318 HA ASP 40 HA ASP 40 31.623 7.925 9.576 319 1HB ASP 40 1HB ASP 40 34.264 7.646 9.104 320 2HB ASP 40 2HB ASP 40 34.321 8.854 10.385 321 HD2 ASP 40 HD2 ASP 40 33.044 6.572 12.725 322 H LYS 41 H LYS 41 31.602 8.781 11.843 323 HA LYS 41 HA LYS 41 31.445 11.724 11.834 324 1HB LYS 41 1HB LYS 41 29.545 9.661 12.846 325 2HB LYS 41 2HB LYS 41 29.686 11.166 13.745 326 1HG LYS 41 1HG LYS 41 29.358 11.446 10.834 327 2HG LYS 41 2HG LYS 41 27.975 10.785 11.709 328 1HD LYS 41 1HD LYS 41 29.286 13.162 12.888 329 2HD LYS 41 2HD LYS 41 28.389 13.414 11.389 330 1HE LYS 41 1HE LYS 41 26.762 13.766 12.993 331 2HE LYS 41 2HE LYS 41 26.519 12.067 12.584 332 1HZ LYS 41 1HZ LYS 41 26.489 12.353 14.957 333 2HZ LYS 41 2HZ LYS 41 27.997 13.116 14.936 334 3HZ LYS 41 3HZ LYS 41 27.874 11.481 14.528 335 H GLU 42 H GLU 42 32.572 12.760 13.354 336 HA GLU 42 HA GLU 42 34.126 11.204 15.239 337 1HB GLU 42 1HB GLU 42 34.730 13.406 13.804 338 2HB GLU 42 2HB GLU 42 34.236 14.164 15.312 339 1HG GLU 42 1HG GLU 42 36.284 11.971 15.169 340 2HG GLU 42 2HG GLU 42 36.687 13.684 15.069 341 HE2 GLU 42 HE2 GLU 42 35.561 14.060 18.474 342 H LYS 43 H LYS 43 33.977 11.273 17.450 343 HA LYS 43 HA LYS 43 32.985 11.462 19.488 344 1HB LYS 43 1HB LYS 43 33.359 13.996 18.634 345 2HB LYS 43 2HB LYS 43 31.610 13.999 18.823 346 1HG LYS 43 1HG LYS 43 32.377 12.848 21.153 347 2HG LYS 43 2HG LYS 43 33.731 13.937 20.847 348 1HD LYS 43 1HD LYS 43 32.485 15.788 21.189 349 2HD LYS 43 2HD LYS 43 31.060 15.095 20.412 350 1HE LYS 43 1HE LYS 43 30.855 13.628 22.493 351 2HE LYS 43 2HE LYS 43 32.020 14.726 23.234 352 1HZ LYS 43 1HZ LYS 43 29.745 15.978 21.932 353 2HZ LYS 43 2HZ LYS 43 30.506 16.365 23.391 354 3HZ LYS 43 3HZ LYS 43 29.393 15.093 23.331 355 H THR 44 H THR 44 30.809 11.741 20.611 356 HA THR 44 HA THR 44 28.642 11.091 20.841 357 HB THR 44 HB THR 44 28.311 11.879 17.943 358 HG1 THR 44 HG1 THR 44 27.863 13.950 18.756 359 1HG2 THR 44 1HG2 THR 44 26.133 12.728 19.444 360 2HG2 THR 44 2HG2 THR 44 26.461 11.085 19.996 361 3HG2 THR 44 3HG2 THR 44 26.181 11.400 18.283 362 H ASP 45 H ASP 45 28.388 8.974 21.113 363 HA ASP 45 HA ASP 45 28.908 7.151 18.890 364 1HB ASP 45 1HB ASP 45 28.801 6.894 21.850 365 2HB ASP 45 2HB ASP 45 28.333 5.482 20.906 366 HD2 ASP 45 HD2 ASP 45 31.662 4.731 20.696 367 H ARG 46 H ARG 46 27.337 5.075 19.186 368 HA ARG 46 HA ARG 46 25.277 4.232 18.722 369 1HB ARG 46 1HB ARG 46 24.230 6.544 20.361 370 2HB ARG 46 2HB ARG 46 23.400 5.032 20.017 371 1HG ARG 46 1HG ARG 46 25.636 4.093 21.190 372 2HG ARG 46 2HG ARG 46 25.473 5.646 22.010 373 1HD ARG 46 1HD ARG 46 22.959 4.176 21.771 374 2HD ARG 46 2HD ARG 46 24.187 3.326 22.708 375 HE ARG 46 HE ARG 46 24.007 4.918 24.355 376 1HH1 ARG 46 1HH1 ARG 46 22.317 6.012 21.501 377 2HH1 ARG 46 2HH1 ARG 46 21.572 7.352 22.305 378 1HH2 ARG 46 1HH2 ARG 46 23.026 6.678 25.411 379 2HH2 ARG 46 2HH2 ARG 46 21.975 7.730 24.524 380 H TYR 47 H TYR 47 22.856 5.225 18.114 381 HA TYR 47 HA TYR 47 23.364 6.568 15.606 382 1HB TYR 47 1HB TYR 47 20.894 6.243 15.268 383 2HB TYR 47 2HB TYR 47 21.797 4.757 15.543 384 HD1 TYR 47 HD1 TYR 47 19.429 7.152 17.034 385 HD2 TYR 47 HD2 TYR 47 21.406 3.412 17.489 386 HE1 TYR 47 HE1 TYR 47 17.909 6.580 18.880 387 HE2 TYR 47 HE2 TYR 47 19.891 2.830 19.336 388 HH TYR 47 HH TYR 47 18.268 4.759 21.064 389 H ASN 48 H ASN 48 22.176 8.461 14.911 390 HA ASN 48 HA ASN 48 22.127 10.481 16.968 391 1HB ASN 48 1HB ASN 48 21.650 12.030 15.081 392 2HB ASN 48 2HB ASN 48 23.090 11.050 14.819 393 1HD2 ASN 48 1HD2 ASN 48 22.808 11.570 12.578 394 2HD2 ASN 48 2HD2 ASN 48 21.689 10.667 11.619 395 H GLU 49 H GLU 49 20.336 11.873 17.403 396 HA GLU 49 HA GLU 49 17.791 10.453 17.299 397 1HB GLU 49 1HB GLU 49 17.040 12.157 18.929 398 2HB GLU 49 2HB GLU 49 18.468 11.285 19.469 399 1HG GLU 49 1HG GLU 49 19.475 13.218 19.813 400 2HG GLU 49 2HG GLU 49 19.406 13.534 18.080 401 HE2 GLU 49 HE2 GLU 49 17.629 16.136 20.004 402 H ARG 50 H ARG 50 16.400 10.867 15.727 403 HA ARG 50 HA ARG 50 15.796 13.575 14.950 404 1HB ARG 50 1HB ARG 50 17.421 11.789 13.235 405 2HB ARG 50 2HB ARG 50 16.117 12.653 12.435 406 1HG ARG 50 1HG ARG 50 17.636 14.401 14.163 407 2HG ARG 50 2HG ARG 50 18.666 13.601 12.974 408 1HD ARG 50 1HD ARG 50 17.613 14.591 11.195 409 2HD ARG 50 2HD ARG 50 16.089 14.777 12.061 410 HE ARG 50 HE ARG 50 18.282 16.634 11.987 411 1HH1 ARG 50 1HH1 ARG 50 15.489 15.573 13.790 412 2HH1 ARG 50 2HH1 ARG 50 15.281 17.089 14.601 413 1HH2 ARG 50 1HH2 ARG 50 18.010 18.629 13.052 414 2HH2 ARG 50 2HH2 ARG 50 16.711 18.824 14.182 415 HA PRO 51 HA PRO 51 12.060 10.889 15.157 416 1HB PRO 51 1HB PRO 51 10.941 13.645 14.920 417 2HB PRO 51 2HB PRO 51 10.459 12.323 15.990 418 1HG PRO 51 1HG PRO 51 11.880 14.369 16.925 419 2HG PRO 51 2HG PRO 51 12.199 12.713 17.474 420 1HD PRO 51 1HD PRO 51 13.749 14.416 15.580 421 2HD PRO 51 2HD PRO 51 14.327 13.212 16.748 422 H TRP 52 H TRP 52 11.752 9.897 13.251 423 HA TRP 52 HA TRP 52 11.356 11.534 10.846 424 1HB TRP 52 1HB TRP 52 12.659 9.001 11.362 425 2HB TRP 52 2HB TRP 52 11.449 8.833 10.095 426 HD1 TRP 52 HD1 TRP 52 14.304 11.362 10.881 427 HE1 TRP 52 HE1 TRP 52 15.484 11.921 8.663 428 HE3 TRP 52 HE3 TRP 52 11.464 8.528 7.711 429 HZ2 TRP 52 HZ2 TRP 52 15.244 11.250 5.933 430 HZ3 TRP 52 HZ3 TRP 52 12.005 8.543 5.312 431 HH2 TRP 52 HH2 TRP 52 13.857 9.877 4.442 432 H GLY 53 H GLY 53 9.988 8.703 12.519 433 1HA GLY 53 1HA GLY 53 7.450 9.077 12.785 434 2HA GLY 53 2HA GLY 53 7.484 9.116 11.029 435 H GLY 54 H GLY 54 6.043 7.315 11.015 436 1HA GLY 54 1HA GLY 54 6.886 4.917 10.314 437 2HA GLY 54 2HA GLY 54 7.087 4.789 12.055 438 H GLY 55 H GLY 55 5.459 3.011 10.828 439 1HA GLY 55 1HA GLY 55 2.823 3.848 11.829 440 2HA GLY 55 2HA GLY 55 2.949 3.135 10.228 441 H PHE 56 H PHE 56 1.343 2.041 12.212 442 HA PHE 56 HA PHE 56 2.563 -0.589 12.449 443 1HB PHE 56 1HB PHE 56 1.772 -0.736 14.861 444 2HB PHE 56 2HB PHE 56 3.193 0.263 14.571 445 HD1 PHE 56 HD1 PHE 56 2.766 2.797 14.253 446 HD2 PHE 56 HD2 PHE 56 -0.011 0.121 16.050 447 HE1 PHE 56 HE1 PHE 56 1.658 4.695 15.358 448 HE2 PHE 56 HE2 PHE 56 -1.125 2.014 17.159 449 HZ PHE 56 HZ PHE 56 -0.289 4.305 16.813 450 H GLY 57 H GLY 57 1.094 -2.261 12.429 451 1HA GLY 57 1HA GLY 57 -1.706 -1.855 12.878 452 2HA GLY 57 2HA GLY 57 -1.324 -1.958 11.167 453 H LEU 58 H LEU 58 -2.738 -3.853 11.244 454 HA LEU 58 HA LEU 58 -1.175 -6.250 11.855 455 1HB LEU 58 1HB LEU 58 -3.893 -5.585 12.920 456 2HB LEU 58 2HB LEU 58 -3.463 -7.258 12.616 457 HG LEU 58 HG LEU 58 -1.344 -6.590 14.084 458 1HD1 LEU 58 1HD1 LEU 58 -1.581 -4.854 15.509 459 2HD1 LEU 58 2HD1 LEU 58 -3.335 -5.023 15.600 460 3HD1 LEU 58 3HD1 LEU 58 -2.596 -4.228 14.210 461 1HD2 LEU 58 1HD2 LEU 58 -2.644 -8.418 14.733 462 2HD2 LEU 58 2HD2 LEU 58 -4.089 -7.431 14.954 463 3HD2 LEU 58 3HD2 LEU 58 -2.753 -7.310 16.101 464 H SER 59 H SER 59 -2.522 -8.246 11.003 465 HA SER 59 HA SER 59 -3.671 -7.515 8.390 466 1HB SER 59 1HB SER 59 -2.181 -10.085 8.676 467 2HB SER 59 2HB SER 59 -2.375 -9.050 7.262 468 HG SER 59 HG SER 59 -0.241 -9.019 8.194 469 H ARG 60 H ARG 60 -5.123 -9.117 7.469 470 HA ARG 60 HA ARG 60 -6.258 -11.012 9.392 471 1HB ARG 60 1HB ARG 60 -7.684 -8.733 8.068 472 2HB ARG 60 2HB ARG 60 -8.561 -10.208 8.450 473 1HG ARG 60 1HG ARG 60 -8.694 -9.688 10.608 474 2HG ARG 60 2HG ARG 60 -6.984 -9.257 10.692 475 1HD ARG 60 1HD ARG 60 -7.548 -7.076 9.634 476 2HD ARG 60 2HD ARG 60 -9.252 -7.513 9.738 477 HE ARG 60 HE ARG 60 -7.552 -6.620 11.880 478 1HH1 ARG 60 1HH1 ARG 60 -10.454 -8.380 11.069 479 2HH1 ARG 60 2HH1 ARG 60 -11.186 -8.134 12.618 480 1HH2 ARG 60 1HH2 ARG 60 -8.513 -6.296 13.919 481 2HH2 ARG 60 2HH2 ARG 60 -10.085 -6.950 14.237 482 H TRP 61 H TRP 61 -7.122 -12.846 8.496 483 HA TRP 61 HA TRP 61 -6.690 -13.163 5.607 484 1HB TRP 61 1HB TRP 61 -6.744 -15.629 6.147 485 2HB TRP 61 2HB TRP 61 -5.399 -14.739 6.853 486 HD1 TRP 61 HD1 TRP 61 -5.503 -14.294 9.531 487 HE1 TRP 61 HE1 TRP 61 -6.693 -15.599 11.403 488 HE3 TRP 61 HE3 TRP 61 -8.792 -16.982 6.685 489 HZ2 TRP 61 HZ2 TRP 61 -8.753 -17.515 11.642 490 HZ3 TRP 61 HZ3 TRP 61 -10.337 -18.529 7.813 491 HH2 TRP 61 HH2 TRP 61 -10.316 -18.789 10.241 492 H ASP 62 H ASP 62 -8.279 -13.937 4.268 493 HA ASP 62 HA ASP 62 -10.959 -14.224 5.461 494 1HB ASP 62 1HB ASP 62 -10.220 -12.206 3.799 495 2HB ASP 62 2HB ASP 62 -10.803 -13.388 2.632 496 HD2 ASP 62 HD2 ASP 62 -13.978 -12.324 3.292 497 H GLU 63 H GLU 63 -11.886 -16.128 5.162 498 HA GLU 63 HA GLU 63 -10.698 -18.269 3.850 499 1HB GLU 63 1HB GLU 63 -13.609 -17.853 4.542 500 2HB GLU 63 2HB GLU 63 -12.900 -19.393 4.078 501 1HG GLU 63 1HG GLU 63 -11.998 -19.734 6.098 502 2HG GLU 63 2HG GLU 63 -11.548 -18.042 6.299 503 HE2 GLU 63 HE2 GLU 63 -15.001 -19.284 7.759 504 H LYS 64 H LYS 64 -12.591 -15.700 2.556 505 HA LYS 64 HA LYS 64 -13.229 -17.159 0.120 506 1HB LYS 64 1HB LYS 64 -14.780 -15.479 1.293 507 2HB LYS 64 2HB LYS 64 -13.739 -14.235 0.614 508 1HG LYS 64 1HG LYS 64 -14.202 -15.479 -1.632 509 2HG LYS 64 2HG LYS 64 -15.602 -16.109 -0.762 510 1HD LYS 64 1HD LYS 64 -16.621 -14.072 -0.652 511 2HD LYS 64 2HD LYS 64 -15.094 -13.189 -0.612 512 1HE LYS 64 1HE LYS 64 -14.986 -14.263 -3.090 513 2HE LYS 64 2HE LYS 64 -16.727 -14.057 -2.903 514 1HZ LYS 64 1HZ LYS 64 -14.622 -11.981 -2.795 515 2HZ LYS 64 2HZ LYS 64 -16.181 -11.706 -2.202 516 3HZ LYS 64 3HZ LYS 64 -15.952 -12.072 -3.837 517 H GLY 65 H GLY 65 -10.416 -16.506 0.893 518 1HA GLY 65 1HA GLY 65 -8.494 -15.930 -0.220 519 2HA GLY 65 2HA GLY 65 -9.472 -15.799 -1.675 520 H ASN 66 H ASN 66 -9.373 -13.990 1.394 521 HA ASN 66 HA ASN 66 -8.821 -11.557 -0.161 522 1HB ASN 66 1HB ASN 66 -11.280 -12.110 0.987 523 2HB ASN 66 2HB ASN 66 -10.501 -11.079 2.183 524 1HD2 ASN 66 1HD2 ASN 66 -10.655 -11.215 -1.364 525 2HD2 ASN 66 2HD2 ASN 66 -11.067 -9.551 -1.577 526 H TRP 67 H TRP 67 -7.299 -10.251 0.676 527 HA TRP 67 HA TRP 67 -6.282 -10.909 3.363 528 1HB TRP 67 1HB TRP 67 -4.886 -11.163 1.069 529 2HB TRP 67 2HB TRP 67 -4.510 -9.487 1.459 530 HD1 TRP 67 HD1 TRP 67 -3.764 -9.297 4.298 531 HE1 TRP 67 HE1 TRP 67 -1.949 -10.724 5.434 532 HE3 TRP 67 HE3 TRP 67 -3.619 -13.201 1.000 533 HZ2 TRP 67 HZ2 TRP 67 -0.629 -13.181 4.991 534 HZ3 TRP 67 HZ3 TRP 67 -2.052 -15.049 1.429 535 HH2 TRP 67 HH2 TRP 67 -0.589 -15.037 3.383 536 H HIS 68 H HIS 68 -7.199 -9.425 4.667 537 HA HIS 68 HA HIS 68 -7.596 -6.698 3.854 538 1HB HIS 68 1HB HIS 68 -8.275 -8.368 6.183 539 2HB HIS 68 2HB HIS 68 -7.968 -6.678 6.560 540 HD1 HIS 68 HD1 HIS 68 -9.731 -8.047 3.494 541 HD2 HIS 68 HD2 HIS 68 -10.507 -5.740 6.861 542 HE1 HIS 68 HE1 HIS 68 -12.075 -7.186 3.194 543 HE2 HIS 68 HE2 HIS 68 -12.554 -5.867 5.287 544 H GLY 69 H GLY 69 -6.292 -4.998 4.157 545 1HA GLY 69 1HA GLY 69 -3.868 -5.425 5.795 546 2HA GLY 69 2HA GLY 69 -3.889 -4.470 4.319 547 H LEU 70 H LEU 70 -4.081 -4.381 7.664 548 HA LEU 70 HA LEU 70 -5.196 -1.654 7.606 549 1HB LEU 70 1HB LEU 70 -6.138 -3.761 9.047 550 2HB LEU 70 2HB LEU 70 -5.036 -3.038 10.202 551 HG LEU 70 HG LEU 70 -6.974 -1.244 8.827 552 1HD1 LEU 70 1HD1 LEU 70 -8.584 -2.786 9.376 553 2HD1 LEU 70 2HD1 LEU 70 -8.508 -1.835 10.858 554 3HD1 LEU 70 3HD1 LEU 70 -7.686 -3.392 10.767 555 1HD2 LEU 70 1HD2 LEU 70 -6.566 0.139 10.565 556 2HD2 LEU 70 2HD2 LEU 70 -5.091 -0.819 10.692 557 3HD2 LEU 70 3HD2 LEU 70 -6.468 -1.178 11.733 558 H TYR 71 H TYR 71 -3.759 -0.097 7.922 559 HA TYR 71 HA TYR 71 -1.581 -0.503 9.823 560 1HB TYR 71 1HB TYR 71 -0.985 0.657 7.107 561 2HB TYR 71 2HB TYR 71 0.152 0.110 8.335 562 HD1 TYR 71 HD1 TYR 71 0.338 -2.365 8.797 563 HD2 TYR 71 HD2 TYR 71 -1.787 -0.819 5.451 564 HE1 TYR 71 HE1 TYR 71 0.458 -4.567 7.710 565 HE2 TYR 71 HE2 TYR 71 -1.674 -3.016 4.355 566 HH TYR 71 HH TYR 71 -0.333 -5.042 4.424 567 H ALA 72 H ALA 72 -0.794 1.387 10.754 568 HA ALA 72 HA ALA 72 -2.164 3.878 9.995 569 1HB ALA 72 1HB ALA 72 -2.342 4.442 12.402 570 2HB ALA 72 2HB ALA 72 -1.771 2.820 12.790 571 3HB ALA 72 3HB ALA 72 -3.302 3.036 11.942 572 H MET 73 H MET 73 -0.617 5.175 9.248 573 HA MET 73 HA MET 73 2.021 5.137 10.535 574 1HB MET 73 1HB MET 73 1.337 5.078 7.871 575 2HB MET 73 2HB MET 73 1.720 6.776 8.122 576 1HG MET 73 1HG MET 73 3.662 4.943 9.299 577 2HG MET 73 2HG MET 73 3.516 4.806 7.549 578 1HE MET 73 1HE MET 73 4.982 5.547 6.355 579 2HE MET 73 2HE MET 73 6.390 6.322 7.080 580 3HE MET 73 3HE MET 73 5.315 7.249 6.034 581 H ALA 74 H ALA 74 2.923 6.944 11.430 582 HA ALA 74 HA ALA 74 1.251 9.368 11.509 583 1HB ALA 74 1HB ALA 74 1.317 9.501 13.764 584 2HB ALA 74 2HB ALA 74 2.932 8.801 13.868 585 3HB ALA 74 3HB ALA 74 1.531 7.754 13.638 586 H PHE 75 H PHE 75 2.277 11.295 11.275 587 HA PHE 75 HA PHE 75 5.196 11.193 10.876 588 1HB PHE 75 1HB PHE 75 3.084 12.865 9.513 589 2HB PHE 75 2HB PHE 75 4.804 13.217 9.391 590 HD1 PHE 75 HD1 PHE 75 2.129 11.595 7.864 591 HD2 PHE 75 HD2 PHE 75 6.276 11.122 8.688 592 HE1 PHE 75 HE1 PHE 75 2.315 10.005 5.996 593 HE2 PHE 75 HE2 PHE 75 6.470 9.532 6.821 594 HZ PHE 75 HZ PHE 75 4.488 8.973 5.471 595 H LYS 76 H LYS 76 6.427 12.428 12.139 596 HA LYS 76 HA LYS 76 5.107 14.520 13.742 597 1HB LYS 76 1HB LYS 76 5.918 12.609 15.077 598 2HB LYS 76 2HB LYS 76 7.540 12.870 14.453 599 1HG LYS 76 1HG LYS 76 7.909 14.681 15.771 600 2HG LYS 76 2HG LYS 76 6.210 15.159 15.779 601 1HD LYS 76 1HD LYS 76 6.227 14.359 17.880 602 2HD LYS 76 2HD LYS 76 6.099 12.784 17.094 603 1HE LYS 76 1HE LYS 76 8.808 13.947 17.474 604 2HE LYS 76 2HE LYS 76 7.975 13.308 18.890 605 1HZ LYS 76 1HZ LYS 76 7.879 11.181 17.951 606 2HZ LYS 76 2HZ LYS 76 9.447 11.718 17.619 607 3HZ LYS 76 3HZ LYS 76 8.272 11.735 16.402 608 H ASP 77 H ASP 77 5.601 16.478 13.025 609 HA ASP 77 HA ASP 77 7.710 17.090 11.289 610 1HB ASP 77 1HB ASP 77 6.365 19.048 13.156 611 2HB ASP 77 2HB ASP 77 7.118 19.392 11.601 612 HD2 ASP 77 HD2 ASP 77 4.291 17.545 10.142 613 H SER 78 H SER 78 9.413 18.787 11.800 614 HA SER 78 HA SER 78 11.017 17.791 13.985 615 1HB SER 78 1HB SER 78 12.105 18.240 11.856 616 2HB SER 78 2HB SER 78 11.571 19.920 11.905 617 HG SER 78 HG SER 78 13.739 18.789 13.037 618 H TRP 79 H TRP 79 9.157 20.653 13.228 619 HA TRP 79 HA TRP 79 9.337 21.506 15.989 620 1HB TRP 79 1HB TRP 79 11.269 22.563 14.624 621 2HB TRP 79 2HB TRP 79 10.010 23.552 13.891 622 HD1 TRP 79 HD1 TRP 79 9.914 25.840 15.008 623 HE1 TRP 79 HE1 TRP 79 10.206 26.752 17.398 624 HE3 TRP 79 HE3 TRP 79 10.977 21.461 17.425 625 HZ2 TRP 79 HZ2 TRP 79 10.806 25.747 19.967 626 HZ3 TRP 79 HZ3 TRP 79 11.397 21.524 19.848 627 HH2 TRP 79 HH2 TRP 79 11.314 23.624 21.091 628 H ASN 80 H ASN 80 7.091 20.632 15.357 629 HA ASN 80 HA ASN 80 5.343 22.891 15.138 630 1HB ASN 80 1HB ASN 80 5.608 20.956 12.858 631 2HB ASN 80 2HB ASN 80 4.054 21.713 13.195 632 1HD2 ASN 80 1HD2 ASN 80 4.143 24.128 13.431 633 2HD2 ASN 80 2HD2 ASN 80 5.147 24.985 12.316 634 H LYS 81 H LYS 81 4.734 19.524 14.200 635 HA LYS 81 HA LYS 81 3.892 18.554 16.675 636 1HB LYS 81 1HB LYS 81 2.130 20.454 15.930 637 2HB LYS 81 2HB LYS 81 1.415 19.062 15.129 638 1HG LYS 81 1HG LYS 81 0.722 18.149 17.055 639 2HG LYS 81 2HG LYS 81 2.192 18.603 17.919 640 1HD LYS 81 1HD LYS 81 0.786 20.023 18.979 641 2HD LYS 81 2HD LYS 81 1.101 21.034 17.568 642 1HE LYS 81 1HE LYS 81 -1.299 20.875 18.096 643 2HE LYS 81 2HE LYS 81 -0.916 20.234 16.500 644 1HZ LYS 81 1HZ LYS 81 -0.889 18.313 18.678 645 2HZ LYS 81 2HZ LYS 81 -1.485 18.156 17.104 646 3HZ LYS 81 3HZ LYS 81 -2.408 18.945 18.281 647 H TRP 82 H TRP 82 2.499 16.554 16.434 648 HA TRP 82 HA TRP 82 3.109 15.254 13.860 649 1HB TRP 82 1HB TRP 82 3.262 13.139 15.092 650 2HB TRP 82 2HB TRP 82 4.400 14.322 15.728 651 HD1 TRP 82 HD1 TRP 82 3.975 15.238 18.196 652 HE1 TRP 82 HE1 TRP 82 2.528 14.364 20.137 653 HE3 TRP 82 HE3 TRP 82 1.043 11.948 15.605 654 HZ2 TRP 82 HZ2 TRP 82 0.423 12.522 20.519 655 HZ3 TRP 82 HZ3 TRP 82 -0.663 10.668 16.833 656 HH2 TRP 82 HH2 TRP 82 -0.965 10.951 19.239 657 H GLU 83 H GLU 83 1.568 13.914 12.924 658 HA GLU 83 HA GLU 83 -1.074 13.823 14.192 659 1HB GLU 83 1HB GLU 83 -0.359 15.063 11.584 660 2HB GLU 83 2HB GLU 83 -1.870 14.168 11.669 661 1HG GLU 83 1HG GLU 83 -2.778 16.055 12.399 662 2HG GLU 83 2HG GLU 83 -1.955 15.731 13.924 663 HE2 GLU 83 HE2 GLU 83 0.053 18.472 13.530 664 HA PRO 84 HA PRO 84 -0.546 9.595 12.820 665 1HB PRO 84 1HB PRO 84 -2.825 8.593 13.844 666 2HB PRO 84 2HB PRO 84 -1.452 9.030 14.867 667 1HG PRO 84 1HG PRO 84 -3.962 10.562 14.309 668 2HG PRO 84 2HG PRO 84 -3.119 10.319 15.851 669 1HD PRO 84 1HD PRO 84 -2.885 12.589 14.354 670 2HD PRO 84 2HD PRO 84 -1.605 11.992 15.427 671 H ILE 85 H ILE 85 -1.773 7.997 11.530 672 HA ILE 85 HA ILE 85 -3.993 9.033 9.962 673 HB ILE 85 HB ILE 85 -1.509 8.053 8.559 674 1HG1 ILE 85 1HG1 ILE 85 -2.506 10.888 8.922 675 2HG1 ILE 85 2HG1 ILE 85 -1.047 10.206 9.633 676 1HG2 ILE 85 1HG2 ILE 85 -3.985 7.947 7.624 677 2HG2 ILE 85 2HG2 ILE 85 -2.615 8.351 6.591 678 3HG2 ILE 85 3HG2 ILE 85 -3.643 9.632 7.233 679 1HD1 ILE 85 1HD1 ILE 85 -1.588 11.034 6.834 680 2HD1 ILE 85 2HD1 ILE 85 -0.435 9.733 7.129 681 3HD1 ILE 85 3HD1 ILE 85 -0.174 11.322 7.848 682 H ALA 86 H ALA 86 -5.423 7.467 9.596 683 HA ALA 86 HA ALA 86 -4.588 4.690 10.047 684 1HB ALA 86 1HB ALA 86 -6.358 4.980 11.451 685 2HB ALA 86 2HB ALA 86 -7.227 4.458 10.008 686 3HB ALA 86 3HB ALA 86 -7.134 6.173 10.407 687 H GLY 87 H GLY 87 -5.182 3.025 8.615 688 1HA GLY 87 1HA GLY 87 -6.448 3.703 6.094 689 2HA GLY 87 2HA GLY 87 -4.745 3.288 5.978 690 H TYR 88 H TYR 88 -7.451 2.002 5.191 691 HA TYR 88 HA TYR 88 -6.603 -0.704 5.857 692 1HB TYR 88 1HB TYR 88 -8.902 -1.367 6.502 693 2HB TYR 88 2HB TYR 88 -8.196 -0.206 7.621 694 HD1 TYR 88 HD1 TYR 88 -8.757 2.325 7.062 695 HD2 TYR 88 HD2 TYR 88 -11.065 -1.011 5.777 696 HE1 TYR 88 HE1 TYR 88 -10.709 3.793 6.774 697 HE2 TYR 88 HE2 TYR 88 -13.022 0.448 5.485 698 HH TYR 88 HH TYR 88 -13.623 2.994 6.741 699 H GLY 89 H GLY 89 -7.264 -2.270 4.371 700 1HA GLY 89 1HA GLY 89 -9.137 -1.737 2.290 701 2HA GLY 89 2HA GLY 89 -7.487 -1.525 1.721 702 H TRP 90 H TRP 90 -8.271 -3.305 0.264 703 HA TRP 90 HA TRP 90 -7.625 -5.890 1.506 704 1HB TRP 90 1HB TRP 90 -9.307 -6.971 0.037 705 2HB TRP 90 2HB TRP 90 -10.031 -5.858 1.192 706 HD1 TRP 90 HD1 TRP 90 -8.814 -5.672 -2.500 707 HE1 TRP 90 HE1 TRP 90 -10.500 -4.234 -3.809 708 HE3 TRP 90 HE3 TRP 90 -11.974 -4.440 1.326 709 HZ2 TRP 90 HZ2 TRP 90 -12.856 -2.769 -3.289 710 HZ3 TRP 90 HZ3 TRP 90 -13.920 -3.016 0.835 711 HH2 TRP 90 HH2 TRP 90 -14.351 -2.199 -1.425 712 H GLU 91 H GLU 91 -6.509 -7.358 0.209 713 HA GLU 91 HA GLU 91 -5.840 -6.644 -2.518 714 1HB GLU 91 1HB GLU 91 -3.933 -6.400 -0.247 715 2HB GLU 91 2HB GLU 91 -3.319 -7.082 -1.747 716 1HG GLU 91 1HG GLU 91 -3.866 -5.110 -2.959 717 2HG GLU 91 2HG GLU 91 -4.760 -4.448 -1.591 718 HE2 GLU 91 HE2 GLU 91 -0.952 -3.740 -1.820 719 H SER 92 H SER 92 -4.874 -8.362 -3.695 720 HA SER 92 HA SER 92 -5.205 -10.980 -2.393 721 1HB SER 92 1HB SER 92 -5.779 -9.982 -5.138 722 2HB SER 92 2HB SER 92 -5.228 -11.649 -4.981 723 HG SER 92 HG SER 92 -7.572 -10.447 -4.034 724 H THR 93 H THR 93 -3.383 -11.992 -1.909 725 HA THR 93 HA THR 93 -0.900 -11.246 -3.223 726 HB THR 93 HB THR 93 -1.252 -13.298 -1.039 727 HG1 THR 93 HG1 THR 93 -1.708 -11.741 0.262 728 1HG2 THR 93 1HG2 THR 93 1.065 -11.631 -1.961 729 2HG2 THR 93 2HG2 THR 93 0.948 -13.388 -1.856 730 3HG2 THR 93 3HG2 THR 93 1.018 -12.419 -0.384 731 H TRP 94 H TRP 94 -0.090 -12.318 -4.891 732 HA TRP 94 HA TRP 94 -1.064 -15.045 -5.414 733 1HB TRP 94 1HB TRP 94 -0.376 -12.753 -7.172 734 2HB TRP 94 2HB TRP 94 0.034 -14.359 -7.767 735 HD1 TRP 94 HD1 TRP 94 -2.345 -16.110 -7.176 736 HE1 TRP 94 HE1 TRP 94 -4.701 -15.634 -8.095 737 HE3 TRP 94 HE3 TRP 94 -1.848 -11.113 -8.133 738 HZ2 TRP 94 HZ2 TRP 94 -6.156 -13.431 -9.094 739 HZ3 TRP 94 HZ3 TRP 94 -3.770 -9.896 -9.070 740 HH2 TRP 94 HH2 TRP 94 -5.878 -11.032 -9.541 741 H ARG 95 H ARG 95 0.318 -16.681 -5.267 742 HA ARG 95 HA ARG 95 3.187 -16.063 -5.095 743 1HB ARG 95 1HB ARG 95 2.212 -17.108 -3.093 744 2HB ARG 95 2HB ARG 95 1.673 -18.471 -4.065 745 1HG ARG 95 1HG ARG 95 4.050 -18.943 -4.613 746 2HG ARG 95 2HG ARG 95 4.514 -17.669 -3.483 747 1HD ARG 95 1HD ARG 95 3.996 -18.910 -1.660 748 2HD ARG 95 2HD ARG 95 2.647 -19.716 -2.460 749 HE ARG 95 HE ARG 95 5.373 -20.615 -2.324 750 1HH1 ARG 95 1HH1 ARG 95 2.385 -20.802 -4.118 751 2HH1 ARG 95 2HH1 ARG 95 2.757 -22.343 -4.818 752 1HH2 ARG 95 1HH2 ARG 95 5.863 -22.641 -3.244 753 2HH2 ARG 95 2HH2 ARG 95 4.731 -23.386 -4.322 754 HA PRO 96 HA PRO 96 3.765 -18.202 -8.936 755 1HB PRO 96 1HB PRO 96 6.426 -18.683 -8.777 756 2HB PRO 96 2HB PRO 96 5.764 -17.075 -9.094 757 1HG PRO 96 1HG PRO 96 6.765 -18.237 -6.523 758 2HG PRO 96 2HG PRO 96 7.044 -16.624 -7.206 759 1HD PRO 96 1HD PRO 96 5.211 -17.096 -5.264 760 2HD PRO 96 2HD PRO 96 5.003 -15.830 -6.492 761 H LEU 97 H LEU 97 4.841 -20.261 -9.762 762 HA LEU 97 HA LEU 97 4.280 -22.413 -7.845 763 1HB LEU 97 1HB LEU 97 4.134 -22.183 -10.817 764 2HB LEU 97 2HB LEU 97 4.410 -23.763 -10.108 765 HG LEU 97 HG LEU 97 2.136 -22.159 -9.056 766 1HD1 LEU 97 1HD1 LEU 97 1.717 -21.806 -11.344 767 2HD1 LEU 97 2HD1 LEU 97 0.717 -23.186 -10.889 768 3HD1 LEU 97 3HD1 LEU 97 2.223 -23.440 -11.772 769 1HD2 LEU 97 1HD2 LEU 97 2.911 -25.015 -9.354 770 2HD2 LEU 97 2HD2 LEU 97 1.196 -24.608 -9.304 771 3HD2 LEU 97 3HD2 LEU 97 2.248 -24.162 -7.960 772 H ALA 98 H ALA 98 6.414 -22.013 -6.873 773 HA ALA 98 HA ALA 98 8.307 -23.914 -7.717 774 1HB ALA 98 1HB ALA 98 8.670 -22.129 -9.455 775 2HB ALA 98 2HB ALA 98 10.100 -22.597 -8.536 776 3HB ALA 98 3HB ALA 98 9.260 -21.094 -8.155 777 H ASP 99 H ASP 99 8.563 -20.657 -6.280 778 HA ASP 99 HA ASP 99 8.916 -21.772 -3.640 779 1HB ASP 99 1HB ASP 99 11.180 -20.226 -4.922 780 2HB ASP 99 2HB ASP 99 11.130 -20.805 -3.260 781 HD2 ASP 99 HD2 ASP 99 12.478 -23.201 -5.964 782 H GLU 100 H GLU 100 9.411 -19.937 -2.037 783 HA GLU 100 HA GLU 100 7.653 -17.705 -2.728 784 1HB GLU 100 1HB GLU 100 8.722 -18.653 -0.063 785 2HB GLU 100 2HB GLU 100 7.665 -17.263 -0.274 786 1HG GLU 100 1HG GLU 100 5.888 -18.655 -1.069 787 2HG GLU 100 2HG GLU 100 6.945 -20.068 -1.089 788 HE2 GLU 100 HE2 GLU 100 5.607 -20.695 2.025 789 H ASN 101 H ASN 101 9.699 -17.129 -4.108 790 HA ASN 101 HA ASN 101 11.586 -15.558 -2.500 791 1HB ASN 101 1HB ASN 101 11.697 -16.684 -5.286 792 2HB ASN 101 2HB ASN 101 12.785 -15.392 -4.789 793 1HD2 ASN 101 1HD2 ASN 101 14.627 -16.609 -4.927 794 2HD2 ASN 101 2HD2 ASN 101 14.986 -17.904 -3.842 795 H PHE 102 H PHE 102 9.311 -15.318 -5.188 796 HA PHE 102 HA PHE 102 9.362 -12.391 -4.863 797 1HB PHE 102 1HB PHE 102 10.474 -13.094 -6.974 798 2HB PHE 102 2HB PHE 102 8.976 -13.874 -7.472 799 HD1 PHE 102 HD1 PHE 102 10.337 -10.572 -6.435 800 HD2 PHE 102 HD2 PHE 102 7.411 -12.686 -8.688 801 HE1 PHE 102 HE1 PHE 102 9.567 -8.451 -7.417 802 HE2 PHE 102 HE2 PHE 102 6.636 -10.569 -9.675 803 HZ PHE 102 HZ PHE 102 7.714 -8.448 -9.040 804 H HIS 103 H HIS 103 7.471 -11.605 -4.238 805 HA HIS 103 HA HIS 103 5.039 -13.159 -4.826 806 1HB HIS 103 1HB HIS 103 6.014 -11.849 -2.399 807 2HB HIS 103 2HB HIS 103 4.357 -11.407 -2.799 808 HD1 HIS 103 HD1 HIS 103 3.572 -12.731 -0.680 809 HD2 HIS 103 HD2 HIS 103 5.384 -15.048 -3.614 810 HE1 HIS 103 HE1 HIS 103 3.017 -15.113 -0.094 811 HE2 HIS 103 HE2 HIS 103 4.051 -16.490 -1.932 812 H LEU 104 H LEU 104 3.246 -12.135 -5.647 813 HA LEU 104 HA LEU 104 3.466 -9.267 -6.230 814 1HB LEU 104 1HB LEU 104 4.020 -11.049 -8.153 815 2HB LEU 104 2HB LEU 104 2.276 -10.992 -8.329 816 HG LEU 104 HG LEU 104 2.442 -8.513 -8.602 817 1HD1 LEU 104 1HD1 LEU 104 4.895 -8.722 -7.526 818 2HD1 LEU 104 2HD1 LEU 104 4.389 -7.378 -8.548 819 3HD1 LEU 104 3HD1 LEU 104 5.313 -8.712 -9.239 820 1HD2 LEU 104 1HD2 LEU 104 3.791 -8.808 -10.875 821 2HD2 LEU 104 2HD2 LEU 104 2.169 -9.463 -10.648 822 3HD2 LEU 104 3HD2 LEU 104 3.576 -10.513 -10.474 823 H GLY 105 H GLY 105 1.676 -8.179 -5.723 824 1HA GLY 105 1HA GLY 105 -0.900 -9.593 -5.747 825 2HA GLY 105 2HA GLY 105 -0.395 -8.768 -4.281 826 H LEU 106 H LEU 106 -2.741 -8.021 -5.310 827 HA LEU 106 HA LEU 106 -2.283 -5.262 -5.955 828 1HB LEU 106 1HB LEU 106 -2.336 -6.823 -8.135 829 2HB LEU 106 2HB LEU 106 -4.059 -6.569 -7.936 830 HG LEU 106 HG LEU 106 -2.298 -4.172 -7.877 831 1HD1 LEU 106 1HD1 LEU 106 -2.069 -4.031 -10.213 832 2HD1 LEU 106 2HD1 LEU 106 -3.148 -5.399 -10.483 833 3HD1 LEU 106 3HD1 LEU 106 -1.548 -5.661 -9.789 834 1HD2 LEU 106 1HD2 LEU 106 -4.463 -3.514 -7.622 835 2HD2 LEU 106 2HD2 LEU 106 -5.104 -4.874 -8.544 836 3HD2 LEU 106 3HD2 LEU 106 -4.374 -3.505 -9.383 837 H GLY 107 H GLY 107 -4.140 -3.962 -5.682 838 1HA GLY 107 1HA GLY 107 -6.757 -4.822 -5.359 839 2HA GLY 107 2HA GLY 107 -5.998 -4.967 -3.780 840 H PHE 108 H PHE 108 -7.644 -3.380 -3.159 841 HA PHE 108 HA PHE 108 -6.850 -0.637 -3.892 842 1HB PHE 108 1HB PHE 108 -9.534 -1.833 -3.276 843 2HB PHE 108 2HB PHE 108 -9.250 -0.114 -3.019 844 HD1 PHE 108 HD1 PHE 108 -9.546 1.368 -4.765 845 HD2 PHE 108 HD2 PHE 108 -8.936 -2.756 -5.620 846 HE1 PHE 108 HE1 PHE 108 -9.993 1.799 -7.146 847 HE2 PHE 108 HE2 PHE 108 -9.382 -2.333 -8.003 848 HZ PHE 108 HZ PHE 108 -9.911 -0.052 -8.768 849 H THR 109 H THR 109 -6.689 0.912 -2.260 850 HA THR 109 HA THR 109 -6.835 -0.080 0.502 851 HB THR 109 HB THR 109 -4.738 1.500 0.801 852 HG1 THR 109 HG1 THR 109 -4.040 2.162 -1.054 853 1HG2 THR 109 1HG2 THR 109 -5.029 -1.301 0.423 854 2HG2 THR 109 2HG2 THR 109 -3.818 -0.424 1.358 855 3HG2 THR 109 3HG2 THR 109 -3.535 -0.770 -0.348 856 H ALA 110 H ALA 110 -7.639 1.330 1.972 857 HA ALA 110 HA ALA 110 -8.382 4.000 0.970 858 1HB ALA 110 1HB ALA 110 -9.837 1.992 2.580 859 2HB ALA 110 2HB ALA 110 -10.437 3.141 1.384 860 3HB ALA 110 3HB ALA 110 -10.070 3.683 3.022 861 H GLY 111 H GLY 111 -8.223 5.786 2.375 862 1HA GLY 111 1HA GLY 111 -6.759 5.346 4.886 863 2HA GLY 111 2HA GLY 111 -6.079 6.435 3.686 864 H VAL 112 H VAL 112 -7.169 6.792 6.491 865 HA VAL 112 HA VAL 112 -9.001 9.010 5.845 866 HB VAL 112 HB VAL 112 -9.947 8.659 8.175 867 1HG1 VAL 112 1HG1 VAL 112 -11.378 6.714 7.415 868 2HG1 VAL 112 2HG1 VAL 112 -10.368 6.658 5.971 869 3HG1 VAL 112 3HG1 VAL 112 -11.313 8.103 6.331 870 1HG2 VAL 112 1HG2 VAL 112 -8.286 7.258 9.152 871 2HG2 VAL 112 2HG2 VAL 112 -8.447 6.066 7.862 872 3HG2 VAL 112 3HG2 VAL 112 -9.761 6.303 9.013 873 H THR 113 H THR 113 -8.265 10.944 6.412 874 HA THR 113 HA THR 113 -6.126 11.091 8.431 875 HB THR 113 HB THR 113 -6.649 13.241 6.402 876 HG1 THR 113 HG1 THR 113 -5.146 12.185 5.048 877 1HG2 THR 113 1HG2 THR 113 -3.908 12.744 6.832 878 2HG2 THR 113 2HG2 THR 113 -4.691 12.810 8.410 879 3HG2 THR 113 3HG2 THR 113 -4.853 14.161 7.289 880 H ALA 114 H ALA 114 -6.675 11.977 10.300 881 HA ALA 114 HA ALA 114 -8.736 14.079 10.321 882 1HB ALA 114 1HB ALA 114 -9.998 13.065 11.893 883 2HB ALA 114 2HB ALA 114 -8.606 12.339 12.698 884 3HB ALA 114 3HB ALA 114 -9.261 11.604 11.235 885 H ARG 115 H ARG 115 -8.533 15.656 11.955 886 HA ARG 115 HA ARG 115 -6.136 15.588 13.617 887 1HB ARG 115 1HB ARG 115 -5.391 17.788 12.889 888 2HB ARG 115 2HB ARG 115 -5.435 16.678 11.525 889 1HG ARG 115 1HG ARG 115 -7.775 18.448 12.079 890 2HG ARG 115 2HG ARG 115 -6.348 19.090 11.260 891 1HD ARG 115 1HD ARG 115 -6.635 16.946 9.772 892 2HD ARG 115 2HD ARG 115 -8.299 17.027 10.351 893 HE ARG 115 HE ARG 115 -7.754 19.555 9.477 894 1HH1 ARG 115 1HH1 ARG 115 -7.621 16.377 8.041 895 2HH1 ARG 115 2HH1 ARG 115 -7.966 16.948 6.443 896 1HH2 ARG 115 1HH2 ARG 115 -8.209 20.308 7.375 897 2HH2 ARG 115 2HH2 ARG 115 -8.300 19.179 6.065 898 H ASP 116 H ASP 116 -6.107 17.922 14.809 899 HA ASP 116 HA ASP 116 -7.077 19.181 16.434 900 1HB ASP 116 1HB ASP 116 -8.628 19.530 14.169 901 2HB ASP 116 2HB ASP 116 -9.813 19.117 15.404 902 HD2 ASP 116 HD2 ASP 116 -9.637 22.274 16.683 903 H ASN 117 H ASN 117 -9.501 19.203 17.669 904 HA ASN 117 HA ASN 117 -9.370 16.961 19.349 905 1HB ASN 117 1HB ASN 117 -11.608 18.958 18.958 906 2HB ASN 117 2HB ASN 117 -11.522 17.799 20.281 907 1HD2 ASN 117 1HD2 ASN 117 -10.494 18.375 22.068 908 2HD2 ASN 117 2HD2 ASN 117 -9.476 19.761 22.238 909 H TRP 118 H TRP 118 -11.635 15.797 19.841 910 HA TRP 118 HA TRP 118 -12.202 14.288 17.413 911 1HB TRP 118 1HB TRP 118 -12.581 13.801 20.342 912 2HB TRP 118 2HB TRP 118 -13.556 12.895 19.188 913 HD1 TRP 118 HD1 TRP 118 -9.768 13.661 19.663 914 HE1 TRP 118 HE1 TRP 118 -8.461 11.513 19.112 915 HE3 TRP 118 HE3 TRP 118 -13.680 10.640 18.354 916 HZ2 TRP 118 HZ2 TRP 118 -9.014 8.886 18.238 917 HZ3 TRP 118 HZ3 TRP 118 -13.206 8.325 17.672 918 HH2 TRP 118 HH2 TRP 118 -10.920 7.468 17.615 919 H ASN 119 H ASN 119 -13.505 15.840 16.339 920 HA ASN 119 HA ASN 119 -16.290 15.663 17.055 921 1HB ASN 119 1HB ASN 119 -14.729 18.094 17.592 922 2HB ASN 119 2HB ASN 119 -16.192 18.376 16.654 923 1HD2 ASN 119 1HD2 ASN 119 -18.057 18.514 17.697 924 2HD2 ASN 119 2HD2 ASN 119 -18.314 18.095 19.353 925 H TYR 120 H TYR 120 -14.011 17.503 15.021 926 HA TYR 120 HA TYR 120 -15.743 17.841 12.842 927 1HB TYR 120 1HB TYR 120 -12.780 17.968 13.212 928 2HB TYR 120 2HB TYR 120 -13.428 17.976 11.576 929 HD1 TYR 120 HD1 TYR 120 -14.574 19.895 10.709 930 HD2 TYR 120 HD2 TYR 120 -13.302 19.809 14.768 931 HE1 TYR 120 HE1 TYR 120 -15.004 22.310 10.888 932 HE2 TYR 120 HE2 TYR 120 -13.730 22.224 14.959 933 HH TYR 120 HH TYR 120 -15.494 23.907 13.438 934 H ILE 121 H ILE 121 -14.933 16.928 10.574 935 HA ILE 121 HA ILE 121 -15.062 14.005 10.839 936 HB ILE 121 HB ILE 121 -15.775 14.096 8.408 937 1HG1 ILE 121 1HG1 ILE 121 -16.233 17.018 9.036 938 2HG1 ILE 121 2HG1 ILE 121 -14.901 16.426 8.048 939 1HG2 ILE 121 1HG2 ILE 121 -17.340 15.074 10.734 940 2HG2 ILE 121 2HG2 ILE 121 -17.540 13.613 9.766 941 3HG2 ILE 121 3HG2 ILE 121 -18.080 15.170 9.136 942 1HD1 ILE 121 1HD1 ILE 121 -17.255 17.252 7.062 943 2HD1 ILE 121 2HD1 ILE 121 -17.581 15.528 7.239 944 3HD1 ILE 121 3HD1 ILE 121 -16.216 16.072 6.263 945 HA PRO 122 HA PRO 122 -10.984 13.654 9.151 946 1HB PRO 122 1HB PRO 122 -11.052 11.104 8.270 947 2HB PRO 122 2HB PRO 122 -11.025 11.507 9.991 948 1HG PRO 122 1HG PRO 122 -13.346 10.746 8.260 949 2HG PRO 122 2HG PRO 122 -12.956 10.212 9.906 950 1HD PRO 122 1HD PRO 122 -14.791 12.150 9.366 951 2HD PRO 122 2HD PRO 122 -13.838 12.106 10.863 952 H LEU 123 H LEU 123 -10.068 12.323 7.028 953 HA LEU 123 HA LEU 123 -11.634 13.294 4.730 954 1HB LEU 123 1HB LEU 123 -8.824 13.836 5.489 955 2HB LEU 123 2HB LEU 123 -9.119 13.510 3.792 956 HG LEU 123 HG LEU 123 -10.864 15.336 3.848 957 1HD1 LEU 123 1HD1 LEU 123 -9.614 15.793 6.548 958 2HD1 LEU 123 2HD1 LEU 123 -11.312 15.488 6.183 959 3HD1 LEU 123 3HD1 LEU 123 -10.562 17.004 5.684 960 1HD2 LEU 123 1HD2 LEU 123 -8.911 15.946 2.773 961 2HD2 LEU 123 2HD2 LEU 123 -7.935 15.791 4.234 962 3HD2 LEU 123 3HD2 LEU 123 -9.029 17.162 4.045 963 HA PRO 124 HA PRO 124 -10.864 8.829 4.030 964 1HB PRO 124 1HB PRO 124 -13.031 8.475 2.425 965 2HB PRO 124 2HB PRO 124 -13.118 8.426 4.190 966 1HG PRO 124 1HG PRO 124 -13.785 10.668 2.322 967 2HG PRO 124 2HG PRO 124 -14.668 10.104 3.753 968 1HD PRO 124 1HD PRO 124 -13.066 12.278 3.810 969 2HD PRO 124 2HD PRO 124 -13.264 11.208 5.213 970 H VAL 125 H VAL 125 -9.967 7.790 2.284 971 HA VAL 125 HA VAL 125 -10.057 9.000 -0.352 972 HB VAL 125 HB VAL 125 -7.529 8.917 -0.530 973 1HG1 VAL 125 1HG1 VAL 125 -8.921 10.994 -0.314 974 2HG1 VAL 125 2HG1 VAL 125 -7.257 11.149 0.246 975 3HG1 VAL 125 3HG1 VAL 125 -8.566 10.970 1.413 976 1HG2 VAL 125 1HG2 VAL 125 -7.520 7.660 1.801 977 2HG2 VAL 125 2HG2 VAL 125 -7.392 9.309 2.411 978 3HG2 VAL 125 3HG2 VAL 125 -6.178 8.685 1.294 979 H LEU 126 H LEU 126 -9.612 7.562 -1.998 980 HA LEU 126 HA LEU 126 -8.850 4.833 -1.204 981 1HB LEU 126 1HB LEU 126 -11.136 5.700 -2.957 982 2HB LEU 126 2HB LEU 126 -10.464 4.083 -3.045 983 HG LEU 126 HG LEU 126 -10.923 4.136 -0.430 984 1HD1 LEU 126 1HD1 LEU 126 -13.294 5.288 -0.336 985 2HD1 LEU 126 2HD1 LEU 126 -12.575 6.328 -1.565 986 3HD1 LEU 126 3HD1 LEU 126 -11.818 6.185 0.022 987 1HD2 LEU 126 1HD2 LEU 126 -13.176 3.716 -2.381 988 2HD2 LEU 126 2HD2 LEU 126 -12.922 2.915 -0.830 989 3HD2 LEU 126 3HD2 LEU 126 -11.836 2.587 -2.181 990 H LEU 127 H LEU 127 -7.046 4.267 -2.206 991 HA LEU 127 HA LEU 127 -6.688 5.004 -5.020 992 1HB LEU 127 1HB LEU 127 -4.519 5.251 -2.935 993 2HB LEU 127 2HB LEU 127 -4.359 5.596 -4.647 994 HG LEU 127 HG LEU 127 -6.418 7.118 -3.137 995 1HD1 LEU 127 1HD1 LEU 127 -4.335 8.758 -2.781 996 2HD1 LEU 127 2HD1 LEU 127 -3.518 7.208 -2.580 997 3HD1 LEU 127 3HD1 LEU 127 -4.889 7.623 -1.550 998 1HD2 LEU 127 1HD2 LEU 127 -5.638 7.205 -5.674 999 2HD2 LEU 127 2HD2 LEU 127 -4.446 8.317 -5.001 1000 3HD2 LEU 127 3HD2 LEU 127 -6.169 8.645 -4.805 1001 HA PRO 128 HA PRO 128 -5.518 0.764 -5.424 1002 1HB PRO 128 1HB PRO 128 -4.031 0.870 -7.685 1003 2HB PRO 128 2HB PRO 128 -5.790 1.050 -7.691 1004 1HG PRO 128 1HG PRO 128 -3.668 3.159 -7.806 1005 2HG PRO 128 2HG PRO 128 -5.173 3.034 -8.736 1006 1HD PRO 128 1HD PRO 128 -4.915 4.652 -6.573 1007 2HD PRO 128 2HD PRO 128 -6.452 3.885 -7.020 1008 H LEU 129 H LEU 129 -3.863 -0.623 -4.912 1009 HA LEU 129 HA LEU 129 -1.145 0.431 -4.707 1010 1HB LEU 129 1HB LEU 129 -2.689 0.460 -2.497 1011 2HB LEU 129 2HB LEU 129 -2.053 -1.170 -2.391 1012 HG LEU 129 HG LEU 129 -0.112 1.035 -2.861 1013 1HD1 LEU 129 1HD1 LEU 129 -1.442 2.027 -1.141 1014 2HD1 LEU 129 2HD1 LEU 129 0.031 1.398 -0.402 1015 3HD1 LEU 129 3HD1 LEU 129 -1.487 0.516 -0.232 1016 1HD2 LEU 129 1HD2 LEU 129 1.394 -0.448 -2.075 1017 2HD2 LEU 129 2HD2 LEU 129 0.152 -1.620 -2.515 1018 3HD2 LEU 129 3HD2 LEU 129 0.297 -1.074 -0.843 1019 H ALA 130 H ALA 130 0.485 -1.189 -4.607 1020 HA ALA 130 HA ALA 130 -0.452 -3.883 -5.357 1021 1HB ALA 130 1HB ALA 130 1.850 -3.883 -6.630 1022 2HB ALA 130 2HB ALA 130 1.604 -2.137 -6.617 1023 3HB ALA 130 3HB ALA 130 0.405 -3.191 -7.365 1024 H SER 131 H SER 131 0.579 -5.616 -4.456 1025 HA SER 131 HA SER 131 2.481 -4.996 -2.305 1026 1HB SER 131 1HB SER 131 0.590 -6.126 -1.421 1027 2HB SER 131 2HB SER 131 0.578 -7.298 -2.740 1028 HG SER 131 HG SER 131 2.518 -7.060 -0.682 1029 H VAL 132 H VAL 132 4.497 -5.821 -2.277 1030 HA VAL 132 HA VAL 132 5.209 -7.902 -4.214 1031 HB VAL 132 HB VAL 132 6.861 -5.400 -3.869 1032 1HG1 VAL 132 1HG1 VAL 132 8.054 -7.492 -4.485 1033 2HG1 VAL 132 2HG1 VAL 132 8.155 -6.231 -5.713 1034 3HG1 VAL 132 3HG1 VAL 132 7.051 -7.590 -5.932 1035 1HG2 VAL 132 1HG2 VAL 132 4.680 -4.961 -4.986 1036 2HG2 VAL 132 2HG2 VAL 132 5.127 -6.136 -6.222 1037 3HG2 VAL 132 3HG2 VAL 132 6.080 -4.667 -6.016 1038 H GLY 133 H GLY 133 6.102 -9.503 -3.098 1039 1HA GLY 133 1HA GLY 133 7.509 -8.880 -0.596 1040 2HA GLY 133 2HA GLY 133 6.881 -10.455 -1.056 1041 H TYR 134 H TYR 134 9.625 -8.561 -0.805 1042 HA TYR 134 HA TYR 134 11.137 -10.439 -2.498 1043 1HB TYR 134 1HB TYR 134 10.908 -7.747 -2.981 1044 2HB TYR 134 2HB TYR 134 12.398 -7.824 -2.045 1045 HD1 TYR 134 HD1 TYR 134 11.238 -7.702 -5.253 1046 HD2 TYR 134 HD2 TYR 134 13.890 -10.009 -2.857 1047 HE1 TYR 134 HE1 TYR 134 12.463 -8.382 -7.274 1048 HE2 TYR 134 HE2 TYR 134 15.123 -10.695 -4.870 1049 HH TYR 134 HH TYR 134 14.125 -10.725 -7.717 1050 H GLY 135 H GLY 135 12.323 -11.731 -1.264 1051 1HA GLY 135 1HA GLY 135 13.692 -12.478 0.419 1052 2HA GLY 135 2HA GLY 135 14.280 -10.826 0.524 1053 HA PRO 136 HA PRO 136 12.262 -11.646 4.563 1054 1HB PRO 136 1HB PRO 136 13.991 -10.191 6.042 1055 2HB PRO 136 2HB PRO 136 14.341 -11.848 5.532 1056 1HG PRO 136 1HG PRO 136 15.278 -9.264 4.345 1057 2HG PRO 136 2HG PRO 136 16.195 -10.749 4.655 1058 1HD PRO 136 1HD PRO 136 15.228 -10.091 2.201 1059 2HD PRO 136 2HD PRO 136 15.431 -11.769 2.741 1060 H VAL 137 H VAL 137 12.736 -8.903 2.635 1061 HA VAL 137 HA VAL 137 11.152 -7.226 4.466 1062 HB VAL 137 HB VAL 137 12.795 -6.277 2.118 1063 1HG1 VAL 137 1HG1 VAL 137 11.386 -4.856 4.367 1064 2HG1 VAL 137 2HG1 VAL 137 11.071 -4.722 2.638 1065 3HG1 VAL 137 3HG1 VAL 137 12.569 -4.081 3.313 1066 1HG2 VAL 137 1HG2 VAL 137 13.520 -6.205 5.046 1067 2HG2 VAL 137 2HG2 VAL 137 14.478 -5.573 3.707 1068 3HG2 VAL 137 3HG2 VAL 137 14.210 -7.310 3.857 1069 H THR 138 H THR 138 9.469 -5.917 3.559 1070 HA THR 138 HA THR 138 8.355 -7.026 1.065 1071 HB THR 138 HB THR 138 6.756 -5.863 3.347 1072 HG1 THR 138 HG1 THR 138 7.293 -8.589 2.779 1073 1HG2 THR 138 1HG2 THR 138 5.959 -7.572 1.005 1074 2HG2 THR 138 2HG2 THR 138 5.535 -5.882 1.274 1075 3HG2 THR 138 3HG2 THR 138 4.906 -7.130 2.349 1076 H PHE 139 H PHE 139 7.459 -5.621 -0.420 1077 HA PHE 139 HA PHE 139 7.759 -2.748 0.149 1078 1HB PHE 139 1HB PHE 139 8.542 -4.240 -2.359 1079 2HB PHE 139 2HB PHE 139 8.408 -2.486 -2.275 1080 HD1 PHE 139 HD1 PHE 139 9.882 -1.251 -0.631 1081 HD2 PHE 139 HD2 PHE 139 10.488 -5.331 -1.676 1082 HE1 PHE 139 HE1 PHE 139 12.198 -1.111 0.186 1083 HE2 PHE 139 HE2 PHE 139 12.806 -5.199 -0.861 1084 HZ PHE 139 HZ PHE 139 13.664 -3.088 0.073 1085 H GLN 140 H GLN 140 6.075 -1.485 -0.396 1086 HA GLN 140 HA GLN 140 3.939 -2.674 -2.039 1087 1HB GLN 140 1HB GLN 140 3.808 -1.363 0.628 1088 2HB GLN 140 2HB GLN 140 2.498 -1.035 -0.498 1089 1HG GLN 140 1HG GLN 140 1.982 -3.374 -0.664 1090 2HG GLN 140 2HG GLN 140 3.387 -3.792 0.315 1091 1HE2 GLN 140 1HE2 GLN 140 0.124 -2.754 0.309 1092 2HE2 GLN 140 2HE2 GLN 140 -0.104 -2.711 2.021 1093 H MET 141 H MET 141 3.626 -1.564 -3.841 1094 HA MET 141 HA MET 141 4.521 1.210 -3.998 1095 1HB MET 141 1HB MET 141 3.535 -0.621 -6.192 1096 2HB MET 141 2HB MET 141 4.278 0.957 -6.412 1097 1HG MET 141 1HG MET 141 5.948 -0.808 -4.843 1098 2HG MET 141 2HG MET 141 5.552 -1.499 -6.415 1099 1HE MET 141 1HE MET 141 6.197 -0.457 -8.708 1100 2HE MET 141 2HE MET 141 6.931 1.134 -8.909 1101 3HE MET 141 3HE MET 141 5.278 0.994 -8.309 1102 H THR 142 H THR 142 3.203 2.920 -4.556 1103 HA THR 142 HA THR 142 0.310 2.387 -4.386 1104 HB THR 142 HB THR 142 0.424 4.993 -3.790 1105 HG1 THR 142 HG1 THR 142 2.271 5.349 -2.492 1106 1HG2 THR 142 1HG2 THR 142 0.954 2.750 -1.862 1107 2HG2 THR 142 2HG2 THR 142 -0.606 3.448 -2.297 1108 3HG2 THR 142 3HG2 THR 142 0.563 4.403 -1.385 1109 H TYR 143 H TYR 143 -0.856 2.797 -6.138 1110 HA TYR 143 HA TYR 143 0.330 4.457 -8.253 1111 1HB TYR 143 1HB TYR 143 -0.229 2.106 -8.837 1112 2HB TYR 143 2HB TYR 143 -1.917 2.443 -8.469 1113 HD1 TYR 143 HD1 TYR 143 0.851 3.173 -10.792 1114 HD2 TYR 143 HD2 TYR 143 -3.308 3.623 -10.016 1115 HE1 TYR 143 HE1 TYR 143 0.509 3.940 -13.103 1116 HE2 TYR 143 HE2 TYR 143 -3.662 4.391 -12.325 1117 HH TYR 143 HH TYR 143 -1.067 5.213 -14.407 1118 H ILE 144 H ILE 144 -0.829 6.107 -9.219 1119 HA ILE 144 HA ILE 144 -3.470 6.749 -8.130 1120 HB ILE 144 HB ILE 144 -1.280 8.817 -8.292 1121 1HG1 ILE 144 1HG1 ILE 144 -1.768 8.657 -5.662 1122 2HG1 ILE 144 2HG1 ILE 144 -2.107 6.984 -6.099 1123 1HG2 ILE 144 1HG2 ILE 144 -4.164 8.850 -7.669 1124 2HG2 ILE 144 2HG2 ILE 144 -3.137 10.098 -8.376 1125 3HG2 ILE 144 3HG2 ILE 144 -3.129 9.833 -6.633 1126 1HD1 ILE 144 1HD1 ILE 144 0.383 8.181 -5.611 1127 2HD1 ILE 144 2HD1 ILE 144 0.332 7.802 -7.332 1128 3HD1 ILE 144 3HD1 ILE 144 0.053 6.533 -6.140 1129 HA PRO 145 HA PRO 145 -3.605 7.332 -12.651 1130 1HB PRO 145 1HB PRO 145 -6.295 7.061 -12.860 1131 2HB PRO 145 2HB PRO 145 -5.198 5.679 -12.755 1132 1HG PRO 145 1HG PRO 145 -6.845 6.958 -10.607 1133 2HG PRO 145 2HG PRO 145 -6.593 5.236 -10.946 1134 1HD PRO 145 1HD PRO 145 -5.263 6.547 -8.985 1135 2HD PRO 145 2HD PRO 145 -4.543 5.201 -9.892 1136 H GLY 146 H GLY 146 -4.291 9.048 -13.948 1137 1HA GLY 146 1HA GLY 146 -6.124 10.954 -13.711 1138 2HA GLY 146 2HA GLY 146 -4.994 11.458 -12.464 1139 H THR 147 H THR 147 -5.821 12.727 -15.029 1140 HA THR 147 HA THR 147 -3.239 12.792 -16.425 1141 HB THR 147 HB THR 147 -5.850 13.985 -17.358 1142 HG1 THR 147 HG1 THR 147 -4.756 11.451 -18.008 1143 1HG2 THR 147 1HG2 THR 147 -4.571 14.823 -18.965 1144 2HG2 THR 147 2HG2 THR 147 -4.402 13.166 -19.547 1145 3HG2 THR 147 3HG2 THR 147 -3.181 13.855 -18.477 1146 H TYR 148 H TYR 148 -2.007 14.196 -15.263 1147 HA TYR 148 HA TYR 148 -2.921 16.981 -15.225 1148 1HB TYR 148 1HB TYR 148 -1.633 15.554 -12.889 1149 2HB TYR 148 2HB TYR 148 -1.950 17.283 -12.966 1150 HD1 TYR 148 HD1 TYR 148 -3.236 14.124 -11.998 1151 HD2 TYR 148 HD2 TYR 148 -4.422 17.986 -13.329 1152 HE1 TYR 148 HE1 TYR 148 -5.483 13.745 -11.075 1153 HE2 TYR 148 HE2 TYR 148 -6.672 17.619 -12.410 1154 HH TYR 148 HH TYR 148 -8.099 15.338 -11.890 1155 H ASN 149 H ASN 149 -0.043 15.236 -14.057 1156 HA ASN 149 HA ASN 149 1.584 16.938 -15.829 1157 1HB ASN 149 1HB ASN 149 2.042 15.956 -13.034 1158 2HB ASN 149 2HB ASN 149 3.421 16.305 -14.071 1159 1HD2 ASN 149 1HD2 ASN 149 2.006 17.574 -11.630 1160 2HD2 ASN 149 2HD2 ASN 149 1.971 19.252 -12.038 1161 H ASN 150 H ASN 150 1.857 13.835 -14.084 1162 HA ASN 150 HA ASN 150 3.284 12.748 -16.412 1163 1HB ASN 150 1HB ASN 150 3.421 12.243 -13.486 1164 2HB ASN 150 2HB ASN 150 3.684 10.861 -14.547 1165 1HD2 ASN 150 1HD2 ASN 150 5.736 10.500 -14.913 1166 2HD2 ASN 150 2HD2 ASN 150 6.976 11.694 -15.070 1167 H GLY 151 H GLY 151 0.851 11.811 -13.981 1168 1HA GLY 151 1HA GLY 151 -1.026 10.498 -14.178 1169 2HA GLY 151 2HA GLY 151 -0.872 10.657 -15.920 1170 H ASN 152 H ASN 152 1.707 9.367 -13.958 1171 HA ASN 152 HA ASN 152 1.011 6.635 -14.153 1172 1HB ASN 152 1HB ASN 152 2.616 5.923 -15.870 1173 2HB ASN 152 2HB ASN 152 1.398 6.999 -16.548 1174 1HD2 ASN 152 1HD2 ASN 152 4.667 6.374 -16.244 1175 2HD2 ASN 152 2HD2 ASN 152 5.278 7.877 -16.836 1176 H VAL 153 H VAL 153 2.070 8.451 -12.219 1177 HA VAL 153 HA VAL 153 4.865 7.760 -11.871 1178 HB VAL 153 HB VAL 153 4.602 9.041 -9.702 1179 1HG1 VAL 153 1HG1 VAL 153 4.931 11.084 -10.750 1180 2HG1 VAL 153 2HG1 VAL 153 3.764 10.732 -12.024 1181 3HG1 VAL 153 3HG1 VAL 153 5.334 9.927 -12.019 1182 1HG2 VAL 153 1HG2 VAL 153 1.936 8.677 -10.085 1183 2HG2 VAL 153 2HG2 VAL 153 2.150 10.324 -10.677 1184 3HG2 VAL 153 3HG2 VAL 153 2.640 9.907 -9.035 1185 H TYR 154 H TYR 154 5.661 6.222 -10.563 1186 HA TYR 154 HA TYR 154 3.734 4.676 -8.958 1187 1HB TYR 154 1HB TYR 154 6.187 3.847 -10.490 1188 2HB TYR 154 2HB TYR 154 5.553 2.849 -9.185 1189 HD1 TYR 154 HD1 TYR 154 3.653 1.472 -9.515 1190 HD2 TYR 154 HD2 TYR 154 4.752 4.307 -12.491 1191 HE1 TYR 154 HE1 TYR 154 2.050 0.448 -11.073 1192 HE2 TYR 154 HE2 TYR 154 3.151 3.292 -14.057 1193 HH TYR 154 HH TYR 154 0.800 1.756 -13.549 1194 H PHE 155 H PHE 155 4.035 4.552 -6.825 1195 HA PHE 155 HA PHE 155 6.502 5.704 -5.721 1196 1HB PHE 155 1HB PHE 155 3.802 6.153 -5.116 1197 2HB PHE 155 2HB PHE 155 4.423 5.215 -3.763 1198 HD1 PHE 155 HD1 PHE 155 5.738 6.218 -2.114 1199 HD2 PHE 155 HD2 PHE 155 5.021 8.268 -5.775 1200 HE1 PHE 155 HE1 PHE 155 6.748 8.253 -1.168 1201 HE2 PHE 155 HE2 PHE 155 6.031 10.305 -4.836 1202 HZ PHE 155 HZ PHE 155 6.896 10.300 -2.530 1203 H ALA 156 H ALA 156 7.321 4.734 -3.693 1204 HA ALA 156 HA ALA 156 6.713 1.892 -3.367 1205 1HB ALA 156 1HB ALA 156 9.272 3.010 -4.359 1206 2HB ALA 156 2HB ALA 156 8.487 1.472 -4.723 1207 3HB ALA 156 3HB ALA 156 9.360 1.679 -3.205 1208 H TRP 157 H TRP 157 6.958 1.145 -1.310 1209 HA TRP 157 HA TRP 157 8.250 2.890 0.661 1210 1HB TRP 157 1HB TRP 157 5.391 2.127 0.546 1211 2HB TRP 157 2HB TRP 157 6.156 2.007 2.127 1212 HD1 TRP 157 HD1 TRP 157 7.973 4.553 2.123 1213 HE1 TRP 157 HE1 TRP 157 6.927 6.904 2.160 1214 HE3 TRP 157 HE3 TRP 157 3.330 3.405 0.315 1215 HZ2 TRP 157 HZ2 TRP 157 4.461 8.113 1.509 1216 HZ3 TRP 157 HZ3 TRP 157 1.686 5.217 0.053 1217 HH2 TRP 157 HH2 TRP 157 2.241 7.521 0.638 1218 H MET 158 H MET 158 8.964 1.825 2.560 1219 HA MET 158 HA MET 158 9.485 -1.016 2.131 1220 1HB MET 158 1HB MET 158 11.167 0.939 2.875 1221 2HB MET 158 2HB MET 158 10.640 0.409 4.466 1222 1HG MET 158 1HG MET 158 11.679 -1.598 4.298 1223 2HG MET 158 2HG MET 158 11.471 -1.686 2.550 1224 1HE MET 158 1HE MET 158 14.314 0.371 5.186 1225 2HE MET 158 2HE MET 158 12.629 0.836 4.947 1226 3HE MET 158 3HE MET 158 13.907 1.660 4.053 1227 H ARG 159 H ARG 159 8.855 -2.623 3.511 1228 HA ARG 159 HA ARG 159 7.306 -1.876 5.886 1229 1HB ARG 159 1HB ARG 159 6.139 -2.777 3.507 1230 2HB ARG 159 2HB ARG 159 6.145 -4.180 4.566 1231 1HG ARG 159 1HG ARG 159 5.262 -2.180 6.223 1232 2HG ARG 159 2HG ARG 159 4.532 -1.759 4.672 1233 1HD ARG 159 1HD ARG 159 4.240 -4.304 6.244 1234 2HD ARG 159 2HD ARG 159 2.982 -3.168 5.763 1235 HE ARG 159 HE ARG 159 4.037 -4.060 3.408 1236 1HH1 ARG 159 1HH1 ARG 159 2.617 -5.593 6.204 1237 2HH1 ARG 159 2HH1 ARG 159 1.990 -6.934 5.305 1238 1HH2 ARG 159 1HH2 ARG 159 3.213 -5.824 2.225 1239 2HH2 ARG 159 2HH2 ARG 159 2.329 -7.065 3.047 1240 H PHE 160 H PHE 160 7.577 -3.198 7.613 1241 HA PHE 160 HA PHE 160 9.310 -5.549 7.219 1242 1HB PHE 160 1HB PHE 160 10.160 -3.497 8.561 1243 2HB PHE 160 2HB PHE 160 9.077 -4.070 9.827 1244 HD1 PHE 160 HD1 PHE 160 12.236 -4.537 8.158 1245 HD2 PHE 160 HD2 PHE 160 9.433 -6.329 10.811 1246 HE1 PHE 160 HE1 PHE 160 13.968 -6.111 8.917 1247 HE2 PHE 160 HE2 PHE 160 11.160 -7.905 11.577 1248 HZ PHE 160 HZ PHE 160 13.431 -7.797 10.630 1249 H GLN 161 H GLN 161 8.377 -7.438 7.593 1250 HA GLN 161 HA GLN 161 5.836 -7.549 8.998 1251 1HB GLN 161 1HB GLN 161 7.401 -9.479 7.316 1252 2HB GLN 161 2HB GLN 161 6.081 -10.051 8.327 1253 1HG GLN 161 1HG GLN 161 4.638 -8.317 7.175 1254 2HG GLN 161 2HG GLN 161 5.960 -8.135 6.023 1255 1HE2 GLN 161 1HE2 GLN 161 3.103 -9.617 6.509 1256 2HE2 GLN 161 2HE2 GLN 161 3.299 -10.999 5.493 1257 H PHE 162 H PHE 162 5.627 -8.094 11.063 1258 HA PHE 162 HA PHE 162 7.885 -9.448 12.385 1259 1HB PHE 162 1HB PHE 162 6.790 -6.990 13.003 1260 2HB PHE 162 2HB PHE 162 6.004 -8.067 14.151 1261 HD1 PHE 162 HD1 PHE 162 7.307 -9.269 15.822 1262 HD2 PHE 162 HD2 PHE 162 9.143 -6.541 13.121 1263 HE1 PHE 162 HE1 PHE 162 9.314 -9.216 17.245 1264 HE2 PHE 162 HE2 PHE 162 11.153 -6.485 14.538 1265 HZ PHE 162 HZ PHE 162 11.240 -7.823 16.603 1266 H LEU 163 H LEU 163 7.477 -11.485 12.898 1267 HA LEU 163 HA LEU 163 4.700 -12.263 13.496 1268 1HB LEU 163 1HB LEU 163 6.941 -14.041 12.536 1269 2HB LEU 163 2HB LEU 163 5.262 -14.497 12.753 1270 HG LEU 163 HG LEU 163 4.877 -12.551 10.987 1271 1HD1 LEU 163 1HD1 LEU 163 7.553 -12.388 11.092 1272 2HD1 LEU 163 2HD1 LEU 163 6.609 -11.995 9.654 1273 3HD1 LEU 163 3HD1 LEU 163 7.375 -13.578 9.802 1274 1HD2 LEU 163 1HD2 LEU 163 5.922 -15.166 9.967 1275 2HD2 LEU 163 2HD2 LEU 163 4.570 -14.200 9.377 1276 3HD2 LEU 163 3HD2 LEU 163 4.424 -15.086 10.894 1277 H GLU 164 H GLU 164 4.736 -11.871 15.698 1278 HA GLU 164 HA GLU 164 6.679 -13.427 17.271 1279 1HB GLU 164 1HB GLU 164 6.214 -10.785 17.469 1280 2HB GLU 164 2HB GLU 164 4.998 -11.372 18.595 1281 1HG GLU 164 1HG GLU 164 6.821 -12.657 19.742 1282 2HG GLU 164 2HG GLU 164 7.970 -11.797 18.716 1283 HE2 GLU 164 HE2 GLU 164 7.979 -9.202 20.932 1284 H HIS 165 H HIS 165 5.996 -14.995 18.613 1285 HA HIS 165 HA HIS 165 3.340 -15.126 19.652 1286 1HB HIS 165 1HB HIS 165 3.384 -16.001 17.125 1287 2HB HIS 165 2HB HIS 165 3.908 -17.480 17.923 1288 HD1 HIS 165 HD1 HIS 165 1.285 -15.027 19.147 1289 HD2 HIS 165 HD2 HIS 165 1.621 -18.958 17.843 1290 HE1 HIS 165 HE1 HIS 165 -0.982 -16.053 19.513 1291 HE2 HIS 165 HE2 HIS 165 -0.730 -18.455 18.796 1292 H HIS 166 H HIS 166 4.799 -15.182 21.499 1293 HA HIS 166 HA HIS 166 6.131 -17.764 21.911 1294 1HB HIS 166 1HB HIS 166 6.361 -15.200 23.499 1295 2HB HIS 166 2HB HIS 166 7.288 -16.669 23.782 1296 HD1 HIS 166 HD1 HIS 166 9.603 -16.204 23.055 1297 HD2 HIS 166 HD2 HIS 166 6.809 -14.644 20.404 1298 HE1 HIS 166 HE1 HIS 166 10.943 -15.235 21.160 1299 HE2 HIS 166 HE2 HIS 166 9.234 -14.222 19.610 1300 H HIS 167 H HIS 167 6.110 -18.347 24.401 1301 HA HIS 167 HA HIS 167 4.910 -19.195 26.136 1302 1HB HIS 167 1HB HIS 167 4.214 -16.535 25.992 1303 2HB HIS 167 2HB HIS 167 2.647 -17.337 25.962 1304 HD1 HIS 167 HD1 HIS 167 1.753 -17.190 28.263 1305 HD2 HIS 167 HD2 HIS 167 5.793 -18.162 28.232 1306 HE1 HIS 167 HE1 HIS 167 2.367 -17.591 30.669 1307 HE2 HIS 167 HE2 HIS 167 4.796 -18.258 30.616 1308 H HIS 168 H HIS 168 3.063 -20.484 26.640 1309 HA HIS 168 HA HIS 168 0.940 -20.774 24.721 1310 1HB HIS 168 1HB HIS 168 3.139 -22.819 24.917 1311 2HB HIS 168 2HB HIS 168 1.515 -23.272 24.412 1312 HD1 HIS 168 HD1 HIS 168 4.655 -22.145 23.085 1313 HD2 HIS 168 HD2 HIS 168 0.660 -21.659 22.048 1314 HE1 HIS 168 HE1 HIS 168 4.669 -21.410 20.680 1315 HE2 HIS 168 HE2 HIS 168 2.245 -21.041 20.100 1316 H HIS 169 H HIS 169 1.124 -20.190 27.512 1317 HA HIS 169 HA HIS 169 -0.755 -22.132 28.494 1318 1HB HIS 169 1HB HIS 169 1.489 -23.153 29.005 1319 2HB HIS 169 2HB HIS 169 1.815 -21.771 30.044 1320 HD1 HIS 169 HD1 HIS 169 1.999 -23.946 31.767 1321 HD2 HIS 169 HD2 HIS 169 -1.783 -22.718 30.558 1322 HE1 HIS 169 HE1 HIS 169 0.405 -24.915 33.454 1323 HE2 HIS 169 HE2 HIS 169 -1.867 -24.086 32.751 1324 H HIS 170 H HIS 170 -2.277 -20.968 29.444 1325 HA HIS 170 HA HIS 170 -1.737 -18.273 30.333 1326 1HB HIS 170 1HB HIS 170 -4.172 -19.939 29.907 1327 2HB HIS 170 2HB HIS 170 -4.292 -18.574 31.013 1328 HD1 HIS 170 HD1 HIS 170 -3.034 -19.170 27.464 1329 HD2 HIS 170 HD2 HIS 170 -4.980 -16.294 29.746 1330 HE1 HIS 170 HE1 HIS 170 -3.587 -17.306 25.868 1331 HE2 HIS 170 HE2 HIS 170 -4.834 -15.613 27.256 Start of MODEL 2 1 1H MET 1 1H MET 1 -0.845 -6.129 39.986 2 2H MET 1 2H MET 1 0.062 -5.903 41.425 3 H MET 1 H MET 1 -0.686 -7.360 40.857 4 3H MET 1 3H MET 1 -0.444 -7.478 40.966 5 HA MET 1 HA MET 1 0.882 -7.171 38.910 6 1HB MET 1 1HB MET 1 0.981 -4.595 39.700 7 2HB MET 1 2HB MET 1 2.488 -5.169 40.399 8 1HG MET 1 1HG MET 1 2.692 -6.197 37.920 9 2HG MET 1 2HG MET 1 1.739 -4.751 37.588 10 1HE MET 1 1HE MET 1 6.136 -5.008 38.734 11 2HE MET 1 2HE MET 1 5.126 -6.228 37.960 12 3HE MET 1 3HE MET 1 4.946 -5.899 39.683 13 H ASN 2 H ASN 2 1.646 -9.157 39.401 14 HA ASN 2 HA ASN 2 4.045 -9.371 40.925 15 1HB ASN 2 1HB ASN 2 1.465 -10.182 42.155 16 2HB ASN 2 2HB ASN 2 2.824 -11.285 42.358 17 1HD2 ASN 2 1HD2 ASN 2 4.730 -10.495 43.382 18 2HD2 ASN 2 2HD2 ASN 2 4.639 -9.177 44.496 19 H ALA 3 H ALA 3 4.732 -11.745 41.086 20 HA ALA 3 HA ALA 3 4.692 -12.865 38.504 21 1HB ALA 3 1HB ALA 3 6.506 -13.148 40.196 22 2HB ALA 3 2HB ALA 3 6.002 -14.644 39.410 23 3HB ALA 3 3HB ALA 3 5.459 -14.284 41.048 24 H ASP 4 H ASP 4 2.467 -13.125 41.084 25 HA ASP 4 HA ASP 4 1.447 -15.723 40.420 26 1HB ASP 4 1HB ASP 4 0.280 -13.502 42.112 27 2HB ASP 4 2HB ASP 4 -0.396 -15.123 41.979 28 HD2 ASP 4 HD2 ASP 4 2.952 -14.663 44.064 29 H GLU 5 H GLU 5 0.119 -12.429 40.123 30 HA GLU 5 HA GLU 5 -2.057 -13.218 38.486 31 1HB GLU 5 1HB GLU 5 -1.505 -10.988 39.892 32 2HB GLU 5 2HB GLU 5 -1.053 -10.436 38.286 33 1HG GLU 5 1HG GLU 5 -3.456 -11.608 37.797 34 2HG GLU 5 2HG GLU 5 -3.693 -10.968 39.423 35 HE2 GLU 5 HE2 GLU 5 -4.168 -8.480 36.613 36 H TRP 6 H TRP 6 1.254 -12.412 37.849 37 HA TRP 6 HA TRP 6 1.021 -11.703 35.127 38 1HB TRP 6 1HB TRP 6 3.155 -12.253 37.011 39 2HB TRP 6 2HB TRP 6 3.518 -12.935 35.428 40 HD1 TRP 6 HD1 TRP 6 4.346 -10.006 37.202 41 HE1 TRP 6 HE1 TRP 6 4.691 -7.959 35.679 42 HE3 TRP 6 HE3 TRP 6 2.047 -11.741 32.979 43 HZ2 TRP 6 HZ2 TRP 6 4.069 -7.183 33.037 44 HZ3 TRP 6 HZ3 TRP 6 1.964 -10.284 30.998 45 HH2 TRP 6 HH2 TRP 6 2.955 -8.053 31.028 46 H MET 7 H MET 7 1.149 -14.777 36.777 47 HA MET 7 HA MET 7 1.817 -16.441 34.628 48 1HB MET 7 1HB MET 7 1.359 -16.863 37.245 49 2HB MET 7 2HB MET 7 -0.163 -17.452 36.590 50 1HG MET 7 1HG MET 7 1.409 -18.771 34.963 51 2HG MET 7 2HG MET 7 2.592 -18.516 36.244 52 1HE MET 7 1HE MET 7 3.028 -20.713 37.510 53 2HE MET 7 2HE MET 7 2.553 -21.264 35.904 54 3HE MET 7 3HE MET 7 1.907 -22.062 37.338 55 H THR 8 H THR 8 -1.430 -15.721 35.926 56 HA THR 8 HA THR 8 -2.860 -17.006 33.891 57 HB THR 8 HB THR 8 -3.929 -16.411 35.976 58 HG1 THR 8 HG1 THR 8 -5.075 -14.891 33.876 59 1HG2 THR 8 1HG2 THR 8 -2.760 -14.325 36.468 60 2HG2 THR 8 2HG2 THR 8 -4.511 -14.137 36.565 61 3HG2 THR 8 3HG2 THR 8 -3.635 -13.531 35.159 62 H THR 9 H THR 9 -1.777 -13.650 34.199 63 HA THR 9 HA THR 9 -3.056 -12.678 31.879 64 HB THR 9 HB THR 9 -0.467 -11.582 32.956 65 HG1 THR 9 HG1 THR 9 -1.532 -10.683 34.617 66 1HG2 THR 9 1HG2 THR 9 -2.847 -10.399 31.584 67 2HG2 THR 9 2HG2 THR 9 -1.141 -10.284 31.151 68 3HG2 THR 9 3HG2 THR 9 -1.755 -9.415 32.558 69 H PHE 10 H PHE 10 0.278 -13.794 32.428 70 HA PHE 10 HA PHE 10 1.184 -13.425 29.797 71 1HB PHE 10 1HB PHE 10 2.552 -13.897 31.915 72 2HB PHE 10 2HB PHE 10 2.186 -15.596 31.631 73 HD1 PHE 10 HD1 PHE 10 2.741 -16.467 29.225 74 HD2 PHE 10 HD2 PHE 10 4.453 -12.993 30.990 75 HE1 PHE 10 HE1 PHE 10 4.641 -16.617 27.669 76 HE2 PHE 10 HE2 PHE 10 6.355 -13.136 29.436 77 HZ PHE 10 HZ PHE 10 6.451 -14.950 27.772 78 H ARG 11 H ARG 11 -0.591 -16.029 31.312 79 HA ARG 11 HA ARG 11 -0.192 -18.020 29.373 80 1HB ARG 11 1HB ARG 11 -1.224 -18.296 31.669 81 2HB ARG 11 2HB ARG 11 -2.707 -17.635 30.996 82 1HG ARG 11 1HG ARG 11 -1.471 -19.923 29.580 83 2HG ARG 11 2HG ARG 11 -2.244 -20.239 31.133 84 1HD ARG 11 1HD ARG 11 -4.310 -19.241 30.330 85 2HD ARG 11 2HD ARG 11 -3.542 -18.848 28.793 86 HE ARG 11 HE ARG 11 -3.435 -21.643 29.418 87 1HH1 ARG 11 1HH1 ARG 11 -5.413 -19.115 28.048 88 2HH1 ARG 11 2HH1 ARG 11 -6.342 -20.200 27.069 89 1HH2 ARG 11 1HH2 ARG 11 -4.655 -23.071 28.131 90 2HH2 ARG 11 2HH2 ARG 11 -5.912 -22.446 27.117 91 H GLU 12 H GLU 12 -2.341 -15.267 29.486 92 HA GLU 12 HA GLU 12 -4.005 -16.108 27.318 93 1HB GLU 12 1HB GLU 12 -4.769 -14.507 29.033 94 2HB GLU 12 2HB GLU 12 -3.580 -13.343 28.466 95 1HG GLU 12 1HG GLU 12 -5.524 -14.433 26.505 96 2HG GLU 12 2HG GLU 12 -6.092 -13.254 27.688 97 HE2 GLU 12 HE2 GLU 12 -4.049 -11.981 24.633 98 H ASN 13 H ASN 13 -1.043 -14.279 27.626 99 HA ASN 13 HA ASN 13 -1.049 -13.148 25.025 100 1HB ASN 13 1HB ASN 13 0.451 -12.732 27.229 101 2HB ASN 13 2HB ASN 13 1.559 -13.740 26.302 102 1HD2 ASN 13 1HD2 ASN 13 -0.690 -11.065 25.660 103 2HD2 ASN 13 2HD2 ASN 13 0.418 -10.141 24.710 104 H ILE 14 H ILE 14 0.680 -15.955 26.380 105 HA ILE 14 HA ILE 14 1.865 -16.794 23.985 106 HB ILE 14 HB ILE 14 2.565 -17.622 26.191 107 1HG1 ILE 14 1HG1 ILE 14 1.745 -20.131 24.841 108 2HG1 ILE 14 2HG1 ILE 14 2.623 -18.968 23.850 109 1HG2 ILE 14 1HG2 ILE 14 0.199 -17.859 27.044 110 2HG2 ILE 14 2HG2 ILE 14 1.308 -19.163 27.465 111 3HG2 ILE 14 3HG2 ILE 14 0.132 -19.388 26.169 112 1HD1 ILE 14 1HD1 ILE 14 3.578 -20.073 26.481 113 2HD1 ILE 14 2HD1 ILE 14 4.466 -18.988 25.411 114 3HD1 ILE 14 3HD1 ILE 14 4.092 -20.630 24.889 115 H ALA 15 H ALA 15 -1.210 -17.724 25.491 116 HA ALA 15 HA ALA 15 -1.956 -19.700 23.657 117 1HB ALA 15 1HB ALA 15 -4.353 -18.777 24.411 118 2HB ALA 15 2HB ALA 15 -3.353 -18.037 25.661 119 3HB ALA 15 3HB ALA 15 -3.342 -19.787 25.445 120 H GLN 16 H GLN 16 -2.285 -16.204 23.555 121 HA GLN 16 HA GLN 16 -4.045 -16.083 21.341 122 1HB GLN 16 1HB GLN 16 -3.154 -14.255 23.099 123 2HB GLN 16 2HB GLN 16 -2.095 -13.883 21.746 124 1HG GLN 16 1HG GLN 16 -3.781 -12.520 21.167 125 2HG GLN 16 2HG GLN 16 -4.439 -13.993 20.456 126 1HE2 GLN 16 1HE2 GLN 16 -5.243 -15.313 22.755 127 2HE2 GLN 16 2HE2 GLN 16 -6.552 -14.443 23.473 128 H THR 17 H THR 17 -0.514 -15.643 21.561 129 HA THR 17 HA THR 17 -0.080 -15.367 18.797 130 HB THR 17 HB THR 17 2.292 -16.310 19.584 131 HG1 THR 17 HG1 THR 17 2.602 -16.048 21.745 132 1HG2 THR 17 1HG2 THR 17 1.085 -13.633 20.129 133 2HG2 THR 17 2HG2 THR 17 2.272 -14.098 18.910 134 3HG2 THR 17 3HG2 THR 17 2.743 -13.998 20.606 135 H TRP 18 H TRP 18 -0.381 -18.172 20.860 136 HA TRP 18 HA TRP 18 0.706 -20.090 19.104 137 1HB TRP 18 1HB TRP 18 -0.225 -20.146 21.665 138 2HB TRP 18 2HB TRP 18 -1.519 -20.985 20.818 139 HD1 TRP 18 HD1 TRP 18 2.343 -21.217 20.418 140 HE1 TRP 18 HE1 TRP 18 2.998 -23.703 20.552 141 HE3 TRP 18 HE3 TRP 18 -2.279 -23.228 21.267 142 HZ2 TRP 18 HZ2 TRP 18 1.722 -26.187 20.962 143 HZ3 TRP 18 HZ3 TRP 18 -2.476 -25.669 21.518 144 HH2 TRP 18 HH2 TRP 18 -0.515 -27.117 21.368 145 H GLN 19 H GLN 19 -2.645 -19.031 19.640 146 HA GLN 19 HA GLN 19 -3.650 -20.687 17.510 147 1HB GLN 19 1HB GLN 19 -4.831 -18.721 19.426 148 2HB GLN 19 2HB GLN 19 -5.740 -19.142 17.981 149 1HG GLN 19 1HG GLN 19 -4.985 -21.593 18.930 150 2HG GLN 19 2HG GLN 19 -5.258 -20.676 20.411 151 1HE2 GLN 19 1HE2 GLN 19 -7.276 -20.414 21.096 152 2HE2 GLN 19 2HE2 GLN 19 -8.698 -20.807 20.198 153 H GLN 20 H GLN 20 -4.119 -17.190 17.956 154 HA GLN 20 HA GLN 20 -4.282 -16.775 15.124 155 1HB GLN 20 1HB GLN 20 -4.552 -15.089 17.561 156 2HB GLN 20 2HB GLN 20 -4.174 -14.273 16.049 157 1HG GLN 20 1HG GLN 20 -6.241 -14.530 15.262 158 2HG GLN 20 2HG GLN 20 -6.339 -16.205 15.803 159 1HE2 GLN 20 1HE2 GLN 20 -6.862 -12.873 16.667 160 2HE2 GLN 20 2HE2 GLN 20 -7.854 -13.177 18.047 161 HA PRO 21 HA PRO 21 -0.045 -15.933 14.238 162 1HB PRO 21 1HB PRO 21 -0.293 -14.131 12.215 163 2HB PRO 21 2HB PRO 21 -0.612 -15.858 12.015 164 1HG PRO 21 1HG PRO 21 -2.543 -13.611 12.440 165 2HG PRO 21 2HG PRO 21 -2.657 -14.991 11.332 166 1HD PRO 21 1HD PRO 21 -3.975 -14.912 13.693 167 2HD PRO 21 2HD PRO 21 -3.369 -16.426 12.991 168 H GLU 22 H GLU 22 -2.066 -12.993 14.268 169 HA GLU 22 HA GLU 22 -1.727 -10.914 15.125 170 1HB GLU 22 1HB GLU 22 -0.235 -12.687 17.005 171 2HB GLU 22 2HB GLU 22 -0.027 -10.948 17.158 172 1HG GLU 22 1HG GLU 22 -2.778 -11.333 16.944 173 2HG GLU 22 2HG GLU 22 -2.209 -12.619 18.006 174 HE2 GLU 22 HE2 GLU 22 -1.806 -10.424 20.597 175 H HIS 23 H HIS 23 -0.103 -11.753 12.901 176 HA HIS 23 HA HIS 23 2.591 -10.995 13.183 177 1HB HIS 23 1HB HIS 23 0.742 -11.157 10.813 178 2HB HIS 23 2HB HIS 23 2.408 -10.617 10.644 179 HD1 HIS 23 HD1 HIS 23 2.905 -12.714 9.171 180 HD2 HIS 23 HD2 HIS 23 1.775 -13.569 13.076 181 HE1 HIS 23 HE1 HIS 23 3.494 -15.133 9.526 182 HE2 HIS 23 HE2 HIS 23 2.718 -15.652 11.866 183 H TYR 24 H TYR 24 3.539 -9.070 13.353 184 HA TYR 24 HA TYR 24 1.877 -6.678 13.159 185 1HB TYR 24 1HB TYR 24 3.842 -7.466 14.952 186 2HB TYR 24 2HB TYR 24 4.650 -6.258 13.961 187 HD1 TYR 24 HD1 TYR 24 4.701 -4.206 15.002 188 HD2 TYR 24 HD2 TYR 24 1.198 -6.594 15.368 189 HE1 TYR 24 HE1 TYR 24 3.624 -2.418 16.302 190 HE2 TYR 24 HE2 TYR 24 0.112 -4.810 16.668 191 HH TYR 24 HH TYR 24 0.274 -2.438 17.036 192 H ASP 25 H ASP 25 1.785 -5.723 11.240 193 HA ASP 25 HA ASP 25 4.054 -5.903 9.411 194 1HB ASP 25 1HB ASP 25 1.169 -5.126 9.101 195 2HB ASP 25 2HB ASP 25 2.347 -4.678 7.872 196 HD2 ASP 25 HD2 ASP 25 2.075 -7.784 6.491 197 H LEU 26 H LEU 26 5.518 -4.347 9.337 198 HA LEU 26 HA LEU 26 4.757 -1.648 10.235 199 1HB LEU 26 1HB LEU 26 6.684 -3.169 11.300 200 2HB LEU 26 2HB LEU 26 7.614 -2.421 10.014 201 HG LEU 26 HG LEU 26 5.997 -0.651 11.784 202 1HD1 LEU 26 1HD1 LEU 26 8.141 -0.551 13.228 203 2HD1 LEU 26 2HD1 LEU 26 8.437 -2.172 12.600 204 3HD1 LEU 26 3HD1 LEU 26 6.968 -1.837 13.517 205 1HD2 LEU 26 1HD2 LEU 26 7.885 0.857 11.389 206 2HD2 LEU 26 2HD2 LEU 26 7.184 0.282 9.876 207 3HD2 LEU 26 3HD2 LEU 26 8.698 -0.405 10.465 208 H TYR 27 H TYR 27 5.251 0.124 8.991 209 HA TYR 27 HA TYR 27 6.320 -0.440 6.302 210 1HB TYR 27 1HB TYR 27 4.069 1.371 7.160 211 2HB TYR 27 2HB TYR 27 4.878 1.564 5.607 212 HD1 TYR 27 HD1 TYR 27 3.483 -1.282 7.602 213 HD2 TYR 27 HD2 TYR 27 3.738 0.663 3.827 214 HE1 TYR 27 HE1 TYR 27 2.006 -2.991 6.628 215 HE2 TYR 27 HE2 TYR 27 2.262 -1.039 2.843 216 HH TYR 27 HH TYR 27 1.540 -3.312 3.256 217 H ILE 28 H ILE 28 7.940 0.814 5.569 218 HA ILE 28 HA ILE 28 8.566 3.310 6.964 219 HB ILE 28 HB ILE 28 10.976 2.712 7.036 220 1HG1 ILE 28 1HG1 ILE 28 10.357 -0.180 6.885 221 2HG1 ILE 28 2HG1 ILE 28 10.350 0.688 5.354 222 1HG2 ILE 28 1HG2 ILE 28 10.845 1.686 9.107 223 2HG2 ILE 28 2HG2 ILE 28 9.485 0.670 8.631 224 3HG2 ILE 28 3HG2 ILE 28 9.237 2.390 8.931 225 1HD1 ILE 28 1HD1 ILE 28 12.643 1.569 6.068 226 2HD1 ILE 28 2HD1 ILE 28 12.520 -0.113 5.552 227 3HD1 ILE 28 3HD1 ILE 28 12.609 0.279 7.269 228 HA PRO 29 HA PRO 29 9.426 4.791 2.899 229 1HB PRO 29 1HB PRO 29 11.275 6.711 3.403 230 2HB PRO 29 2HB PRO 29 9.566 6.896 3.814 231 1HG PRO 29 1HG PRO 29 11.863 6.116 5.570 232 2HG PRO 29 2HG PRO 29 10.529 7.236 5.904 233 1HD PRO 29 1HD PRO 29 10.564 4.695 6.836 234 2HD PRO 29 2HD PRO 29 9.059 5.534 6.410 235 H ALA 30 H ALA 30 11.586 5.632 1.649 236 HA ALA 30 HA ALA 30 13.783 3.763 2.113 237 1HB ALA 30 1HB ALA 30 12.248 2.599 0.593 238 2HB ALA 30 2HB ALA 30 13.783 2.979 -0.187 239 3HB ALA 30 3HB ALA 30 12.353 3.949 -0.537 240 H ILE 31 H ILE 31 15.527 4.188 0.318 241 HA ILE 31 HA ILE 31 15.671 7.067 -0.258 242 HB ILE 31 HB ILE 31 18.138 6.937 0.307 243 1HG1 ILE 31 1HG1 ILE 31 17.570 4.746 2.213 244 2HG1 ILE 31 2HG1 ILE 31 17.722 4.267 0.525 245 1HG2 ILE 31 1HG2 ILE 31 16.046 7.735 1.770 246 2HG2 ILE 31 2HG2 ILE 31 17.710 7.828 2.343 247 3HG2 ILE 31 3HG2 ILE 31 16.682 6.484 2.838 248 1HD1 ILE 31 1HD1 ILE 31 19.889 4.087 1.096 249 2HD1 ILE 31 2HD1 ILE 31 19.756 5.258 2.408 250 3HD1 ILE 31 3HD1 ILE 31 19.891 5.815 0.740 251 H THR 32 H THR 32 16.067 7.411 -2.336 252 HA THR 32 HA THR 32 17.662 5.430 -3.820 253 HB THR 32 HB THR 32 16.165 6.204 -5.815 254 HG1 THR 32 HG1 THR 32 14.482 7.327 -5.309 255 1HG2 THR 32 1HG2 THR 32 15.400 4.141 -5.684 256 2HG2 THR 32 2HG2 THR 32 14.321 4.606 -4.368 257 3HG2 THR 32 3HG2 THR 32 15.955 4.045 -4.013 258 H TRP 33 H TRP 33 16.488 8.777 -3.728 259 HA TRP 33 HA TRP 33 18.137 9.817 -5.732 260 1HB TRP 33 1HB TRP 33 16.214 10.828 -4.018 261 2HB TRP 33 2HB TRP 33 17.678 11.669 -3.517 262 HD1 TRP 33 HD1 TRP 33 17.986 13.884 -4.738 263 HE1 TRP 33 HE1 TRP 33 17.365 14.830 -7.050 264 HE3 TRP 33 HE3 TRP 33 15.738 9.747 -6.733 265 HZ2 TRP 33 HZ2 TRP 33 16.092 13.941 -9.407 266 HZ3 TRP 33 HZ3 TRP 33 14.844 9.878 -9.022 267 HH2 TRP 33 HH2 TRP 33 15.018 11.932 -10.329 268 H HIS 34 H HIS 34 18.670 9.586 -2.228 269 HA HIS 34 HA HIS 34 21.486 10.312 -2.669 270 1HB HIS 34 1HB HIS 34 19.683 11.310 -0.835 271 2HB HIS 34 2HB HIS 34 20.590 10.137 0.114 272 HD1 HIS 34 HD1 HIS 34 20.812 13.495 -1.367 273 HD2 HIS 34 HD2 HIS 34 23.413 10.695 0.263 274 HE1 HIS 34 HE1 HIS 34 22.943 14.747 -0.903 275 HE2 HIS 34 HE2 HIS 34 24.472 13.052 0.164 276 H ALA 35 H ALA 35 23.032 8.833 -2.406 277 HA ALA 35 HA ALA 35 22.292 6.271 -1.151 278 1HB ALA 35 1HB ALA 35 24.318 5.467 -2.607 279 2HB ALA 35 2HB ALA 35 23.940 6.909 -3.550 280 3HB ALA 35 3HB ALA 35 22.718 5.659 -3.321 281 H ARG 36 H ARG 36 23.097 6.226 0.849 282 HA ARG 36 HA ARG 36 25.926 6.950 1.209 283 1HB ARG 36 1HB ARG 36 23.711 7.484 3.196 284 2HB ARG 36 2HB ARG 36 25.414 7.861 3.415 285 1HG ARG 36 1HG ARG 36 25.185 9.330 1.348 286 2HG ARG 36 2HG ARG 36 23.443 9.144 1.558 287 1HD ARG 36 1HD ARG 36 25.089 9.967 3.899 288 2HD ARG 36 2HD ARG 36 24.745 11.159 2.646 289 HE ARG 36 HE ARG 36 22.316 10.057 3.226 290 1HH1 ARG 36 1HH1 ARG 36 24.807 11.634 5.094 291 2HH1 ARG 36 2HH1 ARG 36 23.700 12.281 6.258 292 1HH2 ARG 36 1HH2 ARG 36 20.859 10.906 4.757 293 2HH2 ARG 36 2HH2 ARG 36 21.458 11.867 6.067 294 H PHE 37 H PHE 37 23.167 5.148 2.525 295 HA PHE 37 HA PHE 37 23.019 3.138 3.577 296 1HB PHE 37 1HB PHE 37 24.934 2.806 1.577 297 2HB PHE 37 2HB PHE 37 25.686 2.125 3.014 298 HD1 PHE 37 HD1 PHE 37 25.288 -0.082 3.507 299 HD2 PHE 37 HD2 PHE 37 22.427 2.067 1.203 300 HE1 PHE 37 HE1 PHE 37 23.981 -2.146 3.212 301 HE2 PHE 37 HE2 PHE 37 21.114 0.008 0.904 302 HZ PHE 37 HZ PHE 37 21.891 -2.103 1.910 303 H ALA 38 H ALA 38 23.643 2.042 5.492 304 HA ALA 38 HA ALA 38 24.920 3.713 7.408 305 1HB ALA 38 1HB ALA 38 24.065 2.312 8.964 306 2HB ALA 38 2HB ALA 38 24.513 0.862 8.065 307 3HB ALA 38 3HB ALA 38 23.077 1.776 7.603 308 H TYR 39 H TYR 39 26.981 3.793 8.036 309 HA TYR 39 HA TYR 39 28.774 1.597 7.233 310 1HB TYR 39 1HB TYR 39 30.548 3.271 6.872 311 2HB TYR 39 2HB TYR 39 29.174 3.535 5.804 312 HD1 TYR 39 HD1 TYR 39 27.482 5.332 6.471 313 HD2 TYR 39 HD2 TYR 39 31.327 4.989 8.258 314 HE1 TYR 39 HE1 TYR 39 27.323 7.660 7.249 315 HE2 TYR 39 HE2 TYR 39 31.179 7.315 9.042 316 HH TYR 39 HH TYR 39 29.524 8.997 9.512 317 H ASP 40 H ASP 40 29.170 0.555 9.091 318 HA ASP 40 HA ASP 40 30.077 2.164 11.388 319 1HB ASP 40 1HB ASP 40 28.156 -0.101 11.248 320 2HB ASP 40 2HB ASP 40 29.246 -0.059 12.631 321 HD2 ASP 40 HD2 ASP 40 27.703 2.805 13.907 322 H LYS 41 H LYS 41 31.643 1.130 12.783 323 HA LYS 41 HA LYS 41 33.003 -1.226 11.782 324 1HB LYS 41 1HB LYS 41 33.874 1.119 10.765 325 2HB LYS 41 2HB LYS 41 34.835 1.057 12.236 326 1HG LYS 41 1HG LYS 41 34.767 -1.408 10.615 327 2HG LYS 41 2HG LYS 41 35.612 -0.025 9.918 328 1HD LYS 41 1HD LYS 41 36.801 0.154 12.177 329 2HD LYS 41 2HD LYS 41 36.177 -1.467 12.492 330 1HE LYS 41 1HE LYS 41 38.063 -0.587 10.321 331 2HE LYS 41 2HE LYS 41 38.358 -1.748 11.616 332 1HZ LYS 41 1HZ LYS 41 36.526 -2.099 9.305 333 2HZ LYS 41 2HZ LYS 41 36.661 -3.190 10.591 334 3HZ LYS 41 3HZ LYS 41 37.985 -2.914 9.573 335 H GLU 42 H GLU 42 33.130 1.488 14.071 336 HA GLU 42 HA GLU 42 33.920 -0.435 16.161 337 1HB GLU 42 1HB GLU 42 35.532 1.541 15.307 338 2HB GLU 42 2HB GLU 42 34.617 2.425 16.522 339 1HG GLU 42 1HG GLU 42 35.282 0.875 18.230 340 2HG GLU 42 2HG GLU 42 36.074 -0.156 17.038 341 HE2 GLU 42 HE2 GLU 42 37.891 3.291 17.848 342 H LYS 43 H LYS 43 33.274 0.218 18.366 343 HA LYS 43 HA LYS 43 30.791 1.805 18.362 344 1HB LYS 43 1HB LYS 43 30.817 -0.881 18.666 345 2HB LYS 43 2HB LYS 43 31.025 -0.385 20.340 346 1HG LYS 43 1HG LYS 43 28.830 0.703 18.606 347 2HG LYS 43 2HG LYS 43 28.655 -0.780 19.544 348 1HD LYS 43 1HD LYS 43 29.575 1.761 20.840 349 2HD LYS 43 2HD LYS 43 27.857 1.449 20.579 350 1HE LYS 43 1HE LYS 43 27.975 0.456 22.592 351 2HE LYS 43 2HE LYS 43 28.639 -0.898 21.678 352 1HZ LYS 43 1HZ LYS 43 30.841 0.522 22.120 353 2HZ LYS 43 2HZ LYS 43 30.296 -0.690 23.165 354 3HZ LYS 43 3HZ LYS 43 29.959 0.931 23.506 355 H THR 44 H THR 44 31.104 3.581 19.518 356 HA THR 44 HA THR 44 32.339 3.360 22.155 357 HB THR 44 HB THR 44 33.466 5.674 21.483 358 HG1 THR 44 HG1 THR 44 33.282 5.992 19.427 359 1HG2 THR 44 1HG2 THR 44 35.171 4.392 22.090 360 2HG2 THR 44 2HG2 THR 44 35.331 3.989 20.380 361 3HG2 THR 44 3HG2 THR 44 34.411 2.934 21.453 362 H ASP 45 H ASP 45 31.014 5.767 19.877 363 HA ASP 45 HA ASP 45 29.455 6.888 22.107 364 1HB ASP 45 1HB ASP 45 30.745 8.083 19.709 365 2HB ASP 45 2HB ASP 45 29.219 8.789 20.232 366 HD2 ASP 45 HD2 ASP 45 32.448 9.599 22.258 367 H ARG 46 H ARG 46 29.277 5.739 18.785 368 HA ARG 46 HA ARG 46 27.537 5.055 17.490 369 1HB ARG 46 1HB ARG 46 27.079 3.955 19.905 370 2HB ARG 46 2HB ARG 46 25.628 4.937 19.755 371 1HG ARG 46 1HG ARG 46 24.919 2.968 18.834 372 2HG ARG 46 2HG ARG 46 25.477 3.823 17.395 373 1HD ARG 46 1HD ARG 46 27.187 2.399 17.057 374 2HD ARG 46 2HD ARG 46 27.541 2.260 18.778 375 HE ARG 46 HE ARG 46 26.285 0.357 18.833 376 1HH1 ARG 46 1HH1 ARG 46 25.430 2.160 15.970 377 2HH1 ARG 46 2HH1 ARG 46 24.402 0.916 15.342 378 1HH2 ARG 46 1HH2 ARG 46 24.934 -1.280 18.008 379 2HH2 ARG 46 2HH2 ARG 46 24.120 -1.037 16.499 380 H TYR 47 H TYR 47 25.483 5.721 16.580 381 HA TYR 47 HA TYR 47 24.989 8.562 17.070 382 1HB TYR 47 1HB TYR 47 24.437 6.722 14.758 383 2HB TYR 47 2HB TYR 47 23.612 8.271 14.892 384 HD1 TYR 47 HD1 TYR 47 24.512 9.819 13.443 385 HD2 TYR 47 HD2 TYR 47 27.137 7.149 15.464 386 HE1 TYR 47 HE1 TYR 47 26.440 10.938 12.404 387 HE2 TYR 47 HE2 TYR 47 29.072 8.261 14.431 388 HH TYR 47 HH TYR 47 29.126 9.901 11.915 389 H ASN 48 H ASN 48 23.002 9.387 17.603 390 HA ASN 48 HA ASN 48 21.247 7.716 19.067 391 1HB ASN 48 1HB ASN 48 21.330 10.590 18.307 392 2HB ASN 48 2HB ASN 48 19.769 9.933 18.791 393 1HD2 ASN 48 1HD2 ASN 48 22.948 10.807 19.805 394 2HD2 ASN 48 2HD2 ASN 48 22.692 10.604 21.501 395 H GLU 49 H GLU 49 19.644 6.476 18.373 396 HA GLU 49 HA GLU 49 18.749 6.709 15.611 397 1HB GLU 49 1HB GLU 49 19.330 4.532 17.090 398 2HB GLU 49 2HB GLU 49 17.600 4.632 17.385 399 1HG GLU 49 1HG GLU 49 17.068 4.027 15.286 400 2HG GLU 49 2HG GLU 49 18.427 4.896 14.576 401 HE2 GLU 49 HE2 GLU 49 19.066 1.163 15.791 402 H ARG 50 H ARG 50 17.008 7.844 15.101 403 HA ARG 50 HA ARG 50 14.590 7.674 16.631 404 1HB ARG 50 1HB ARG 50 16.031 9.423 17.814 405 2HB ARG 50 2HB ARG 50 15.795 10.424 16.388 406 1HG ARG 50 1HG ARG 50 14.198 11.090 18.015 407 2HG ARG 50 2HG ARG 50 13.333 10.219 16.746 408 1HD ARG 50 1HD ARG 50 12.423 9.089 18.460 409 2HD ARG 50 2HD ARG 50 13.943 8.196 18.446 410 HE ARG 50 HE ARG 50 14.014 10.556 20.081 411 1HH1 ARG 50 1HH1 ARG 50 13.168 7.172 19.991 412 2HH1 ARG 50 2HH1 ARG 50 13.323 6.958 21.702 413 1HH2 ARG 50 1HH2 ARG 50 14.218 10.278 22.333 414 2HH2 ARG 50 2HH2 ARG 50 13.918 8.722 23.032 415 HA PRO 51 HA PRO 51 13.834 8.282 12.158 416 1HB PRO 51 1HB PRO 51 11.442 6.978 12.160 417 2HB PRO 51 2HB PRO 51 12.997 6.150 12.022 418 1HG PRO 51 1HG PRO 51 11.260 6.528 14.430 419 2HG PRO 51 2HG PRO 51 12.138 5.082 13.899 420 1HD PRO 51 1HD PRO 51 13.065 6.695 15.856 421 2HD PRO 51 2HD PRO 51 14.150 5.840 14.740 422 H TRP 52 H TRP 52 11.782 9.095 11.027 423 HA TRP 52 HA TRP 52 10.522 11.145 12.729 424 1HB TRP 52 1HB TRP 52 10.219 12.388 10.522 425 2HB TRP 52 2HB TRP 52 11.864 12.275 11.141 426 HD1 TRP 52 HD1 TRP 52 9.824 9.811 8.925 427 HE1 TRP 52 HE1 TRP 52 11.247 9.259 6.854 428 HE3 TRP 52 HE3 TRP 52 13.862 12.795 9.895 429 HZ2 TRP 52 HZ2 TRP 52 13.750 9.992 5.772 430 HZ3 TRP 52 HZ3 TRP 52 15.728 12.811 8.291 431 HH2 TRP 52 HH2 TRP 52 15.673 11.437 6.273 432 H GLY 53 H GLY 53 9.435 8.571 12.592 433 1HA GLY 53 1HA GLY 53 6.851 8.666 12.489 434 2HA GLY 53 2HA GLY 53 7.144 8.852 10.766 435 H GLY 54 H GLY 54 5.618 6.822 11.235 436 1HA GLY 54 1HA GLY 54 6.884 4.593 10.211 437 2HA GLY 54 2HA GLY 54 6.932 4.397 11.956 438 H GLY 55 H GLY 55 5.514 2.856 9.859 439 1HA GLY 55 1HA GLY 55 2.743 3.280 10.798 440 2HA GLY 55 2HA GLY 55 3.157 2.603 9.229 441 H PHE 56 H PHE 56 1.534 1.562 11.517 442 HA PHE 56 HA PHE 56 2.652 -1.113 11.488 443 1HB PHE 56 1HB PHE 56 2.556 -1.392 13.920 444 2HB PHE 56 2HB PHE 56 3.690 -0.119 13.483 445 HD1 PHE 56 HD1 PHE 56 2.611 2.303 13.413 446 HD2 PHE 56 HD2 PHE 56 1.094 -0.992 15.638 447 HE1 PHE 56 HE1 PHE 56 1.441 3.861 14.916 448 HE2 PHE 56 HE2 PHE 56 -0.079 0.560 17.144 449 HZ PHE 56 HZ PHE 56 0.093 2.990 16.784 450 H GLY 57 H GLY 57 1.130 -2.744 12.059 451 1HA GLY 57 1HA GLY 57 -1.472 -2.273 12.983 452 2HA GLY 57 2HA GLY 57 -1.506 -2.206 11.228 453 H LEU 58 H LEU 58 -2.977 -4.056 11.495 454 HA LEU 58 HA LEU 58 -1.438 -6.557 11.585 455 1HB LEU 58 1HB LEU 58 -3.583 -5.748 13.348 456 2HB LEU 58 2HB LEU 58 -4.018 -7.201 12.468 457 HG LEU 58 HG LEU 58 -2.971 -7.647 14.674 458 1HD1 LEU 58 1HD1 LEU 58 -2.877 -9.395 13.078 459 2HD1 LEU 58 2HD1 LEU 58 -1.270 -9.277 13.796 460 3HD1 LEU 58 3HD1 LEU 58 -1.571 -8.609 12.192 461 1HD2 LEU 58 1HD2 LEU 58 -0.312 -6.919 13.570 462 2HD2 LEU 58 2HD2 LEU 58 -0.864 -6.987 15.243 463 3HD2 LEU 58 3HD2 LEU 58 -1.324 -5.629 14.217 464 H SER 59 H SER 59 -2.880 -8.411 10.687 465 HA SER 59 HA SER 59 -4.506 -7.431 8.445 466 1HB SER 59 1HB SER 59 -3.444 -9.220 7.017 467 2HB SER 59 2HB SER 59 -2.370 -7.891 7.454 468 HG SER 59 HG SER 59 -2.498 -10.430 8.719 469 H ARG 60 H ARG 60 -6.180 -8.775 7.793 470 HA ARG 60 HA ARG 60 -6.774 -10.984 9.644 471 1HB ARG 60 1HB ARG 60 -8.524 -9.057 8.147 472 2HB ARG 60 2HB ARG 60 -9.165 -10.596 8.704 473 1HG ARG 60 1HG ARG 60 -8.701 -10.038 10.985 474 2HG ARG 60 2HG ARG 60 -7.847 -8.573 10.498 475 1HD ARG 60 1HD ARG 60 -9.821 -7.573 10.890 476 2HD ARG 60 2HD ARG 60 -10.245 -8.193 9.296 477 HE ARG 60 HE ARG 60 -10.897 -10.212 11.018 478 1HH1 ARG 60 1HH1 ARG 60 -11.761 -6.843 10.728 479 2HH1 ARG 60 2HH1 ARG 60 -13.336 -7.060 11.414 480 1HH2 ARG 60 1HH2 ARG 60 -12.968 -10.498 11.919 481 2HH2 ARG 60 2HH2 ARG 60 -14.021 -9.135 12.091 482 H TRP 61 H TRP 61 -7.498 -12.958 8.861 483 HA TRP 61 HA TRP 61 -6.846 -13.456 6.046 484 1HB TRP 61 1HB TRP 61 -5.825 -14.764 8.061 485 2HB TRP 61 2HB TRP 61 -7.363 -15.622 8.058 486 HD1 TRP 61 HD1 TRP 61 -5.098 -14.584 5.075 487 HE1 TRP 61 HE1 TRP 61 -4.626 -16.691 3.676 488 HE3 TRP 61 HE3 TRP 61 -7.541 -18.033 7.952 489 HZ2 TRP 61 HZ2 TRP 61 -5.212 -19.452 3.778 490 HZ3 TRP 61 HZ3 TRP 61 -7.538 -20.385 7.231 491 HH2 TRP 61 HH2 TRP 61 -6.397 -21.078 5.186 492 H ASP 62 H ASP 62 -8.563 -13.276 4.755 493 HA ASP 62 HA ASP 62 -11.216 -13.971 5.703 494 1HB ASP 62 1HB ASP 62 -10.275 -12.089 3.920 495 2HB ASP 62 2HB ASP 62 -10.955 -13.320 2.860 496 HD2 ASP 62 HD2 ASP 62 -13.549 -10.962 3.952 497 H GLU 63 H GLU 63 -12.088 -15.908 5.475 498 HA GLU 63 HA GLU 63 -10.783 -18.055 4.208 499 1HB GLU 63 1HB GLU 63 -12.732 -17.888 6.050 500 2HB GLU 63 2HB GLU 63 -13.711 -18.243 4.634 501 1HG GLU 63 1HG GLU 63 -13.296 -20.376 5.111 502 2HG GLU 63 2HG GLU 63 -11.708 -20.078 4.406 503 HE2 GLU 63 HE2 GLU 63 -10.417 -21.096 7.414 504 H LYS 64 H LYS 64 -12.738 -15.584 2.910 505 HA LYS 64 HA LYS 64 -13.574 -17.175 0.616 506 1HB LYS 64 1HB LYS 64 -14.767 -15.096 1.947 507 2HB LYS 64 2HB LYS 64 -14.085 -14.285 0.544 508 1HG LYS 64 1HG LYS 64 -15.488 -15.309 -0.907 509 2HG LYS 64 2HG LYS 64 -15.567 -16.793 0.044 510 1HD LYS 64 1HD LYS 64 -16.776 -15.014 1.713 511 2HD LYS 64 2HD LYS 64 -17.260 -14.395 0.133 512 1HE LYS 64 1HE LYS 64 -18.176 -16.542 -0.476 513 2HE LYS 64 2HE LYS 64 -17.579 -17.260 1.019 514 1HZ LYS 64 1HZ LYS 64 -19.660 -16.815 1.704 515 2HZ LYS 64 2HZ LYS 64 -19.910 -15.589 0.567 516 3HZ LYS 64 3HZ LYS 64 -19.045 -15.263 1.982 517 H GLY 65 H GLY 65 -10.714 -16.505 1.155 518 1HA GLY 65 1HA GLY 65 -8.885 -16.082 -0.175 519 2HA GLY 65 2HA GLY 65 -9.990 -15.869 -1.525 520 H ASN 66 H ASN 66 -9.686 -14.091 1.540 521 HA ASN 66 HA ASN 66 -8.974 -11.695 -0.007 522 1HB ASN 66 1HB ASN 66 -11.452 -12.128 1.258 523 2HB ASN 66 2HB ASN 66 -10.581 -10.996 2.286 524 1HD2 ASN 66 1HD2 ASN 66 -9.661 -9.092 1.214 525 2HD2 ASN 66 2HD2 ASN 66 -10.527 -8.394 -0.107 526 H TRP 67 H TRP 67 -7.601 -10.250 0.995 527 HA TRP 67 HA TRP 67 -6.537 -11.085 3.613 528 1HB TRP 67 1HB TRP 67 -5.162 -11.180 1.228 529 2HB TRP 67 2HB TRP 67 -4.660 -9.629 1.894 530 HD1 TRP 67 HD1 TRP 67 -5.175 -13.093 3.593 531 HE1 TRP 67 HE1 TRP 67 -3.049 -13.626 4.942 532 HE3 TRP 67 HE3 TRP 67 -2.408 -8.955 2.423 533 HZ2 TRP 67 HZ2 TRP 67 -0.532 -12.451 5.444 534 HZ3 TRP 67 HZ3 TRP 67 -0.152 -8.736 3.379 535 HH2 TRP 67 HH2 TRP 67 0.765 -10.448 4.859 536 H HIS 68 H HIS 68 -7.732 -9.604 4.789 537 HA HIS 68 HA HIS 68 -7.968 -6.863 4.104 538 1HB HIS 68 1HB HIS 68 -9.143 -8.532 5.960 539 2HB HIS 68 2HB HIS 68 -8.172 -7.462 6.965 540 HD1 HIS 68 HD1 HIS 68 -8.531 -4.768 5.909 541 HD2 HIS 68 HD2 HIS 68 -11.635 -7.529 5.808 542 HE1 HIS 68 HE1 HIS 68 -10.637 -3.406 5.721 543 HE2 HIS 68 HE2 HIS 68 -12.506 -5.095 5.733 544 H GLY 69 H GLY 69 -6.866 -5.066 4.832 545 1HA GLY 69 1HA GLY 69 -4.468 -5.545 6.473 546 2HA GLY 69 2HA GLY 69 -4.317 -4.710 4.934 547 H LEU 70 H LEU 70 -4.795 -4.349 8.232 548 HA LEU 70 HA LEU 70 -5.640 -1.552 7.849 549 1HB LEU 70 1HB LEU 70 -6.267 -3.295 10.233 550 2HB LEU 70 2HB LEU 70 -6.785 -1.637 9.989 551 HG LEU 70 HG LEU 70 -7.962 -2.571 7.867 552 1HD1 LEU 70 1HD1 LEU 70 -8.766 -4.964 8.462 553 2HD1 LEU 70 2HD1 LEU 70 -7.269 -5.044 9.392 554 3HD1 LEU 70 3HD1 LEU 70 -7.214 -4.744 7.654 555 1HD2 LEU 70 1HD2 LEU 70 -9.256 -3.549 10.356 556 2HD2 LEU 70 2HD2 LEU 70 -9.918 -2.579 9.040 557 3HD2 LEU 70 3HD2 LEU 70 -8.864 -1.834 10.241 558 H TYR 71 H TYR 71 -4.169 -0.119 8.467 559 HA TYR 71 HA TYR 71 -2.548 -0.553 10.819 560 1HB TYR 71 1HB TYR 71 -0.420 -0.056 9.487 561 2HB TYR 71 2HB TYR 71 -1.090 -1.678 9.345 562 HD1 TYR 71 HD1 TYR 71 -0.732 1.574 7.628 563 HD2 TYR 71 HD2 TYR 71 -1.856 -2.512 7.251 564 HE1 TYR 71 HE1 TYR 71 -0.789 1.821 5.183 565 HE2 TYR 71 HE2 TYR 71 -1.916 -2.277 4.805 566 HH TYR 71 HH TYR 71 -2.179 -0.501 3.132 567 H ALA 72 H ALA 72 -1.516 1.345 11.567 568 HA ALA 72 HA ALA 72 -2.446 3.815 10.250 569 1HB ALA 72 1HB ALA 72 -3.651 3.975 12.161 570 2HB ALA 72 2HB ALA 72 -2.138 4.641 12.776 571 3HB ALA 72 3HB ALA 72 -2.543 2.951 13.077 572 H MET 73 H MET 73 -1.100 5.720 10.621 573 HA MET 73 HA MET 73 1.704 5.098 11.239 574 1HB MET 73 1HB MET 73 1.353 5.082 8.773 575 2HB MET 73 2HB MET 73 0.803 6.749 8.871 576 1HG MET 73 1HG MET 73 2.967 7.467 9.643 577 2HG MET 73 2HG MET 73 3.533 5.799 9.703 578 1HE MET 73 1HE MET 73 3.301 4.237 7.524 579 2HE MET 73 2HE MET 73 3.378 4.850 5.872 580 3HE MET 73 3HE MET 73 1.869 4.948 6.779 581 H ALA 74 H ALA 74 3.018 7.079 11.604 582 HA ALA 74 HA ALA 74 1.487 9.436 12.391 583 1HB ALA 74 1HB ALA 74 3.453 8.484 14.396 584 2HB ALA 74 2HB ALA 74 1.906 7.642 14.309 585 3HB ALA 74 3HB ALA 74 1.949 9.378 14.616 586 H PHE 75 H PHE 75 2.592 11.318 12.161 587 HA PHE 75 HA PHE 75 5.369 11.095 11.216 588 1HB PHE 75 1HB PHE 75 3.492 12.080 9.731 589 2HB PHE 75 2HB PHE 75 3.605 13.492 10.777 590 HD1 PHE 75 HD1 PHE 75 4.675 12.163 7.779 591 HD2 PHE 75 HD2 PHE 75 6.163 14.257 11.172 592 HE1 PHE 75 HE1 PHE 75 6.557 13.001 6.432 593 HE2 PHE 75 HE2 PHE 75 8.046 15.099 9.831 594 HZ PHE 75 HZ PHE 75 8.245 14.472 7.458 595 H LYS 76 H LYS 76 6.729 11.470 12.850 596 HA LYS 76 HA LYS 76 6.060 13.381 14.932 597 1HB LYS 76 1HB LYS 76 7.390 11.029 15.018 598 2HB LYS 76 2HB LYS 76 8.746 12.139 14.881 599 1HG LYS 76 1HG LYS 76 6.704 12.862 16.874 600 2HG LYS 76 2HG LYS 76 7.635 11.402 17.214 601 1HD LYS 76 1HD LYS 76 9.703 12.618 17.060 602 2HD LYS 76 2HD LYS 76 8.858 14.069 16.517 603 1HE LYS 76 1HE LYS 76 9.365 14.367 18.824 604 2HE LYS 76 2HE LYS 76 7.633 14.062 18.703 605 1HZ LYS 76 1HZ LYS 76 9.721 12.444 19.910 606 2HZ LYS 76 2HZ LYS 76 8.543 11.589 19.047 607 3HZ LYS 76 3HZ LYS 76 8.089 12.595 20.328 608 H ASP 77 H ASP 77 6.809 15.404 15.066 609 HA ASP 77 HA ASP 77 8.917 16.219 13.172 610 1HB ASP 77 1HB ASP 77 7.860 18.435 13.107 611 2HB ASP 77 2HB ASP 77 6.738 17.181 12.588 612 HD2 ASP 77 HD2 ASP 77 4.924 17.550 15.639 613 H SER 78 H SER 78 9.686 18.584 13.994 614 HA SER 78 HA SER 78 10.850 18.052 16.613 615 1HB SER 78 1HB SER 78 12.031 18.921 14.367 616 2HB SER 78 2HB SER 78 11.613 20.480 15.078 617 HG SER 78 HG SER 78 13.581 19.970 15.898 618 H TRP 79 H TRP 79 8.292 19.835 15.304 619 HA TRP 79 HA TRP 79 8.398 21.925 17.331 620 1HB TRP 79 1HB TRP 79 7.402 21.808 14.723 621 2HB TRP 79 2HB TRP 79 5.968 21.871 15.743 622 HD1 TRP 79 HD1 TRP 79 7.234 24.257 13.803 623 HE1 TRP 79 HE1 TRP 79 7.538 26.577 14.874 624 HE3 TRP 79 HE3 TRP 79 7.202 22.888 18.729 625 HZ2 TRP 79 HZ2 TRP 79 7.736 27.682 17.464 626 HZ3 TRP 79 HZ3 TRP 79 7.455 24.637 20.441 627 HH2 TRP 79 HH2 TRP 79 7.717 26.984 19.820 628 H ASN 80 H ASN 80 7.758 18.912 17.741 629 HA ASN 80 HA ASN 80 6.406 17.645 19.060 630 1HB ASN 80 1HB ASN 80 6.253 20.367 20.288 631 2HB ASN 80 2HB ASN 80 5.188 19.103 20.897 632 1HD2 ASN 80 1HD2 ASN 80 8.481 20.154 20.535 633 2HD2 ASN 80 2HD2 ASN 80 9.171 19.048 21.669 634 H LYS 81 H LYS 81 5.036 17.152 17.246 635 HA LYS 81 HA LYS 81 2.306 17.518 17.768 636 1HB LYS 81 1HB LYS 81 2.713 19.802 16.960 637 2HB LYS 81 2HB LYS 81 3.355 19.159 15.454 638 1HG LYS 81 1HG LYS 81 0.945 17.971 15.471 639 2HG LYS 81 2HG LYS 81 0.568 19.451 16.357 640 1HD LYS 81 1HD LYS 81 1.665 20.727 14.491 641 2HD LYS 81 2HD LYS 81 1.747 19.209 13.594 642 1HE LYS 81 1HE LYS 81 -0.509 19.132 13.248 643 2HE LYS 81 2HE LYS 81 -0.877 20.010 14.733 644 1HZ LYS 81 1HZ LYS 81 -1.383 21.420 12.912 645 2HZ LYS 81 2HZ LYS 81 0.114 21.141 12.176 646 3HZ LYS 81 3HZ LYS 81 0.032 22.026 13.615 647 H TRP 82 H TRP 82 2.503 15.256 17.479 648 HA TRP 82 HA TRP 82 3.308 14.166 14.945 649 1HB TRP 82 1HB TRP 82 2.624 12.007 15.903 650 2HB TRP 82 2HB TRP 82 3.660 12.900 17.012 651 HD1 TRP 82 HD1 TRP 82 -0.009 11.844 16.552 652 HE1 TRP 82 HE1 TRP 82 -1.179 11.961 18.842 653 HE3 TRP 82 HE3 TRP 82 3.756 13.967 19.283 654 HZ2 TRP 82 HZ2 TRP 82 -0.586 12.836 21.459 655 HZ3 TRP 82 HZ3 TRP 82 3.374 14.412 21.673 656 HH2 TRP 82 HH2 TRP 82 1.247 13.857 22.737 657 H GLU 83 H GLU 83 2.086 13.876 13.200 658 HA GLU 83 HA GLU 83 -0.753 14.489 13.355 659 1HB GLU 83 1HB GLU 83 1.145 15.120 11.506 660 2HB GLU 83 2HB GLU 83 0.395 13.720 10.750 661 1HG GLU 83 1HG GLU 83 -0.832 15.470 9.896 662 2HG GLU 83 2HG GLU 83 -1.828 14.935 11.249 663 HE2 GLU 83 HE2 GLU 83 -0.573 18.603 11.230 664 HA PRO 84 HA PRO 84 -1.651 10.103 13.264 665 1HB PRO 84 1HB PRO 84 -4.280 10.259 13.698 666 2HB PRO 84 2HB PRO 84 -3.121 10.664 14.970 667 1HG PRO 84 1HG PRO 84 -4.697 12.480 13.195 668 2HG PRO 84 2HG PRO 84 -4.332 12.641 14.922 669 1HD PRO 84 1HD PRO 84 -2.972 13.934 12.884 670 2HD PRO 84 2HD PRO 84 -2.329 13.650 14.512 671 H ILE 85 H ILE 85 -2.322 8.663 11.734 672 HA ILE 85 HA ILE 85 -4.168 9.427 9.650 673 HB ILE 85 HB ILE 85 -2.059 10.337 8.777 674 1HG1 ILE 85 1HG1 ILE 85 -2.103 9.206 6.593 675 2HG1 ILE 85 2HG1 ILE 85 -2.988 7.860 7.305 676 1HG2 ILE 85 1HG2 ILE 85 -1.045 7.499 8.824 677 2HG2 ILE 85 2HG2 ILE 85 -0.556 8.766 9.950 678 3HG2 ILE 85 3HG2 ILE 85 -0.188 8.922 8.233 679 1HD1 ILE 85 1HD1 ILE 85 -4.088 10.033 6.053 680 2HD1 ILE 85 2HD1 ILE 85 -4.272 10.427 7.763 681 3HD1 ILE 85 3HD1 ILE 85 -4.934 8.920 7.129 682 H ALA 86 H ALA 86 -5.387 7.717 9.211 683 HA ALA 86 HA ALA 86 -4.302 5.039 9.788 684 1HB ALA 86 1HB ALA 86 -6.152 5.611 11.237 685 2HB ALA 86 2HB ALA 86 -6.642 4.337 10.120 686 3HB ALA 86 3HB ALA 86 -7.159 5.999 9.842 687 H GLY 87 H GLY 87 -5.032 3.274 8.425 688 1HA GLY 87 1HA GLY 87 -6.225 3.922 5.867 689 2HA GLY 87 2HA GLY 87 -4.526 3.478 5.787 690 H TYR 88 H TYR 88 -7.239 2.219 4.981 691 HA TYR 88 HA TYR 88 -6.442 -0.487 5.710 692 1HB TYR 88 1HB TYR 88 -8.756 -1.104 6.346 693 2HB TYR 88 2HB TYR 88 -8.043 0.067 7.450 694 HD1 TYR 88 HD1 TYR 88 -10.748 -0.617 5.171 695 HD2 TYR 88 HD2 TYR 88 -8.720 2.485 7.261 696 HE1 TYR 88 HE1 TYR 88 -12.680 0.866 4.833 697 HE2 TYR 88 HE2 TYR 88 -10.646 3.976 6.928 698 HH TYR 88 HH TYR 88 -13.668 2.874 5.893 699 H GLY 89 H GLY 89 -6.790 -1.942 4.112 700 1HA GLY 89 1HA GLY 89 -8.732 -1.433 2.025 701 2HA GLY 89 2HA GLY 89 -7.057 -1.312 1.507 702 H TRP 90 H TRP 90 -8.292 -3.112 0.152 703 HA TRP 90 HA TRP 90 -7.914 -5.702 1.492 704 1HB TRP 90 1HB TRP 90 -9.470 -4.983 -1.000 705 2HB TRP 90 2HB TRP 90 -9.259 -6.625 -0.401 706 HD1 TRP 90 HD1 TRP 90 -9.651 -4.874 2.670 707 HE1 TRP 90 HE1 TRP 90 -12.098 -4.795 3.464 708 HE3 TRP 90 HE3 TRP 90 -11.967 -6.141 -1.708 709 HZ2 TRP 90 HZ2 TRP 90 -14.669 -5.213 2.379 710 HZ3 TRP 90 HZ3 TRP 90 -14.424 -6.280 -1.746 711 HH2 TRP 90 HH2 TRP 90 -15.745 -5.827 0.256 712 H GLU 91 H GLU 91 -6.564 -7.248 0.656 713 HA GLU 91 HA GLU 91 -5.032 -6.547 -1.753 714 1HB GLU 91 1HB GLU 91 -3.945 -6.225 0.687 715 2HB GLU 91 2HB GLU 91 -3.571 -7.924 0.431 716 1HG GLU 91 1HG GLU 91 -2.324 -7.441 -1.530 717 2HG GLU 91 2HG GLU 91 -2.880 -5.768 -1.544 718 HE2 GLU 91 HE2 GLU 91 -0.252 -4.819 0.419 719 H SER 92 H SER 92 -4.456 -8.241 -3.060 720 HA SER 92 HA SER 92 -5.289 -10.929 -2.192 721 1HB SER 92 1HB SER 92 -6.798 -9.668 -3.915 722 2HB SER 92 2HB SER 92 -5.523 -10.079 -5.061 723 HG SER 92 HG SER 92 -7.016 -11.726 -5.086 724 H THR 93 H THR 93 -3.658 -12.313 -2.199 725 HA THR 93 HA THR 93 -1.174 -11.666 -3.512 726 HB THR 93 HB THR 93 -0.327 -13.706 -2.456 727 HG1 THR 93 HG1 THR 93 -2.966 -14.103 -1.507 728 1HG2 THR 93 1HG2 THR 93 -1.119 -13.231 -0.038 729 2HG2 THR 93 2HG2 THR 93 -1.917 -11.836 -0.765 730 3HG2 THR 93 3HG2 THR 93 -0.168 -12.022 -0.901 731 H TRP 94 H TRP 94 -0.501 -12.352 -5.438 732 HA TRP 94 HA TRP 94 -1.915 -14.612 -6.693 733 1HB TRP 94 1HB TRP 94 -2.501 -12.307 -7.614 734 2HB TRP 94 2HB TRP 94 -0.849 -12.237 -8.220 735 HD1 TRP 94 HD1 TRP 94 -3.700 -14.884 -8.441 736 HE1 TRP 94 HE1 TRP 94 -3.804 -15.717 -10.873 737 HE3 TRP 94 HE3 TRP 94 0.087 -12.078 -10.423 738 HZ2 TRP 94 HZ2 TRP 94 -2.460 -15.247 -13.311 739 HZ3 TRP 94 HZ3 TRP 94 0.613 -12.330 -12.814 740 HH2 TRP 94 HH2 TRP 94 -0.634 -13.882 -14.226 741 H ARG 95 H ARG 95 -0.687 -15.846 -8.218 742 HA ARG 95 HA ARG 95 2.198 -15.753 -7.663 743 1HB ARG 95 1HB ARG 95 1.036 -17.825 -7.011 744 2HB ARG 95 2HB ARG 95 0.512 -18.049 -8.673 745 1HG ARG 95 1HG ARG 95 3.193 -17.815 -9.000 746 2HG ARG 95 2HG ARG 95 3.104 -18.594 -7.419 747 1HD ARG 95 1HD ARG 95 1.884 -20.425 -8.288 748 2HD ARG 95 2HD ARG 95 1.570 -19.588 -9.807 749 HE ARG 95 HE ARG 95 3.635 -20.240 -10.560 750 1HH1 ARG 95 1HH1 ARG 95 3.461 -20.767 -7.114 751 2HH1 ARG 95 2HH1 ARG 95 4.952 -21.644 -7.047 752 1HH2 ARG 95 1HH2 ARG 95 5.597 -21.393 -10.473 753 2HH2 ARG 95 2HH2 ARG 95 6.166 -21.998 -8.953 754 HA PRO 96 HA PRO 96 2.231 -14.357 -11.994 755 1HB PRO 96 1HB PRO 96 4.760 -13.384 -11.933 756 2HB PRO 96 2HB PRO 96 3.375 -12.484 -11.306 757 1HG PRO 96 1HG PRO 96 5.401 -14.113 -9.824 758 2HG PRO 96 2HG PRO 96 4.725 -12.527 -9.412 759 1HD PRO 96 1HD PRO 96 3.863 -14.823 -8.263 760 2HD PRO 96 2HD PRO 96 2.793 -13.435 -8.545 761 H LEU 97 H LEU 97 2.774 -15.548 -13.716 762 HA LEU 97 HA LEU 97 4.446 -17.879 -13.354 763 1HB LEU 97 1HB LEU 97 2.224 -17.567 -14.754 764 2HB LEU 97 2HB LEU 97 3.347 -17.085 -16.010 765 HG LEU 97 HG LEU 97 3.900 -19.644 -14.603 766 1HD1 LEU 97 1HD1 LEU 97 1.360 -19.352 -15.279 767 2HD1 LEU 97 2HD1 LEU 97 2.224 -20.868 -15.538 768 3HD1 LEU 97 3HD1 LEU 97 1.996 -19.744 -16.878 769 1HD2 LEU 97 1HD2 LEU 97 4.369 -20.223 -17.076 770 2HD2 LEU 97 2HD2 LEU 97 5.476 -19.143 -16.230 771 3HD2 LEU 97 3HD2 LEU 97 4.273 -18.481 -17.336 772 H ALA 98 H ALA 98 6.461 -16.771 -12.994 773 HA ALA 98 HA ALA 98 7.994 -16.499 -15.385 774 1HB ALA 98 1HB ALA 98 8.703 -14.069 -14.530 775 2HB ALA 98 2HB ALA 98 7.014 -14.063 -14.024 776 3HB ALA 98 3HB ALA 98 7.425 -14.331 -15.717 777 H ASP 99 H ASP 99 8.149 -15.117 -12.096 778 HA ASP 99 HA ASP 99 10.877 -15.956 -11.780 779 1HB ASP 99 1HB ASP 99 8.908 -14.400 -10.197 780 2HB ASP 99 2HB ASP 99 10.183 -15.205 -9.288 781 HD2 ASP 99 HD2 ASP 99 11.138 -12.142 -11.597 782 H GLU 100 H GLU 100 11.236 -16.902 -9.342 783 HA GLU 100 HA GLU 100 9.834 -19.484 -9.390 784 1HB GLU 100 1HB GLU 100 12.490 -19.051 -9.447 785 2HB GLU 100 2HB GLU 100 12.250 -19.123 -7.707 786 1HG GLU 100 1HG GLU 100 11.664 -21.329 -7.736 787 2HG GLU 100 2HG GLU 100 11.057 -21.260 -9.390 788 HE2 GLU 100 HE2 GLU 100 14.909 -21.974 -8.811 789 H ASN 101 H ASN 101 10.973 -16.960 -7.169 790 HA ASN 101 HA ASN 101 8.813 -17.713 -5.332 791 1HB ASN 101 1HB ASN 101 11.732 -17.615 -4.757 792 2HB ASN 101 2HB ASN 101 10.643 -17.001 -3.517 793 1HD2 ASN 101 1HD2 ASN 101 11.442 -19.802 -5.473 794 2HD2 ASN 101 2HD2 ASN 101 10.770 -20.977 -4.400 795 H PHE 102 H PHE 102 8.150 -15.763 -6.800 796 HA PHE 102 HA PHE 102 8.758 -13.314 -5.282 797 1HB PHE 102 1HB PHE 102 8.991 -13.826 -8.154 798 2HB PHE 102 2HB PHE 102 8.021 -12.404 -7.783 799 HD1 PHE 102 HD1 PHE 102 11.277 -13.986 -6.905 800 HD2 PHE 102 HD2 PHE 102 9.072 -10.385 -7.440 801 HE1 PHE 102 HE1 PHE 102 13.333 -12.681 -6.555 802 HE2 PHE 102 HE2 PHE 102 11.125 -9.073 -7.091 803 HZ PHE 102 HZ PHE 102 13.258 -10.221 -6.648 804 H HIS 103 H HIS 103 6.964 -13.106 -4.066 805 HA HIS 103 HA HIS 103 4.350 -13.769 -5.032 806 1HB HIS 103 1HB HIS 103 5.519 -12.768 -2.500 807 2HB HIS 103 2HB HIS 103 3.837 -12.342 -2.797 808 HD1 HIS 103 HD1 HIS 103 5.227 -15.638 -3.920 809 HD2 HIS 103 HD2 HIS 103 2.870 -14.099 -0.862 810 HE1 HIS 103 HE1 HIS 103 4.238 -17.639 -2.760 811 HE2 HIS 103 HE2 HIS 103 2.883 -16.685 -0.863 812 H LEU 104 H LEU 104 2.938 -12.515 -6.065 813 HA LEU 104 HA LEU 104 3.268 -9.601 -5.953 814 1HB LEU 104 1HB LEU 104 4.323 -10.564 -8.025 815 2HB LEU 104 2HB LEU 104 2.728 -11.110 -8.507 816 HG LEU 104 HG LEU 104 3.295 -8.211 -7.946 817 1HD1 LEU 104 1HD1 LEU 104 3.283 -9.281 -10.725 818 2HD1 LEU 104 2HD1 LEU 104 4.763 -9.388 -9.773 819 3HD1 LEU 104 3HD1 LEU 104 4.024 -7.816 -10.080 820 1HD2 LEU 104 1HD2 LEU 104 1.123 -9.773 -9.293 821 2HD2 LEU 104 2HD2 LEU 104 1.390 -8.073 -9.679 822 3HD2 LEU 104 3HD2 LEU 104 0.997 -8.552 -8.027 823 H GLY 105 H GLY 105 1.425 -8.625 -5.444 824 1HA GLY 105 1HA GLY 105 -1.111 -9.814 -6.327 825 2HA GLY 105 2HA GLY 105 -0.884 -9.490 -4.615 826 H LEU 106 H LEU 106 -2.969 -8.359 -6.033 827 HA LEU 106 HA LEU 106 -2.157 -5.527 -6.134 828 1HB LEU 106 1HB LEU 106 -3.991 -5.174 -7.755 829 2HB LEU 106 2HB LEU 106 -2.728 -6.228 -8.359 830 HG LEU 106 HG LEU 106 -5.092 -7.511 -7.090 831 1HD1 LEU 106 1HD1 LEU 106 -6.271 -5.965 -8.416 832 2HD1 LEU 106 2HD1 LEU 106 -6.205 -7.450 -9.367 833 3HD1 LEU 106 3HD1 LEU 106 -5.123 -6.110 -9.748 834 1HD2 LEU 106 1HD2 LEU 106 -3.589 -9.092 -7.801 835 2HD2 LEU 106 2HD2 LEU 106 -3.065 -8.132 -9.185 836 3HD2 LEU 106 3HD2 LEU 106 -4.623 -8.959 -9.223 837 H GLY 107 H GLY 107 -3.906 -3.993 -5.596 838 1HA GLY 107 1HA GLY 107 -6.314 -4.726 -4.378 839 2HA GLY 107 2HA GLY 107 -5.092 -4.638 -3.118 840 H PHE 108 H PHE 108 -7.023 -2.970 -2.690 841 HA PHE 108 HA PHE 108 -6.009 -0.359 -3.601 842 1HB PHE 108 1HB PHE 108 -8.898 -1.071 -3.052 843 2HB PHE 108 2HB PHE 108 -8.298 0.511 -3.540 844 HD1 PHE 108 HD1 PHE 108 -8.625 -3.008 -4.650 845 HD2 PHE 108 HD2 PHE 108 -8.023 1.045 -5.797 846 HE1 PHE 108 HE1 PHE 108 -8.894 -3.642 -7.012 847 HE2 PHE 108 HE2 PHE 108 -8.292 0.420 -8.162 848 HZ PHE 108 HZ PHE 108 -8.729 -1.927 -8.772 849 H THR 109 H THR 109 -5.406 0.978 -2.028 850 HA THR 109 HA THR 109 -6.059 0.251 0.734 851 HB THR 109 HB THR 109 -3.959 2.153 -0.322 852 HG1 THR 109 HG1 THR 109 -3.150 0.240 -0.809 853 1HG2 THR 109 1HG2 THR 109 -3.623 2.821 1.753 854 2HG2 THR 109 2HG2 THR 109 -3.313 1.153 2.234 855 3HG2 THR 109 3HG2 THR 109 -4.950 1.803 2.313 856 H ALA 110 H ALA 110 -7.306 1.489 2.000 857 HA ALA 110 HA ALA 110 -8.332 3.992 0.857 858 1HB ALA 110 1HB ALA 110 -9.618 2.778 3.234 859 2HB ALA 110 2HB ALA 110 -9.770 1.919 1.702 860 3HB ALA 110 3HB ALA 110 -10.338 3.583 1.841 861 H GLY 111 H GLY 111 -7.433 5.793 1.601 862 1HA GLY 111 1HA GLY 111 -6.239 5.789 4.283 863 2HA GLY 111 2HA GLY 111 -5.905 6.954 3.012 864 H VAL 112 H VAL 112 -7.260 6.677 5.937 865 HA VAL 112 HA VAL 112 -9.250 8.784 5.390 866 HB VAL 112 HB VAL 112 -9.359 6.834 7.691 867 1HG1 VAL 112 1HG1 VAL 112 -11.753 7.662 7.745 868 2HG1 VAL 112 2HG1 VAL 112 -11.231 8.945 6.651 869 3HG1 VAL 112 3HG1 VAL 112 -10.517 8.811 8.258 870 1HG2 VAL 112 1HG2 VAL 112 -11.268 5.819 6.431 871 2HG2 VAL 112 2HG2 VAL 112 -9.684 5.552 5.701 872 3HG2 VAL 112 3HG2 VAL 112 -10.771 6.768 5.030 873 H THR 113 H THR 113 -9.096 10.641 6.523 874 HA THR 113 HA THR 113 -6.904 10.833 8.472 875 HB THR 113 HB THR 113 -6.990 13.277 8.006 876 HG1 THR 113 HG1 THR 113 -8.924 13.758 7.234 877 1HG2 THR 113 1HG2 THR 113 -6.561 12.845 5.349 878 2HG2 THR 113 2HG2 THR 113 -6.246 11.256 6.045 879 3HG2 THR 113 3HG2 THR 113 -5.357 12.665 6.625 880 H ALA 114 H ALA 114 -7.204 11.894 10.443 881 HA ALA 114 HA ALA 114 -9.917 11.752 11.461 882 1HB ALA 114 1HB ALA 114 -7.681 12.671 13.180 883 2HB ALA 114 2HB ALA 114 -7.633 11.010 12.591 884 3HB ALA 114 3HB ALA 114 -9.009 11.570 13.541 885 H ARG 115 H ARG 115 -10.833 13.490 12.763 886 HA ARG 115 HA ARG 115 -10.583 16.020 11.426 887 1HB ARG 115 1HB ARG 115 -12.402 16.740 12.904 888 2HB ARG 115 2HB ARG 115 -12.774 15.205 12.133 889 1HG ARG 115 1HG ARG 115 -11.462 14.862 14.700 890 2HG ARG 115 2HG ARG 115 -12.966 15.776 14.820 891 1HD ARG 115 1HD ARG 115 -14.096 13.975 13.533 892 2HD ARG 115 2HD ARG 115 -12.595 13.051 13.585 893 HE ARG 115 HE ARG 115 -13.048 12.497 15.759 894 1HH1 ARG 115 1HH1 ARG 115 -15.109 15.151 14.815 895 2HH1 ARG 115 2HH1 ARG 115 -16.064 15.087 16.258 896 1HH2 ARG 115 1HH2 ARG 115 -14.304 12.411 17.658 897 2HH2 ARG 115 2HH2 ARG 115 -15.607 13.532 17.872 898 H ASP 116 H ASP 116 -9.789 17.933 12.220 899 HA ASP 116 HA ASP 116 -8.697 18.020 14.918 900 1HB ASP 116 1HB ASP 116 -7.065 17.929 12.441 901 2HB ASP 116 2HB ASP 116 -6.576 19.098 13.664 902 HD2 ASP 116 HD2 ASP 116 -6.110 15.244 14.421 903 H ASN 117 H ASN 117 -10.875 19.349 13.536 904 HA ASN 117 HA ASN 117 -10.010 22.111 13.988 905 1HB ASN 117 1HB ASN 117 -11.528 21.135 11.563 906 2HB ASN 117 2HB ASN 117 -11.388 22.832 12.013 907 1HD2 ASN 117 1HD2 ASN 117 -9.435 23.882 11.768 908 2HD2 ASN 117 2HD2 ASN 117 -8.133 23.220 10.845 909 H TRP 118 H TRP 118 -11.493 20.270 15.632 910 HA TRP 118 HA TRP 118 -13.330 20.225 16.970 911 1HB TRP 118 1HB TRP 118 -12.985 23.011 16.208 912 2HB TRP 118 2HB TRP 118 -14.671 22.630 16.542 913 HD1 TRP 118 HD1 TRP 118 -11.251 22.025 18.298 914 HE1 TRP 118 HE1 TRP 118 -11.602 22.348 20.827 915 HE3 TRP 118 HE3 TRP 118 -16.272 22.992 18.305 916 HZ2 TRP 118 HZ2 TRP 118 -13.726 22.936 22.592 917 HZ3 TRP 118 HZ3 TRP 118 -17.387 23.424 20.455 918 HH2 TRP 118 HH2 TRP 118 -16.139 23.395 22.554 919 H ASN 119 H ASN 119 -14.660 18.698 16.175 920 HA ASN 119 HA ASN 119 -16.422 17.737 15.109 921 1HB ASN 119 1HB ASN 119 -17.210 20.606 15.288 922 2HB ASN 119 2HB ASN 119 -18.171 19.555 14.252 923 1HD2 ASN 119 1HD2 ASN 119 -19.851 20.135 15.815 924 2HD2 ASN 119 2HD2 ASN 119 -19.996 19.195 17.257 925 H TYR 120 H TYR 120 -15.818 16.767 13.278 926 HA TYR 120 HA TYR 120 -16.338 17.923 10.762 927 1HB TYR 120 1HB TYR 120 -13.969 18.850 11.689 928 2HB TYR 120 2HB TYR 120 -13.430 17.383 10.878 929 HD1 TYR 120 HD1 TYR 120 -13.878 20.773 10.434 930 HD2 TYR 120 HD2 TYR 120 -14.641 17.085 8.457 931 HE1 TYR 120 HE1 TYR 120 -13.945 21.951 8.276 932 HE2 TYR 120 HE2 TYR 120 -14.711 18.252 6.293 933 HH TYR 120 HH TYR 120 -15.260 20.792 5.588 934 H ILE 121 H ILE 121 -16.439 16.388 9.174 935 HA ILE 121 HA ILE 121 -16.266 13.648 10.030 936 HB ILE 121 HB ILE 121 -18.107 14.422 8.587 937 1HG1 ILE 121 1HG1 ILE 121 -17.748 12.597 6.755 938 2HG1 ILE 121 2HG1 ILE 121 -16.271 12.241 7.644 939 1HG2 ILE 121 1HG2 ILE 121 -15.942 14.786 6.522 940 2HG2 ILE 121 2HG2 ILE 121 -16.939 16.049 7.243 941 3HG2 ILE 121 3HG2 ILE 121 -17.674 14.838 6.192 942 1HD1 ILE 121 1HD1 ILE 121 -18.035 12.248 9.665 943 2HD1 ILE 121 2HD1 ILE 121 -17.617 10.811 8.733 944 3HD1 ILE 121 3HD1 ILE 121 -19.077 11.720 8.345 945 HA PRO 122 HA PRO 122 -12.090 12.766 8.813 946 1HB PRO 122 1HB PRO 122 -13.274 10.169 7.943 947 2HB PRO 122 2HB PRO 122 -11.874 10.478 8.978 948 1HG PRO 122 1HG PRO 122 -14.187 9.700 10.035 949 2HG PRO 122 2HG PRO 122 -13.183 10.918 10.844 950 1HD PRO 122 1HD PRO 122 -15.696 11.268 9.276 951 2HD PRO 122 2HD PRO 122 -15.124 12.151 10.705 952 H LEU 123 H LEU 123 -10.835 12.305 6.919 953 HA LEU 123 HA LEU 123 -12.305 12.867 4.438 954 1HB LEU 123 1HB LEU 123 -10.218 14.215 5.470 955 2HB LEU 123 2HB LEU 123 -9.349 13.039 4.503 956 HG LEU 123 HG LEU 123 -11.063 13.852 2.638 957 1HD1 LEU 123 1HD1 LEU 123 -10.643 16.495 3.871 958 2HD1 LEU 123 2HD1 LEU 123 -11.885 15.484 4.610 959 3HD1 LEU 123 3HD1 LEU 123 -11.985 15.893 2.897 960 1HD2 LEU 123 1HD2 LEU 123 -8.563 15.312 3.483 961 2HD2 LEU 123 2HD2 LEU 123 -9.340 15.464 1.907 962 3HD2 LEU 123 3HD2 LEU 123 -8.661 13.916 2.410 963 HA PRO 124 HA PRO 124 -11.153 8.466 3.830 964 1HB PRO 124 1HB PRO 124 -13.205 7.916 2.141 965 2HB PRO 124 2HB PRO 124 -13.378 7.890 3.900 966 1HG PRO 124 1HG PRO 124 -14.126 10.040 1.954 967 2HG PRO 124 2HG PRO 124 -15.034 9.427 3.350 968 1HD PRO 124 1HD PRO 124 -13.607 11.726 3.436 969 2HD PRO 124 2HD PRO 124 -13.811 10.675 4.853 970 H VAL 125 H VAL 125 -10.304 7.383 2.015 971 HA VAL 125 HA VAL 125 -10.254 8.734 -0.553 972 HB VAL 125 HB VAL 125 -7.645 8.130 0.841 973 1HG1 VAL 125 1HG1 VAL 125 -8.415 9.181 -1.839 974 2HG1 VAL 125 2HG1 VAL 125 -7.161 8.023 -1.400 975 3HG1 VAL 125 3HG1 VAL 125 -6.918 9.743 -1.094 976 1HG2 VAL 125 1HG2 VAL 125 -8.698 9.979 1.984 977 2HG2 VAL 125 2HG2 VAL 125 -9.037 10.778 0.449 978 3HG2 VAL 125 3HG2 VAL 125 -7.370 10.584 0.992 979 H LEU 126 H LEU 126 -9.269 7.419 -2.243 980 HA LEU 126 HA LEU 126 -8.849 4.606 -1.566 981 1HB LEU 126 1HB LEU 126 -10.690 5.377 -3.817 982 2HB LEU 126 2HB LEU 126 -10.427 3.785 -3.131 983 HG LEU 126 HG LEU 126 -11.389 4.957 -0.951 984 1HD1 LEU 126 1HD1 LEU 126 -12.930 6.664 -1.324 985 2HD1 LEU 126 2HD1 LEU 126 -12.937 6.405 -3.069 986 3HD1 LEU 126 3HD1 LEU 126 -11.534 7.139 -2.292 987 1HD2 LEU 126 1HD2 LEU 126 -13.267 4.146 -3.152 988 2HD2 LEU 126 2HD2 LEU 126 -13.462 3.937 -1.412 989 3HD2 LEU 126 3HD2 LEU 126 -12.261 2.986 -2.286 990 H LEU 127 H LEU 127 -6.944 4.100 -2.401 991 HA LEU 127 HA LEU 127 -6.331 4.957 -5.139 992 1HB LEU 127 1HB LEU 127 -4.263 4.960 -2.951 993 2HB LEU 127 2HB LEU 127 -4.102 5.581 -4.582 994 HG LEU 127 HG LEU 127 -6.181 6.819 -2.856 995 1HD1 LEU 127 1HD1 LEU 127 -4.781 7.974 -1.483 996 2HD1 LEU 127 2HD1 LEU 127 -3.417 7.867 -2.596 997 3HD1 LEU 127 3HD1 LEU 127 -3.869 6.470 -1.620 998 1HD2 LEU 127 1HD2 LEU 127 -4.968 8.839 -4.045 999 2HD2 LEU 127 2HD2 LEU 127 -6.151 7.845 -4.896 1000 3HD2 LEU 127 3HD2 LEU 127 -4.426 7.564 -5.137 1001 HA PRO 128 HA PRO 128 -5.271 0.678 -5.569 1002 1HB PRO 128 1HB PRO 128 -3.904 0.770 -7.892 1003 2HB PRO 128 2HB PRO 128 -5.655 1.010 -7.818 1004 1HG PRO 128 1HG PRO 128 -3.469 3.046 -8.016 1005 2HG PRO 128 2HG PRO 128 -5.020 2.982 -8.873 1006 1HD PRO 128 1HD PRO 128 -4.580 4.556 -6.692 1007 2HD PRO 128 2HD PRO 128 -6.173 3.897 -7.112 1008 H LEU 129 H LEU 129 -3.674 -0.631 -4.875 1009 HA LEU 129 HA LEU 129 -0.922 0.400 -4.842 1010 1HB LEU 129 1HB LEU 129 -2.587 -0.518 -2.567 1011 2HB LEU 129 2HB LEU 129 -0.914 -1.045 -2.578 1012 HG LEU 129 HG LEU 129 -0.347 1.456 -2.905 1013 1HD1 LEU 129 1HD1 LEU 129 -3.253 1.527 -2.350 1014 2HD1 LEU 129 2HD1 LEU 129 -2.249 2.625 -3.298 1015 3HD1 LEU 129 3HD1 LEU 129 -2.245 2.725 -1.537 1016 1HD2 LEU 129 1HD2 LEU 129 -1.196 0.020 -0.455 1017 2HD2 LEU 129 2HD2 LEU 129 -0.909 1.755 -0.322 1018 3HD2 LEU 129 3HD2 LEU 129 0.377 0.691 -0.892 1019 H ALA 130 H ALA 130 0.617 -1.478 -4.164 1020 HA ALA 130 HA ALA 130 -0.276 -4.079 -5.116 1021 1HB ALA 130 1HB ALA 130 0.418 -3.548 -7.203 1022 2HB ALA 130 2HB ALA 130 1.993 -3.984 -6.539 1023 3HB ALA 130 3HB ALA 130 1.516 -2.289 -6.636 1024 H SER 131 H SER 131 1.532 -5.719 -4.927 1025 HA SER 131 HA SER 131 3.539 -5.026 -2.922 1026 1HB SER 131 1HB SER 131 1.214 -6.076 -2.031 1027 2HB SER 131 2HB SER 131 2.097 -7.560 -2.388 1028 HG SER 131 HG SER 131 3.853 -6.529 -1.119 1029 H VAL 132 H VAL 132 5.428 -5.798 -3.566 1030 HA VAL 132 HA VAL 132 5.549 -8.415 -4.873 1031 HB VAL 132 HB VAL 132 7.009 -6.019 -5.989 1032 1HG1 VAL 132 1HG1 VAL 132 8.274 -7.782 -6.685 1033 2HG1 VAL 132 2HG1 VAL 132 7.056 -7.793 -7.960 1034 3HG1 VAL 132 3HG1 VAL 132 6.929 -8.921 -6.611 1035 1HG2 VAL 132 1HG2 VAL 132 4.916 -5.479 -6.700 1036 2HG2 VAL 132 2HG2 VAL 132 4.332 -7.140 -6.599 1037 3HG2 VAL 132 3HG2 VAL 132 5.336 -6.639 -7.960 1038 H GLY 133 H GLY 133 7.037 -9.630 -3.914 1039 1HA GLY 133 1HA GLY 133 9.675 -9.000 -3.440 1040 2HA GLY 133 2HA GLY 133 8.826 -8.544 -1.971 1041 H TYR 134 H TYR 134 10.362 -10.221 -1.123 1042 HA TYR 134 HA TYR 134 8.970 -12.793 -1.060 1043 1HB TYR 134 1HB TYR 134 11.215 -13.958 -1.146 1044 2HB TYR 134 2HB TYR 134 10.675 -13.245 -2.662 1045 HD1 TYR 134 HD1 TYR 134 11.609 -10.935 -3.278 1046 HD2 TYR 134 HD2 TYR 134 13.306 -13.409 -0.260 1047 HE1 TYR 134 HE1 TYR 134 13.717 -9.681 -3.442 1048 HE2 TYR 134 HE2 TYR 134 15.419 -12.161 -0.417 1049 HH TYR 134 HH TYR 134 15.688 -9.211 -2.146 1050 H GLY 135 H GLY 135 9.174 -13.924 0.873 1051 1HA GLY 135 1HA GLY 135 9.428 -14.151 3.142 1052 2HA GLY 135 2HA GLY 135 11.007 -13.416 2.913 1053 HA PRO 136 HA PRO 136 8.809 -10.480 5.646 1054 1HB PRO 136 1HB PRO 136 11.074 -9.405 6.702 1055 2HB PRO 136 2HB PRO 136 10.339 -10.894 7.305 1056 1HG PRO 136 1HG PRO 136 12.655 -10.546 5.441 1057 2HG PRO 136 2HG PRO 136 12.471 -11.672 6.798 1058 1HD PRO 136 1HD PRO 136 12.119 -12.435 4.230 1059 2HD PRO 136 2HD PRO 136 11.190 -13.145 5.566 1060 H VAL 137 H VAL 137 11.212 -10.044 3.182 1061 HA VAL 137 HA VAL 137 10.902 -7.151 3.149 1062 HB VAL 137 HB VAL 137 12.458 -8.860 1.208 1063 1HG1 VAL 137 1HG1 VAL 137 12.271 -6.780 0.225 1064 2HG1 VAL 137 2HG1 VAL 137 13.772 -6.615 1.136 1065 3HG1 VAL 137 3HG1 VAL 137 12.275 -5.931 1.771 1066 1HG2 VAL 137 1HG2 VAL 137 13.448 -9.381 3.258 1067 2HG2 VAL 137 2HG2 VAL 137 13.219 -7.749 3.888 1068 3HG2 VAL 137 3HG2 VAL 137 14.429 -8.051 2.642 1069 H THR 138 H THR 138 9.148 -6.340 2.211 1070 HA THR 138 HA THR 138 8.368 -7.368 -0.421 1071 HB THR 138 HB THR 138 6.154 -6.536 1.372 1072 HG1 THR 138 HG1 THR 138 7.620 -8.928 1.700 1073 1HG2 THR 138 1HG2 THR 138 4.964 -8.342 0.285 1074 2HG2 THR 138 2HG2 THR 138 6.437 -8.832 -0.551 1075 3HG2 THR 138 3HG2 THR 138 5.697 -7.272 -0.909 1076 H PHE 139 H PHE 139 7.986 -5.810 -1.875 1077 HA PHE 139 HA PHE 139 8.143 -3.040 -0.973 1078 1HB PHE 139 1HB PHE 139 8.339 -4.299 -3.712 1079 2HB PHE 139 2HB PHE 139 8.375 -2.561 -3.437 1080 HD1 PHE 139 HD1 PHE 139 10.069 -5.662 -2.242 1081 HD2 PHE 139 HD2 PHE 139 10.421 -1.542 -3.251 1082 HE1 PHE 139 HE1 PHE 139 12.497 -5.778 -1.857 1083 HE2 PHE 139 HE2 PHE 139 12.849 -1.652 -2.868 1084 HZ PHE 139 HZ PHE 139 13.890 -3.772 -2.170 1085 H GLN 140 H GLN 140 6.467 -1.680 -0.960 1086 HA GLN 140 HA GLN 140 3.933 -2.618 -2.126 1087 1HB GLN 140 1HB GLN 140 4.549 -0.879 0.249 1088 2HB GLN 140 2HB GLN 140 2.963 -0.849 -0.511 1089 1HG GLN 140 1HG GLN 140 3.949 -3.533 0.094 1090 2HG GLN 140 2HG GLN 140 3.711 -2.509 1.509 1091 1HE2 GLN 140 1HE2 GLN 140 1.559 -1.049 0.932 1092 2HE2 GLN 140 2HE2 GLN 140 0.175 -2.048 0.669 1093 H MET 141 H MET 141 3.383 -1.657 -3.958 1094 HA MET 141 HA MET 141 4.471 0.968 -4.608 1095 1HB MET 141 1HB MET 141 3.130 -1.200 -6.189 1096 2HB MET 141 2HB MET 141 3.236 0.430 -6.838 1097 1HG MET 141 1HG MET 141 5.749 -0.682 -5.798 1098 2HG MET 141 2HG MET 141 5.090 -1.482 -7.223 1099 1HE MET 141 1HE MET 141 7.859 0.625 -8.801 1100 2HE MET 141 2HE MET 141 6.741 -0.612 -9.378 1101 3HE MET 141 3HE MET 141 7.547 -0.809 -7.821 1102 H THR 142 H THR 142 3.307 2.801 -4.692 1103 HA THR 142 HA THR 142 0.387 2.598 -4.367 1104 HB THR 142 HB THR 142 0.489 4.619 -2.930 1105 HG1 THR 142 HG1 THR 142 3.282 4.199 -3.149 1106 1HG2 THR 142 1HG2 THR 142 1.510 2.015 -2.170 1107 2HG2 THR 142 2HG2 THR 142 0.382 3.083 -1.335 1108 3HG2 THR 142 3HG2 THR 142 2.120 3.315 -1.146 1109 H TYR 143 H TYR 143 -0.850 4.009 -5.530 1110 HA TYR 143 HA TYR 143 0.599 5.716 -7.441 1111 1HB TYR 143 1HB TYR 143 -0.707 3.868 -8.445 1112 2HB TYR 143 2HB TYR 143 -2.166 4.515 -7.703 1113 HD1 TYR 143 HD1 TYR 143 -3.164 6.594 -8.528 1114 HD2 TYR 143 HD2 TYR 143 0.270 4.909 -10.390 1115 HE1 TYR 143 HE1 TYR 143 -3.530 8.031 -10.490 1116 HE2 TYR 143 HE2 TYR 143 -0.085 6.341 -12.357 1117 HH TYR 143 HH TYR 143 -2.317 8.945 -12.355 1118 H ILE 144 H ILE 144 0.542 7.794 -6.923 1119 HA ILE 144 HA ILE 144 -2.001 8.965 -6.058 1120 HB ILE 144 HB ILE 144 -0.694 10.434 -4.455 1121 1HG1 ILE 144 1HG1 ILE 144 1.307 8.287 -4.121 1122 2HG1 ILE 144 2HG1 ILE 144 1.503 9.274 -5.566 1123 1HG2 ILE 144 1HG2 ILE 144 -1.341 9.103 -2.751 1124 2HG2 ILE 144 2HG2 ILE 144 -0.497 7.691 -3.389 1125 3HG2 ILE 144 3HG2 ILE 144 -2.063 8.158 -4.054 1126 1HD1 ILE 144 1HD1 ILE 144 1.364 11.283 -4.022 1127 2HD1 ILE 144 2HD1 ILE 144 2.820 10.292 -3.924 1128 3HD1 ILE 144 3HD1 ILE 144 1.563 10.137 -2.697 1129 HA PRO 145 HA PRO 145 -0.338 11.551 -9.425 1130 1HB PRO 145 1HB PRO 145 -2.726 12.623 -10.125 1131 2HB PRO 145 2HB PRO 145 -2.202 11.023 -10.664 1132 1HG PRO 145 1HG PRO 145 -4.049 11.756 -8.426 1133 2HG PRO 145 2HG PRO 145 -4.213 10.469 -9.636 1134 1HD PRO 145 1HD PRO 145 -3.347 9.999 -7.112 1135 2HD PRO 145 2HD PRO 145 -2.787 9.055 -8.507 1136 H GLY 146 H GLY 146 0.126 13.732 -9.529 1137 1HA GLY 146 1HA GLY 146 -1.081 15.463 -7.474 1138 2HA GLY 146 2HA GLY 146 0.667 15.356 -7.610 1139 H THR 147 H THR 147 1.364 15.630 -10.067 1140 HA THR 147 HA THR 147 0.003 18.060 -11.035 1141 HB THR 147 HB THR 147 2.923 17.346 -11.364 1142 HG1 THR 147 HG1 THR 147 2.705 17.844 -9.257 1143 1HG2 THR 147 1HG2 THR 147 1.895 18.906 -13.059 1144 2HG2 THR 147 2HG2 THR 147 3.278 19.526 -12.159 1145 3HG2 THR 147 3HG2 THR 147 1.646 20.035 -11.727 1146 H TYR 148 H TYR 148 -0.137 18.381 -13.295 1147 HA TYR 148 HA TYR 148 -0.152 15.870 -14.804 1148 1HB TYR 148 1HB TYR 148 -1.553 18.510 -15.196 1149 2HB TYR 148 2HB TYR 148 -1.505 17.284 -16.459 1150 HD1 TYR 148 HD1 TYR 148 -2.601 17.908 -12.969 1151 HD2 TYR 148 HD2 TYR 148 -3.003 15.470 -16.432 1152 HE1 TYR 148 HE1 TYR 148 -4.547 16.799 -11.955 1153 HE2 TYR 148 HE2 TYR 148 -4.951 14.355 -15.428 1154 HH TYR 148 HH TYR 148 -5.714 14.533 -12.207 1155 H ASN 149 H ASN 149 2.308 17.331 -14.276 1156 HA ASN 149 HA ASN 149 3.138 17.728 -17.060 1157 1HB ASN 149 1HB ASN 149 2.763 19.886 -15.482 1158 2HB ASN 149 2HB ASN 149 4.429 19.497 -15.061 1159 1HD2 ASN 149 1HD2 ASN 149 5.744 20.762 -16.142 1160 2HD2 ASN 149 2HD2 ASN 149 5.612 21.183 -17.812 1161 H ASN 150 H ASN 150 3.421 15.519 -15.158 1162 HA ASN 150 HA ASN 150 6.357 15.378 -15.140 1163 1HB ASN 150 1HB ASN 150 4.445 14.734 -12.921 1164 2HB ASN 150 2HB ASN 150 5.975 13.871 -13.040 1165 1HD2 ASN 150 1HD2 ASN 150 4.472 16.990 -12.592 1166 2HD2 ASN 150 2HD2 ASN 150 5.847 17.770 -11.896 1167 H GLY 151 H GLY 151 3.309 13.564 -15.072 1168 1HA GLY 151 1HA GLY 151 2.942 11.853 -16.750 1169 2HA GLY 151 2HA GLY 151 4.651 11.460 -16.645 1170 H ASN 152 H ASN 152 2.473 12.020 -13.930 1171 HA ASN 152 HA ASN 152 1.833 10.700 -12.191 1172 1HB ASN 152 1HB ASN 152 2.127 8.415 -14.152 1173 2HB ASN 152 2HB ASN 152 1.174 8.418 -12.670 1174 1HD2 ASN 152 1HD2 ASN 152 -0.536 10.121 -12.567 1175 2HD2 ASN 152 2HD2 ASN 152 -1.428 10.431 -14.014 1176 H VAL 153 H VAL 153 3.336 10.695 -10.640 1177 HA VAL 153 HA VAL 153 5.745 9.053 -10.999 1178 HB VAL 153 HB VAL 153 5.248 11.126 -8.862 1179 1HG1 VAL 153 1HG1 VAL 153 7.085 9.174 -8.836 1180 2HG1 VAL 153 2HG1 VAL 153 7.366 10.774 -8.146 1181 3HG1 VAL 153 3HG1 VAL 153 7.965 10.392 -9.759 1182 1HG2 VAL 153 1HG2 VAL 153 7.061 12.284 -10.476 1183 2HG2 VAL 153 2HG2 VAL 153 5.324 12.562 -10.605 1184 3HG2 VAL 153 3HG2 VAL 153 6.112 11.398 -11.670 1185 H TYR 154 H TYR 154 5.172 7.022 -10.387 1186 HA TYR 154 HA TYR 154 3.561 6.543 -8.046 1187 1HB TYR 154 1HB TYR 154 4.067 4.127 -8.564 1188 2HB TYR 154 2HB TYR 154 3.274 5.015 -9.861 1189 HD1 TYR 154 HD1 TYR 154 6.471 3.562 -8.740 1190 HD2 TYR 154 HD2 TYR 154 4.363 5.375 -11.959 1191 HE1 TYR 154 HE1 TYR 154 8.270 2.903 -10.280 1192 HE2 TYR 154 HE2 TYR 154 6.156 4.719 -13.510 1193 HH TYR 154 HH TYR 154 9.031 4.057 -12.823 1194 H PHE 155 H PHE 155 4.227 6.039 -6.042 1195 HA PHE 155 HA PHE 155 7.130 5.900 -5.585 1196 1HB PHE 155 1HB PHE 155 4.927 7.236 -4.188 1197 2HB PHE 155 2HB PHE 155 5.991 6.334 -3.112 1198 HD1 PHE 155 HD1 PHE 155 7.859 7.383 -2.287 1199 HD2 PHE 155 HD2 PHE 155 6.170 8.753 -5.944 1200 HE1 PHE 155 HE1 PHE 155 9.481 9.232 -2.338 1201 HE2 PHE 155 HE2 PHE 155 7.789 10.605 -6.002 1202 HZ PHE 155 HZ PHE 155 9.448 10.846 -4.198 1203 H ALA 156 H ALA 156 7.807 4.562 -3.699 1204 HA ALA 156 HA ALA 156 6.063 2.232 -3.284 1205 1HB ALA 156 1HB ALA 156 7.571 0.717 -4.020 1206 2HB ALA 156 2HB ALA 156 8.956 1.679 -3.503 1207 3HB ALA 156 3HB ALA 156 8.116 2.076 -5.003 1208 H TRP 157 H TRP 157 6.512 1.015 -1.363 1209 HA TRP 157 HA TRP 157 8.186 2.397 0.617 1210 1HB TRP 157 1HB TRP 157 5.420 1.319 1.194 1211 2HB TRP 157 2HB TRP 157 6.475 2.173 2.316 1212 HD1 TRP 157 HD1 TRP 157 4.129 2.773 -0.637 1213 HE1 TRP 157 HE1 TRP 157 3.615 5.291 -0.786 1214 HE3 TRP 157 HE3 TRP 157 7.436 4.485 2.865 1215 HZ2 TRP 157 HZ2 TRP 157 4.494 7.686 0.422 1216 HZ3 TRP 157 HZ3 TRP 157 7.537 6.904 3.309 1217 HH2 TRP 157 HH2 TRP 157 6.096 8.470 2.111 1218 H MET 158 H MET 158 9.066 1.086 2.243 1219 HA MET 158 HA MET 158 9.304 -1.711 1.482 1220 1HB MET 158 1HB MET 158 10.762 0.002 3.494 1221 2HB MET 158 2HB MET 158 11.046 -1.725 3.325 1222 1HG MET 158 1HG MET 158 11.479 -1.169 0.841 1223 2HG MET 158 2HG MET 158 11.670 0.486 1.417 1224 1HE MET 158 1HE MET 158 14.671 0.981 1.466 1225 2HE MET 158 2HE MET 158 14.740 0.771 3.216 1226 3HE MET 158 3HE MET 158 13.290 1.435 2.464 1227 H ARG 159 H ARG 159 8.598 -3.425 2.656 1228 HA ARG 159 HA ARG 159 7.119 -2.835 5.136 1229 1HB ARG 159 1HB ARG 159 5.920 -3.599 2.848 1230 2HB ARG 159 2HB ARG 159 6.295 -5.179 3.521 1231 1HG ARG 159 1HG ARG 159 5.227 -3.853 5.670 1232 2HG ARG 159 2HG ARG 159 4.280 -3.232 4.316 1233 1HD ARG 159 1HD ARG 159 4.704 -6.132 5.031 1234 2HD ARG 159 2HD ARG 159 3.223 -5.204 5.261 1235 HE ARG 159 HE ARG 159 3.992 -5.133 2.547 1236 1HH1 ARG 159 1HH1 ARG 159 2.649 -7.296 4.933 1237 2HH1 ARG 159 2HH1 ARG 159 1.790 -8.248 3.769 1238 1HH2 ARG 159 1HH2 ARG 159 2.863 -6.382 1.014 1239 2HH2 ARG 159 2HH2 ARG 159 1.912 -7.730 1.543 1240 H PHE 160 H PHE 160 7.660 -3.993 6.877 1241 HA PHE 160 HA PHE 160 9.146 -6.500 6.502 1242 1HB PHE 160 1HB PHE 160 10.444 -4.237 7.205 1243 2HB PHE 160 2HB PHE 160 9.960 -4.813 8.797 1244 HD1 PHE 160 HD1 PHE 160 12.546 -4.834 6.545 1245 HD2 PHE 160 HD2 PHE 160 10.339 -7.502 9.019 1246 HE1 PHE 160 HE1 PHE 160 14.448 -6.395 6.551 1247 HE2 PHE 160 HE2 PHE 160 12.236 -9.068 9.031 1248 HZ PHE 160 HZ PHE 160 14.294 -8.515 7.796 1249 H GLN 161 H GLN 161 8.583 -8.123 7.849 1250 HA GLN 161 HA GLN 161 6.304 -7.679 9.586 1251 1HB GLN 161 1HB GLN 161 7.665 -10.054 8.413 1252 2HB GLN 161 2HB GLN 161 6.749 -10.285 9.895 1253 1HG GLN 161 1HG GLN 161 5.258 -10.781 8.166 1254 2HG GLN 161 2HG GLN 161 4.814 -9.163 8.708 1255 1HE2 GLN 161 1HE2 GLN 161 3.776 -8.954 6.642 1256 2HE2 GLN 161 2HE2 GLN 161 4.706 -8.530 5.250 1257 H PHE 162 H PHE 162 6.269 -7.870 11.779 1258 HA PHE 162 HA PHE 162 8.788 -8.526 13.140 1259 1HB PHE 162 1HB PHE 162 7.039 -6.116 13.655 1260 2HB PHE 162 2HB PHE 162 8.293 -6.664 14.762 1261 HD1 PHE 162 HD1 PHE 162 10.663 -6.568 14.086 1262 HD2 PHE 162 HD2 PHE 162 7.568 -4.922 11.674 1263 HE1 PHE 162 HE1 PHE 162 12.335 -5.260 12.840 1264 HE2 PHE 162 HE2 PHE 162 9.233 -3.613 10.423 1265 HZ PHE 162 HZ PHE 162 11.620 -3.781 11.005 1266 H LEU 163 H LEU 163 8.315 -8.632 15.628 1267 HA LEU 163 HA LEU 163 5.680 -9.800 16.141 1268 1HB LEU 163 1HB LEU 163 7.651 -11.477 15.543 1269 2HB LEU 163 2HB LEU 163 8.050 -11.233 17.232 1270 HG LEU 163 HG LEU 163 5.412 -12.259 16.181 1271 1HD1 LEU 163 1HD1 LEU 163 6.341 -14.253 17.667 1272 2HD1 LEU 163 2HD1 LEU 163 7.884 -13.566 17.162 1273 3HD1 LEU 163 3HD1 LEU 163 6.720 -14.102 15.951 1274 1HD2 LEU 163 1HD2 LEU 163 4.964 -11.066 18.172 1275 2HD2 LEU 163 2HD2 LEU 163 6.406 -11.701 18.964 1276 3HD2 LEU 163 3HD2 LEU 163 5.044 -12.770 18.626 1277 H GLU 164 H GLU 164 5.151 -8.081 17.466 1278 HA GLU 164 HA GLU 164 6.526 -8.056 20.054 1279 1HB GLU 164 1HB GLU 164 5.744 -5.558 18.540 1280 2HB GLU 164 2HB GLU 164 6.456 -5.614 20.147 1281 1HG GLU 164 1HG GLU 164 7.842 -6.743 17.738 1282 2HG GLU 164 2HG GLU 164 7.997 -5.054 18.219 1283 HE2 GLU 164 HE2 GLU 164 9.603 -7.771 20.644 1284 H HIS 165 H HIS 165 5.222 -7.605 21.819 1285 HA HIS 165 HA HIS 165 2.335 -7.592 21.248 1286 1HB HIS 165 1HB HIS 165 2.075 -8.579 23.511 1287 2HB HIS 165 2HB HIS 165 3.041 -9.584 22.437 1288 HD1 HIS 165 HD1 HIS 165 5.719 -9.376 22.823 1289 HD2 HIS 165 HD2 HIS 165 3.274 -7.978 25.878 1290 HE1 HIS 165 HE1 HIS 165 7.196 -9.231 24.853 1291 HE2 HIS 165 HE2 HIS 165 5.674 -8.464 26.709 1292 H HIS 166 H HIS 166 1.632 -5.545 21.333 1293 HA HIS 166 HA HIS 166 2.016 -4.076 23.823 1294 1HB HIS 166 1HB HIS 166 3.067 -3.255 21.181 1295 2HB HIS 166 2HB HIS 166 2.239 -2.002 22.099 1296 HD1 HIS 166 HD1 HIS 166 3.306 -1.331 24.402 1297 HD2 HIS 166 HD2 HIS 166 5.572 -3.959 22.118 1298 HE1 HIS 166 HE1 HIS 166 5.603 -1.303 25.426 1299 HE2 HIS 166 HE2 HIS 166 6.978 -2.837 23.975 1300 H HIS 167 H HIS 167 -0.078 -4.103 24.428 1301 HA HIS 167 HA HIS 167 -1.958 -2.620 22.760 1302 1HB HIS 167 1HB HIS 167 -2.052 -5.325 22.651 1303 2HB HIS 167 2HB HIS 167 -3.111 -5.033 24.027 1304 HD1 HIS 167 HD1 HIS 167 -4.659 -6.187 21.923 1305 HD2 HIS 167 HD2 HIS 167 -3.749 -2.134 21.821 1306 HE1 HIS 167 HE1 HIS 167 -6.366 -5.153 20.393 1307 HE2 HIS 167 HE2 HIS 167 -5.849 -2.687 20.416 1308 H HIS 168 H HIS 168 -4.227 -2.851 24.214 1309 HA HIS 168 HA HIS 168 -3.472 -1.525 26.704 1310 1HB HIS 168 1HB HIS 168 -6.061 -1.660 25.159 1311 2HB HIS 168 2HB HIS 168 -5.942 -0.931 26.757 1312 HD1 HIS 168 HD1 HIS 168 -3.499 -0.539 23.882 1313 HD2 HIS 168 HD2 HIS 168 -6.157 1.714 26.146 1314 HE1 HIS 168 HE1 HIS 168 -3.144 1.843 23.160 1315 HE2 HIS 168 HE2 HIS 168 -4.825 3.178 24.481 1316 H HIS 169 H HIS 169 -4.602 -2.012 28.693 1317 HA HIS 169 HA HIS 169 -5.192 -4.879 28.913 1318 1HB HIS 169 1HB HIS 169 -3.872 -2.909 30.646 1319 2HB HIS 169 2HB HIS 169 -5.004 -3.958 31.493 1320 HD1 HIS 169 HD1 HIS 169 -1.623 -3.860 30.116 1321 HD2 HIS 169 HD2 HIS 169 -4.363 -6.784 31.212 1322 HE1 HIS 169 HE1 HIS 169 -0.294 -5.986 30.316 1323 HE2 HIS 169 HE2 HIS 169 -1.988 -7.757 30.897 1324 H HIS 170 H HIS 170 -7.267 -5.409 28.946 1325 HA HIS 170 HA HIS 170 -9.135 -3.691 30.431 1326 1HB HIS 170 1HB HIS 170 -9.297 -3.434 27.897 1327 2HB HIS 170 2HB HIS 170 -9.888 -5.091 27.867 1328 HD1 HIS 170 HD1 HIS 170 -10.957 -2.876 30.661 1329 HD2 HIS 170 HD2 HIS 170 -12.414 -4.188 26.998 1330 HE1 HIS 170 HE1 HIS 170 -13.391 -2.244 30.640 1331 HE2 HIS 170 HE2 HIS 170 -14.230 -2.970 28.379 Start of MODEL 3 1 1H MET 1 1H MET 1 -5.218 -42.529 30.481 2 2H MET 1 2H MET 1 -6.339 -41.339 31.003 3 H MET 1 H MET 1 -5.396 -42.506 30.685 4 3H MET 1 3H MET 1 -4.669 -40.960 30.899 5 HA MET 1 HA MET 1 -4.745 -41.318 28.529 6 1HB MET 1 1HB MET 1 -6.929 -42.776 29.005 7 2HB MET 1 2HB MET 1 -7.723 -41.248 28.649 8 1HG MET 1 1HG MET 1 -6.511 -41.173 26.494 9 2HG MET 1 2HG MET 1 -5.848 -42.767 26.852 10 1HE MET 1 1HE MET 1 -8.639 -44.985 27.301 11 2HE MET 1 2HE MET 1 -6.903 -44.695 27.180 12 3HE MET 1 3HE MET 1 -7.819 -45.165 25.749 13 H ASN 2 H ASN 2 -4.100 -39.300 28.133 14 HA ASN 2 HA ASN 2 -6.044 -37.126 28.500 15 1HB ASN 2 1HB ASN 2 -4.308 -37.144 30.328 16 2HB ASN 2 2HB ASN 2 -3.092 -36.846 29.089 17 1HD2 ASN 2 1HD2 ASN 2 -2.454 -34.837 29.543 18 2HD2 ASN 2 2HD2 ASN 2 -3.490 -33.457 29.600 19 H ALA 3 H ALA 3 -5.191 -38.714 26.160 20 HA ALA 3 HA ALA 3 -3.520 -37.035 24.547 21 1HB ALA 3 1HB ALA 3 -4.080 -38.577 22.734 22 2HB ALA 3 2HB ALA 3 -5.302 -39.334 23.755 23 3HB ALA 3 3HB ALA 3 -3.598 -39.445 24.192 24 H ASP 4 H ASP 4 -6.872 -37.115 25.305 25 HA ASP 4 HA ASP 4 -7.783 -35.797 22.923 26 1HB ASP 4 1HB ASP 4 -9.010 -36.572 25.538 27 2HB ASP 4 2HB ASP 4 -9.828 -35.372 24.541 28 HD2 ASP 4 HD2 ASP 4 -10.104 -39.126 23.545 29 H GLU 5 H GLU 5 -7.502 -34.768 26.326 30 HA GLU 5 HA GLU 5 -7.954 -32.026 25.756 31 1HB GLU 5 1HB GLU 5 -6.672 -33.343 28.156 32 2HB GLU 5 2HB GLU 5 -7.141 -31.651 28.074 33 1HG GLU 5 1HG GLU 5 -9.438 -32.994 27.349 34 2HG GLU 5 2HG GLU 5 -8.743 -34.004 28.615 35 HE2 GLU 5 HE2 GLU 5 -8.878 -30.776 30.531 36 H TRP 6 H TRP 6 -5.146 -34.060 25.693 37 HA TRP 6 HA TRP 6 -3.233 -31.923 25.815 38 1HB TRP 6 1HB TRP 6 -2.643 -34.196 26.533 39 2HB TRP 6 2HB TRP 6 -2.909 -34.788 24.896 40 HD1 TRP 6 HD1 TRP 6 -0.693 -35.187 23.703 41 HE1 TRP 6 HE1 TRP 6 1.626 -34.073 23.675 42 HE3 TRP 6 HE3 TRP 6 -1.545 -31.449 27.086 43 HZ2 TRP 6 HZ2 TRP 6 2.924 -31.897 24.920 44 HZ3 TRP 6 HZ3 TRP 6 0.288 -29.894 27.612 45 HH2 TRP 6 HH2 TRP 6 2.476 -30.115 26.551 46 H MET 7 H MET 7 -4.974 -33.610 23.304 47 HA MET 7 HA MET 7 -3.359 -32.611 21.151 48 1HB MET 7 1HB MET 7 -5.845 -34.221 21.402 49 2HB MET 7 2HB MET 7 -5.590 -33.369 19.886 50 1HG MET 7 1HG MET 7 -3.509 -35.163 21.092 51 2HG MET 7 2HG MET 7 -4.773 -35.761 20.018 52 1HE MET 7 1HE MET 7 -4.123 -34.535 16.669 53 2HE MET 7 2HE MET 7 -4.683 -33.113 17.549 54 3HE MET 7 3HE MET 7 -5.356 -34.700 17.920 55 H THR 8 H THR 8 -6.470 -31.755 22.601 56 HA THR 8 HA THR 8 -7.217 -29.776 20.759 57 HB THR 8 HB THR 8 -8.669 -28.918 22.588 58 HG1 THR 8 HG1 THR 8 -7.450 -30.943 24.151 59 1HG2 THR 8 1HG2 THR 8 -8.641 -31.909 22.282 60 2HG2 THR 8 2HG2 THR 8 -9.553 -30.746 21.318 61 3HG2 THR 8 3HG2 THR 8 -9.947 -30.983 23.021 62 H THR 9 H THR 9 -4.993 -29.724 23.442 63 HA THR 9 HA THR 9 -4.812 -26.977 23.895 64 HB THR 9 HB THR 9 -2.362 -28.691 24.013 65 HG1 THR 9 HG1 THR 9 -4.572 -28.913 25.775 66 1HG2 THR 9 1HG2 THR 9 -1.650 -27.252 25.539 67 2HG2 THR 9 2HG2 THR 9 -3.182 -27.299 26.413 68 3HG2 THR 9 3HG2 THR 9 -2.983 -26.213 25.037 69 H PHE 10 H PHE 10 -3.138 -29.025 21.546 70 HA PHE 10 HA PHE 10 -1.526 -26.895 20.516 71 1HB PHE 10 1HB PHE 10 -1.667 -29.719 20.213 72 2HB PHE 10 2HB PHE 10 -1.806 -29.011 18.607 73 HD1 PHE 10 HD1 PHE 10 0.307 -29.148 21.635 74 HD2 PHE 10 HD2 PHE 10 0.060 -28.077 17.524 75 HE1 PHE 10 HE1 PHE 10 2.743 -28.813 21.580 76 HE2 PHE 10 HE2 PHE 10 2.496 -27.739 17.462 77 HZ PHE 10 HZ PHE 10 3.842 -28.108 19.492 78 H ARG 11 H ARG 11 -4.561 -28.429 19.579 79 HA ARG 11 HA ARG 11 -4.850 -27.135 17.087 80 1HB ARG 11 1HB ARG 11 -6.220 -29.088 18.434 81 2HB ARG 11 2HB ARG 11 -7.344 -27.738 18.520 82 1HG ARG 11 1HG ARG 11 -6.098 -28.544 15.920 83 2HG ARG 11 2HG ARG 11 -7.527 -29.368 16.548 84 1HD ARG 11 1HD ARG 11 -8.340 -26.843 16.841 85 2HD ARG 11 2HD ARG 11 -7.221 -26.613 15.498 86 HE ARG 11 HE ARG 11 -9.067 -28.786 15.119 87 1HH1 ARG 11 1HH1 ARG 11 -8.562 -25.354 14.737 88 2HH1 ARG 11 2HH1 ARG 11 -9.729 -25.196 13.468 89 1HH2 ARG 11 1HH2 ARG 11 -10.603 -28.580 13.449 90 2HH2 ARG 11 2HH2 ARG 11 -10.888 -27.028 12.737 91 H GLU 12 H GLU 12 -5.590 -26.181 20.366 92 HA GLU 12 HA GLU 12 -7.175 -23.907 19.601 93 1HB GLU 12 1HB GLU 12 -7.283 -25.249 21.807 94 2HB GLU 12 2HB GLU 12 -5.893 -24.288 22.294 95 1HG GLU 12 1HG GLU 12 -8.069 -22.682 21.222 96 2HG GLU 12 2HG GLU 12 -8.528 -23.617 22.644 97 HE2 GLU 12 HE2 GLU 12 -5.701 -20.858 23.116 98 H ASN 13 H ASN 13 -3.824 -24.543 20.358 99 HA ASN 13 HA ASN 13 -3.002 -21.869 20.761 100 1HB ASN 13 1HB ASN 13 -1.740 -24.041 21.319 101 2HB ASN 13 2HB ASN 13 -1.234 -24.031 19.632 102 1HD2 ASN 13 1HD2 ASN 13 0.281 -22.585 18.951 103 2HD2 ASN 13 2HD2 ASN 13 1.158 -21.549 20.019 104 H ILE 14 H ILE 14 -3.008 -23.954 17.888 105 HA ILE 14 HA ILE 14 -1.904 -21.953 16.172 106 HB ILE 14 HB ILE 14 -3.467 -24.392 15.332 107 1HG1 ILE 14 1HG1 ILE 14 -1.668 -25.038 16.877 108 2HG1 ILE 14 2HG1 ILE 14 -1.315 -25.566 15.235 109 1HG2 ILE 14 1HG2 ILE 14 -2.626 -22.360 13.791 110 2HG2 ILE 14 2HG2 ILE 14 -2.734 -24.027 13.229 111 3HG2 ILE 14 3HG2 ILE 14 -1.185 -23.376 13.765 112 1HD1 ILE 14 1HD1 ILE 14 0.293 -23.851 14.942 113 2HD1 ILE 14 2HD1 ILE 14 0.616 -24.609 16.502 114 3HD1 ILE 14 3HD1 ILE 14 -0.202 -23.047 16.433 115 H ALA 15 H ALA 15 -5.129 -22.914 17.113 116 HA ALA 15 HA ALA 15 -6.556 -21.643 15.037 117 1HB ALA 15 1HB ALA 15 -7.554 -23.330 16.505 118 2HB ALA 15 2HB ALA 15 -8.498 -21.840 16.493 119 3HB ALA 15 3HB ALA 15 -7.448 -22.208 17.862 120 H GLN 16 H GLN 16 -5.511 -20.529 18.232 121 HA GLN 16 HA GLN 16 -6.772 -17.988 18.054 122 1HB GLN 16 1HB GLN 16 -4.786 -19.273 19.857 123 2HB GLN 16 2HB GLN 16 -4.858 -17.517 19.859 124 1HG GLN 16 1HG GLN 16 -7.256 -19.279 20.281 125 2HG GLN 16 2HG GLN 16 -6.256 -18.651 21.591 126 1HE2 GLN 16 1HE2 GLN 16 -9.046 -18.173 20.039 127 2HE2 GLN 16 2HE2 GLN 16 -9.234 -16.468 20.241 128 H THR 17 H THR 17 -3.461 -19.111 17.456 129 HA THR 17 HA THR 17 -2.315 -16.623 16.884 130 HB THR 17 HB THR 17 -1.477 -19.155 15.496 131 HG1 THR 17 HG1 THR 17 -0.651 -19.928 17.325 132 1HG2 THR 17 1HG2 THR 17 0.226 -17.060 16.807 133 2HG2 THR 17 2HG2 THR 17 -0.245 -17.001 15.108 134 3HG2 THR 17 3HG2 THR 17 0.727 -18.345 15.709 135 H TRP 18 H TRP 18 -4.239 -18.787 14.928 136 HA TRP 18 HA TRP 18 -3.698 -17.349 12.476 137 1HB TRP 18 1HB TRP 18 -4.935 -19.866 13.222 138 2HB TRP 18 2HB TRP 18 -5.924 -18.989 12.058 139 HD1 TRP 18 HD1 TRP 18 -5.415 -20.564 10.016 140 HE1 TRP 18 HE1 TRP 18 -3.311 -20.990 8.595 141 HE3 TRP 18 HE3 TRP 18 -1.946 -18.271 12.991 142 HZ2 TRP 18 HZ2 TRP 18 -0.548 -20.427 8.718 143 HZ3 TRP 18 HZ3 TRP 18 0.405 -18.259 12.267 144 HH2 TRP 18 HH2 TRP 18 1.089 -19.316 10.175 145 H GLN 19 H GLN 19 -6.687 -18.053 14.299 146 HA GLN 19 HA GLN 19 -8.285 -16.175 12.979 147 1HB GLN 19 1HB GLN 19 -8.467 -17.675 15.543 148 2HB GLN 19 2HB GLN 19 -9.549 -16.308 15.323 149 1HG GLN 19 1HG GLN 19 -10.225 -17.370 13.130 150 2HG GLN 19 2HG GLN 19 -9.359 -18.806 13.673 151 1HE2 GLN 19 1HE2 GLN 19 -12.129 -18.655 13.094 152 2HE2 GLN 19 2HE2 GLN 19 -12.989 -18.992 14.554 153 H GLN 20 H GLN 20 -7.394 -15.843 16.404 154 HA GLN 20 HA GLN 20 -7.774 -13.063 16.455 155 1HB GLN 20 1HB GLN 20 -6.881 -15.125 18.285 156 2HB GLN 20 2HB GLN 20 -5.956 -13.645 18.500 157 1HG GLN 20 1HG GLN 20 -7.862 -13.678 19.980 158 2HG GLN 20 2HG GLN 20 -8.032 -12.390 18.788 159 1HE2 GLN 20 1HE2 GLN 20 -9.732 -12.403 17.420 160 2HE2 GLN 20 2HE2 GLN 20 -10.982 -13.596 17.434 161 HA PRO 21 HA PRO 21 -4.009 -11.597 14.640 162 1HB PRO 21 1HB PRO 21 -4.020 -9.056 15.536 163 2HB PRO 21 2HB PRO 21 -5.170 -9.629 14.321 164 1HG PRO 21 1HG PRO 21 -5.561 -9.243 17.264 165 2HG PRO 21 2HG PRO 21 -6.645 -8.820 15.925 166 1HD PRO 21 1HD PRO 21 -6.946 -11.064 17.446 167 2HD PRO 21 2HD PRO 21 -7.464 -10.959 15.752 168 H GLU 22 H GLU 22 -1.863 -11.158 15.145 169 HA GLU 22 HA GLU 22 -0.976 -10.465 17.755 170 1HB GLU 22 1HB GLU 22 -1.670 -13.068 17.659 171 2HB GLU 22 2HB GLU 22 -0.008 -13.186 17.098 172 1HG GLU 22 1HG GLU 22 0.845 -12.300 19.097 173 2HG GLU 22 2HG GLU 22 -0.739 -11.719 19.608 174 HE2 GLU 22 HE2 GLU 22 -0.008 -15.608 20.022 175 H HIS 23 H HIS 23 -0.566 -9.645 15.025 176 HA HIS 23 HA HIS 23 2.333 -10.125 14.795 177 1HB HIS 23 1HB HIS 23 0.300 -9.713 12.597 178 2HB HIS 23 2HB HIS 23 2.040 -9.678 12.338 179 HD1 HIS 23 HD1 HIS 23 -0.287 -12.131 14.105 180 HD2 HIS 23 HD2 HIS 23 2.801 -12.054 11.326 181 HE1 HIS 23 HE1 HIS 23 0.110 -14.533 13.475 182 HE2 HIS 23 HE2 HIS 23 1.925 -14.455 11.729 183 H TYR 24 H TYR 24 3.650 -8.372 14.378 184 HA TYR 24 HA TYR 24 2.348 -5.734 14.573 185 1HB TYR 24 1HB TYR 24 4.802 -6.850 15.852 186 2HB TYR 24 2HB TYR 24 4.783 -5.137 15.445 187 HD1 TYR 24 HD1 TYR 24 4.430 -7.175 18.099 188 HD2 TYR 24 HD2 TYR 24 2.204 -4.166 16.075 189 HE1 TYR 24 HE1 TYR 24 3.191 -6.704 20.171 190 HE2 TYR 24 HE2 TYR 24 0.961 -3.687 18.141 191 HH TYR 24 HH TYR 24 1.014 -5.726 20.835 192 H ASP 25 H ASP 25 2.278 -4.992 12.532 193 HA ASP 25 HA ASP 25 4.507 -5.414 10.721 194 1HB ASP 25 1HB ASP 25 1.710 -4.435 10.475 195 2HB ASP 25 2HB ASP 25 2.876 -3.840 9.296 196 HD2 ASP 25 HD2 ASP 25 2.352 -7.779 9.282 197 H LEU 26 H LEU 26 5.634 -3.706 9.672 198 HA LEU 26 HA LEU 26 5.545 -1.119 11.070 199 1HB LEU 26 1HB LEU 26 7.786 -3.000 10.785 200 2HB LEU 26 2HB LEU 26 8.177 -1.342 10.368 201 HG LEU 26 HG LEU 26 6.767 -1.842 12.945 202 1HD1 LEU 26 1HD1 LEU 26 8.941 -2.205 14.058 203 2HD1 LEU 26 2HD1 LEU 26 9.697 -2.368 12.473 204 3HD1 LEU 26 3HD1 LEU 26 8.482 -3.535 12.996 205 1HD2 LEU 26 1HD2 LEU 26 8.957 0.063 12.125 206 2HD2 LEU 26 2HD2 LEU 26 8.073 0.073 13.651 207 3HD2 LEU 26 3HD2 LEU 26 7.234 0.438 12.143 208 H TYR 27 H TYR 27 5.121 0.462 9.693 209 HA TYR 27 HA TYR 27 5.617 0.066 6.844 210 1HB TYR 27 1HB TYR 27 3.456 1.074 8.105 211 2HB TYR 27 2HB TYR 27 4.342 2.565 7.801 212 HD1 TYR 27 HD1 TYR 27 4.168 3.611 5.728 213 HD2 TYR 27 HD2 TYR 27 3.081 -0.488 6.073 214 HE1 TYR 27 HE1 TYR 27 3.323 3.647 3.419 215 HE2 TYR 27 HE2 TYR 27 2.234 -0.463 3.765 216 HH TYR 27 HH TYR 27 1.803 2.442 1.995 217 H ILE 28 H ILE 28 7.517 0.697 6.076 218 HA ILE 28 HA ILE 28 8.631 3.253 7.020 219 HB ILE 28 HB ILE 28 10.919 2.229 6.626 220 1HG1 ILE 28 1HG1 ILE 28 9.758 -0.443 7.190 221 2HG1 ILE 28 2HG1 ILE 28 9.589 0.152 5.542 222 1HG2 ILE 28 1HG2 ILE 28 11.102 1.850 8.844 223 2HG2 ILE 28 2HG2 ILE 28 9.739 0.731 8.875 224 3HG2 ILE 28 3HG2 ILE 28 9.451 2.471 8.864 225 1HD1 ILE 28 1HD1 ILE 28 11.564 -1.192 5.710 226 2HD1 ILE 28 2HD1 ILE 28 12.153 -0.232 7.067 227 3HD1 ILE 28 3HD1 ILE 28 12.034 0.490 5.462 228 HA PRO 29 HA PRO 29 8.995 4.386 2.778 229 1HB PRO 29 1HB PRO 29 11.328 5.797 2.766 230 2HB PRO 29 2HB PRO 29 9.816 6.425 3.431 231 1HG PRO 29 1HG PRO 29 12.142 5.188 4.853 232 2HG PRO 29 2HG PRO 29 11.188 6.615 5.299 233 1HD PRO 29 1HD PRO 29 10.798 4.207 6.453 234 2HD PRO 29 2HD PRO 29 9.465 5.345 6.169 235 H ALA 30 H ALA 30 10.204 4.051 0.828 236 HA ALA 30 HA ALA 30 11.420 1.541 0.632 237 1HB ALA 30 1HB ALA 30 12.115 3.507 -1.451 238 2HB ALA 30 2HB ALA 30 10.393 3.271 -1.155 239 3HB ALA 30 3HB ALA 30 11.407 1.897 -1.596 240 H ILE 31 H ILE 31 13.579 0.940 0.147 241 HA ILE 31 HA ILE 31 15.740 2.793 0.295 242 HB ILE 31 HB ILE 31 15.158 2.729 2.682 243 1HG1 ILE 31 1HG1 ILE 31 17.416 1.947 3.522 244 2HG1 ILE 31 2HG1 ILE 31 17.746 1.387 1.886 245 1HG2 ILE 31 1HG2 ILE 31 14.794 0.858 3.878 246 2HG2 ILE 31 2HG2 ILE 31 16.054 -0.050 3.043 247 3HG2 ILE 31 3HG2 ILE 31 14.469 0.151 2.296 248 1HD1 ILE 31 1HD1 ILE 31 17.359 3.727 1.104 249 2HD1 ILE 31 2HD1 ILE 31 18.763 3.513 2.150 250 3HD1 ILE 31 3HD1 ILE 31 17.278 4.212 2.797 251 H THR 32 H THR 32 17.222 1.961 -1.009 252 HA THR 32 HA THR 32 17.643 -0.950 -1.004 253 HB THR 32 HB THR 32 18.227 -0.511 -3.533 254 HG1 THR 32 HG1 THR 32 17.772 1.802 -3.215 255 1HG2 THR 32 1HG2 THR 32 16.308 -1.521 -4.108 256 2HG2 THR 32 2HG2 THR 32 15.309 -0.394 -3.189 257 3HG2 THR 32 3HG2 THR 32 16.139 -1.712 -2.363 258 H TRP 33 H TRP 33 19.751 -1.313 -2.512 259 HA TRP 33 HA TRP 33 21.804 0.543 -1.501 260 1HB TRP 33 1HB TRP 33 21.660 -2.428 -1.421 261 2HB TRP 33 2HB TRP 33 23.236 -1.703 -1.719 262 HD1 TRP 33 HD1 TRP 33 23.984 0.202 0.235 263 HE1 TRP 33 HE1 TRP 33 23.669 0.038 2.784 264 HE3 TRP 33 HE3 TRP 33 20.293 -3.334 0.371 265 HZ2 TRP 33 HZ2 TRP 33 22.068 -1.401 4.611 266 HZ3 TRP 33 HZ3 TRP 33 19.425 -4.048 2.561 267 HH2 TRP 33 HH2 TRP 33 20.296 -3.102 4.635 268 H HIS 34 H HIS 34 20.963 -1.788 -4.033 269 HA HIS 34 HA HIS 34 23.139 -1.289 -5.732 270 1HB HIS 34 1HB HIS 34 21.041 -3.021 -5.769 271 2HB HIS 34 2HB HIS 34 20.565 -1.903 -7.043 272 HD1 HIS 34 HD1 HIS 34 21.757 -2.092 -9.255 273 HD2 HIS 34 HD2 HIS 34 23.522 -4.382 -6.272 274 HE1 HIS 34 HE1 HIS 34 23.466 -3.519 -10.426 275 HE2 HIS 34 HE2 HIS 34 24.578 -4.837 -8.589 276 H ALA 35 H ALA 35 19.935 0.210 -5.548 277 HA ALA 35 HA ALA 35 20.319 1.925 -7.786 278 1HB ALA 35 1HB ALA 35 18.135 1.174 -6.516 279 2HB ALA 35 2HB ALA 35 18.217 2.719 -7.360 280 3HB ALA 35 3HB ALA 35 18.427 2.659 -5.610 281 H ARG 36 H ARG 36 22.128 3.173 -7.666 282 HA ARG 36 HA ARG 36 22.130 5.245 -5.594 283 1HB ARG 36 1HB ARG 36 24.651 5.046 -5.511 284 2HB ARG 36 2HB ARG 36 23.757 3.737 -4.751 285 1HG ARG 36 1HG ARG 36 24.054 2.741 -7.240 286 2HG ARG 36 2HG ARG 36 25.521 3.712 -7.100 287 1HD ARG 36 1HD ARG 36 26.386 2.416 -5.438 288 2HD ARG 36 2HD ARG 36 24.800 1.984 -4.801 289 HE ARG 36 HE ARG 36 25.359 0.849 -7.382 290 1HH1 ARG 36 1HH1 ARG 36 25.718 0.433 -3.936 291 2HH1 ARG 36 2HH1 ARG 36 25.884 -1.287 -4.034 292 1HH2 ARG 36 1HH2 ARG 36 25.577 -1.415 -7.513 293 2HH2 ARG 36 2HH2 ARG 36 25.804 -2.336 -6.065 294 H PHE 37 H PHE 37 23.682 4.151 -8.606 295 HA PHE 37 HA PHE 37 23.768 6.965 -9.476 296 1HB PHE 37 1HB PHE 37 25.891 5.297 -9.260 297 2HB PHE 37 2HB PHE 37 25.414 4.978 -10.923 298 HD1 PHE 37 HD1 PHE 37 25.884 7.918 -8.671 299 HD2 PHE 37 HD2 PHE 37 26.428 6.238 -12.542 300 HE1 PHE 37 HE1 PHE 37 27.046 9.963 -9.390 301 HE2 PHE 37 HE2 PHE 37 27.593 8.279 -13.268 302 HZ PHE 37 HZ PHE 37 27.905 10.145 -11.692 303 H ALA 38 H ALA 38 21.527 6.708 -10.146 304 HA ALA 38 HA ALA 38 21.124 5.013 -12.502 305 1HB ALA 38 1HB ALA 38 18.693 6.050 -12.085 306 2HB ALA 38 2HB ALA 38 19.347 6.189 -10.453 307 3HB ALA 38 3HB ALA 38 19.283 4.615 -11.247 308 H TYR 39 H TYR 39 19.414 6.158 -14.064 309 HA TYR 39 HA TYR 39 20.838 8.207 -15.380 310 1HB TYR 39 1HB TYR 39 18.877 8.336 -16.869 311 2HB TYR 39 2HB TYR 39 19.376 6.671 -16.591 312 HD1 TYR 39 HD1 TYR 39 18.001 5.177 -15.215 313 HD2 TYR 39 HD2 TYR 39 16.756 9.154 -16.070 314 HE1 TYR 39 HE1 TYR 39 15.718 4.610 -14.497 315 HE2 TYR 39 HE2 TYR 39 14.471 8.599 -15.354 316 HH TYR 39 HH TYR 39 13.448 5.381 -14.799 317 H ASP 40 H ASP 40 20.977 10.276 -14.852 318 HA ASP 40 HA ASP 40 18.687 11.541 -13.494 319 1HB ASP 40 1HB ASP 40 21.096 11.178 -12.340 320 2HB ASP 40 2HB ASP 40 21.381 12.725 -13.134 321 HD2 ASP 40 HD2 ASP 40 18.371 13.712 -11.116 322 H LYS 41 H LYS 41 18.151 13.652 -14.075 323 HA LYS 41 HA LYS 41 18.682 14.330 -16.795 324 1HB LYS 41 1HB LYS 41 17.391 16.126 -14.746 325 2HB LYS 41 2HB LYS 41 17.153 16.126 -16.488 326 1HG LYS 41 1HG LYS 41 16.122 13.868 -16.279 327 2HG LYS 41 2HG LYS 41 16.227 14.041 -14.526 328 1HD LYS 41 1HD LYS 41 14.137 14.873 -14.774 329 2HD LYS 41 2HD LYS 41 15.014 16.360 -15.140 330 1HE LYS 41 1HE LYS 41 14.669 16.151 -17.425 331 2HE LYS 41 2HE LYS 41 14.355 14.419 -17.319 332 1HZ LYS 41 1HZ LYS 41 12.299 15.499 -17.717 333 2HZ LYS 41 2HZ LYS 41 12.560 16.628 -16.486 334 3HZ LYS 41 3HZ LYS 41 12.276 15.006 -16.098 335 H GLU 42 H GLU 42 19.047 16.909 -17.093 336 HA GLU 42 HA GLU 42 21.780 17.307 -16.254 337 1HB GLU 42 1HB GLU 42 19.916 18.856 -18.046 338 2HB GLU 42 2HB GLU 42 21.526 19.434 -17.639 339 1HG GLU 42 1HG GLU 42 22.573 17.800 -18.860 340 2HG GLU 42 2HG GLU 42 21.209 16.688 -18.743 341 HE2 GLU 42 HE2 GLU 42 20.644 17.673 -22.009 342 H LYS 43 H LYS 43 21.349 17.513 -13.963 343 HA LYS 43 HA LYS 43 21.083 20.259 -13.182 344 1HB LYS 43 1HB LYS 43 18.773 18.539 -13.055 345 2HB LYS 43 2HB LYS 43 19.246 19.030 -11.434 346 1HG LYS 43 1HG LYS 43 18.890 21.277 -11.871 347 2HG LYS 43 2HG LYS 43 18.996 21.055 -13.618 348 1HD LYS 43 1HD LYS 43 16.740 21.217 -13.461 349 2HD LYS 43 2HD LYS 43 16.882 19.492 -13.111 350 1HE LYS 43 1HE LYS 43 16.916 20.024 -10.698 351 2HE LYS 43 2HE LYS 43 16.678 21.726 -11.094 352 1HZ LYS 43 1HZ LYS 43 14.567 21.164 -12.114 353 2HZ LYS 43 2HZ LYS 43 14.597 20.639 -10.506 354 3HZ LYS 43 3HZ LYS 43 14.799 19.524 -11.762 355 H THR 44 H THR 44 21.404 20.527 -10.805 356 HA THR 44 HA THR 44 23.507 18.765 -9.934 357 HB THR 44 HB THR 44 22.431 20.822 -8.087 358 HG1 THR 44 HG1 THR 44 23.158 22.506 -9.300 359 1HG2 THR 44 1HG2 THR 44 25.178 21.127 -8.834 360 2HG2 THR 44 2HG2 THR 44 24.845 19.453 -8.387 361 3HG2 THR 44 3HG2 THR 44 24.477 20.758 -7.259 362 H ASP 45 H ASP 45 23.561 17.843 -7.743 363 HA ASP 45 HA ASP 45 21.010 16.565 -7.138 364 1HB ASP 45 1HB ASP 45 23.237 15.312 -7.416 365 2HB ASP 45 2HB ASP 45 23.652 15.949 -5.828 366 HD2 ASP 45 HD2 ASP 45 21.193 12.913 -6.065 367 H ARG 46 H ARG 46 19.830 16.968 -5.368 368 HA ARG 46 HA ARG 46 21.007 18.697 -3.291 369 1HB ARG 46 1HB ARG 46 19.146 19.615 -4.911 370 2HB ARG 46 2HB ARG 46 18.069 18.720 -3.847 371 1HG ARG 46 1HG ARG 46 19.783 20.181 -2.171 372 2HG ARG 46 2HG ARG 46 19.287 21.280 -3.460 373 1HD ARG 46 1HD ARG 46 17.219 19.580 -2.156 374 2HD ARG 46 2HD ARG 46 17.839 20.977 -1.276 375 HE ARG 46 HE ARG 46 17.054 21.622 -3.950 376 1HH1 ARG 46 1HH1 ARG 46 15.867 21.119 -0.706 377 2HH1 ARG 46 2HH1 ARG 46 14.467 22.113 -0.930 378 1HH2 ARG 46 1HH2 ARG 46 15.214 22.931 -4.246 379 2HH2 ARG 46 2HH2 ARG 46 14.096 23.142 -2.939 380 H TYR 47 H TYR 47 20.366 18.333 -1.145 381 HA TYR 47 HA TYR 47 19.262 15.647 -0.683 382 1HB TYR 47 1HB TYR 47 21.093 17.382 0.978 383 2HB TYR 47 2HB TYR 47 20.333 15.923 1.605 384 HD1 TYR 47 HD1 TYR 47 21.674 14.055 1.626 385 HD2 TYR 47 HD2 TYR 47 22.230 16.926 -1.464 386 HE1 TYR 47 HE1 TYR 47 23.511 12.702 0.709 387 HE2 TYR 47 HE2 TYR 47 24.068 15.581 -2.391 388 HH TYR 47 HH TYR 47 24.650 12.389 -1.485 389 H ASN 48 H ASN 48 17.088 16.472 -0.933 390 HA ASN 48 HA ASN 48 16.025 18.488 0.748 391 1HB ASN 48 1HB ASN 48 13.828 17.654 0.018 392 2HB ASN 48 2HB ASN 48 14.931 17.837 -1.343 393 1HD2 ASN 48 1HD2 ASN 48 13.217 15.607 0.680 394 2HD2 ASN 48 2HD2 ASN 48 13.472 14.205 -0.297 395 H GLU 49 H GLU 49 14.912 18.369 2.666 396 HA GLU 49 HA GLU 49 14.976 15.765 4.048 397 1HB GLU 49 1HB GLU 49 15.909 18.441 4.896 398 2HB GLU 49 2HB GLU 49 15.024 17.523 6.107 399 1HG GLU 49 1HG GLU 49 17.319 16.327 4.598 400 2HG GLU 49 2HG GLU 49 17.563 17.299 6.047 401 HE2 GLU 49 HE2 GLU 49 16.317 14.786 8.103 402 H ARG 50 H ARG 50 13.047 15.024 4.609 403 HA ARG 50 HA ARG 50 10.890 16.952 5.150 404 1HB ARG 50 1HB ARG 50 10.926 14.629 3.292 405 2HB ARG 50 2HB ARG 50 9.446 14.922 4.194 406 1HG ARG 50 1HG ARG 50 9.484 17.267 3.324 407 2HG ARG 50 2HG ARG 50 10.826 16.789 2.282 408 1HD ARG 50 1HD ARG 50 9.435 15.114 1.214 409 2HD ARG 50 2HD ARG 50 8.102 15.493 2.304 410 HE ARG 50 HE ARG 50 7.611 17.325 1.019 411 1HH1 ARG 50 1HH1 ARG 50 10.781 16.149 0.156 412 2HH1 ARG 50 2HH1 ARG 50 10.932 17.193 -1.218 413 1HH2 ARG 50 1HH2 ARG 50 7.807 18.698 -0.788 414 2HH2 ARG 50 2HH2 ARG 50 9.243 18.639 -1.754 415 HA PRO 51 HA PRO 51 10.345 14.682 8.900 416 1HB PRO 51 1HB PRO 51 7.769 15.277 9.474 417 2HB PRO 51 2HB PRO 51 9.072 16.464 9.612 418 1HG PRO 51 1HG PRO 51 7.084 16.081 7.405 419 2HG PRO 51 2HG PRO 51 7.647 17.586 8.154 420 1HD PRO 51 1HD PRO 51 8.596 16.682 5.777 421 2HD PRO 51 2HD PRO 51 9.581 17.630 6.907 422 H TRP 52 H TRP 52 9.788 12.658 9.501 423 HA TRP 52 HA TRP 52 7.491 11.314 8.404 424 1HB TRP 52 1HB TRP 52 9.677 11.138 6.827 425 2HB TRP 52 2HB TRP 52 9.973 9.776 7.903 426 HD1 TRP 52 HD1 TRP 52 7.596 8.121 8.139 427 HE1 TRP 52 HE1 TRP 52 6.196 7.224 6.175 428 HE3 TRP 52 HE3 TRP 52 9.014 11.462 4.539 429 HZ2 TRP 52 HZ2 TRP 52 5.752 7.850 3.457 430 HZ3 TRP 52 HZ3 TRP 52 8.056 11.243 2.283 431 HH2 TRP 52 HH2 TRP 52 6.459 9.473 1.756 432 H GLY 53 H GLY 53 6.662 10.192 10.031 433 1HA GLY 53 1HA GLY 53 8.350 9.505 12.306 434 2HA GLY 53 2HA GLY 53 6.597 9.417 12.245 435 H GLY 54 H GLY 54 5.606 7.605 11.198 436 1HA GLY 54 1HA GLY 54 6.751 5.474 9.952 437 2HA GLY 54 2HA GLY 54 7.076 5.169 11.651 438 H GLY 55 H GLY 55 5.571 3.407 10.155 439 1HA GLY 55 1HA GLY 55 2.868 3.841 11.273 440 2HA GLY 55 2HA GLY 55 3.133 3.080 9.711 441 H PHE 56 H PHE 56 1.746 2.036 12.056 442 HA PHE 56 HA PHE 56 3.095 -0.527 12.169 443 1HB PHE 56 1HB PHE 56 3.068 -0.663 14.612 444 2HB PHE 56 2HB PHE 56 4.069 0.684 14.077 445 HD1 PHE 56 HD1 PHE 56 1.051 -0.306 15.844 446 HD2 PHE 56 HD2 PHE 56 3.314 2.988 14.382 447 HE1 PHE 56 HE1 PHE 56 -0.242 1.215 17.281 448 HE2 PHE 56 HE2 PHE 56 2.027 4.515 15.819 449 HZ PHE 56 HZ PHE 56 0.245 3.630 17.271 450 H GLY 57 H GLY 57 1.661 -2.151 12.125 451 1HA GLY 57 1HA GLY 57 -0.935 -1.937 13.348 452 2HA GLY 57 2HA GLY 57 -0.996 -1.867 11.593 453 H LEU 58 H LEU 58 -2.154 -3.807 11.463 454 HA LEU 58 HA LEU 58 -0.472 -6.184 11.736 455 1HB LEU 58 1HB LEU 58 -3.330 -6.129 12.696 456 2HB LEU 58 2HB LEU 58 -2.205 -7.469 12.799 457 HG LEU 58 HG LEU 58 -0.808 -5.722 14.231 458 1HD1 LEU 58 1HD1 LEU 58 -2.922 -4.143 13.727 459 2HD1 LEU 58 2HD1 LEU 58 -1.936 -4.018 15.185 460 3HD1 LEU 58 3HD1 LEU 58 -3.460 -4.904 15.226 461 1HD2 LEU 58 1HD2 LEU 58 -1.345 -7.018 16.004 462 2HD2 LEU 58 2HD2 LEU 58 -2.141 -7.988 14.764 463 3HD2 LEU 58 3HD2 LEU 58 -3.081 -6.857 15.737 464 H SER 59 H SER 59 -1.778 -8.139 10.761 465 HA SER 59 HA SER 59 -3.291 -7.247 8.410 466 1HB SER 59 1HB SER 59 -0.923 -9.131 8.381 467 2HB SER 59 2HB SER 59 -2.015 -8.892 7.018 468 HG SER 59 HG SER 59 0.041 -7.334 7.892 469 H ARG 60 H ARG 60 -4.495 -9.001 7.357 470 HA ARG 60 HA ARG 60 -5.024 -11.298 9.102 471 1HB ARG 60 1HB ARG 60 -6.916 -9.162 8.298 472 2HB ARG 60 2HB ARG 60 -7.525 -10.810 8.230 473 1HG ARG 60 1HG ARG 60 -6.920 -11.126 10.581 474 2HG ARG 60 2HG ARG 60 -6.332 -9.463 10.645 475 1HD ARG 60 1HD ARG 60 -8.734 -8.905 9.764 476 2HD ARG 60 2HD ARG 60 -9.128 -10.485 10.440 477 HE ARG 60 HE ARG 60 -8.533 -8.075 11.891 478 1HH1 ARG 60 1HH1 ARG 60 -8.584 -11.562 12.030 479 2HH1 ARG 60 2HH1 ARG 60 -8.711 -11.616 13.755 480 1HH2 ARG 60 1HH2 ARG 60 -8.701 -8.145 14.161 481 2HH2 ARG 60 2HH2 ARG 60 -8.781 -9.677 14.966 482 H TRP 61 H TRP 61 -6.252 -13.025 7.997 483 HA TRP 61 HA TRP 61 -5.640 -13.065 5.114 484 1HB TRP 61 1HB TRP 61 -4.305 -14.643 6.533 485 2HB TRP 61 2HB TRP 61 -5.809 -15.450 6.965 486 HD1 TRP 61 HD1 TRP 61 -6.372 -17.472 5.510 487 HE1 TRP 61 HE1 TRP 61 -5.721 -18.298 3.161 488 HE3 TRP 61 HE3 TRP 61 -3.540 -13.491 4.005 489 HZ2 TRP 61 HZ2 TRP 61 -4.208 -17.383 0.960 490 HZ3 TRP 61 HZ3 TRP 61 -2.526 -13.544 1.764 491 HH2 TRP 61 HH2 TRP 61 -2.853 -15.451 0.275 492 H ASP 62 H ASP 62 -7.239 -13.518 3.714 493 HA ASP 62 HA ASP 62 -9.902 -14.015 4.839 494 1HB ASP 62 1HB ASP 62 -8.884 -12.435 2.604 495 2HB ASP 62 2HB ASP 62 -10.253 -13.447 2.150 496 HD2 ASP 62 HD2 ASP 62 -12.451 -11.416 3.812 497 H GLU 63 H GLU 63 -10.872 -15.908 4.577 498 HA GLU 63 HA GLU 63 -9.620 -18.136 3.461 499 1HB GLU 63 1HB GLU 63 -12.581 -17.748 3.920 500 2HB GLU 63 2HB GLU 63 -11.746 -19.288 3.758 501 1HG GLU 63 1HG GLU 63 -10.968 -19.245 5.870 502 2HG GLU 63 2HG GLU 63 -10.742 -17.496 5.867 503 HE2 GLU 63 HE2 GLU 63 -14.490 -18.596 6.570 504 H LYS 64 H LYS 64 -11.403 -15.634 1.930 505 HA LYS 64 HA LYS 64 -11.991 -17.241 -0.426 506 1HB LYS 64 1HB LYS 64 -13.513 -15.411 0.611 507 2HB LYS 64 2HB LYS 64 -12.447 -14.282 -0.213 508 1HG LYS 64 1HG LYS 64 -12.940 -15.602 -2.329 509 2HG LYS 64 2HG LYS 64 -14.243 -16.364 -1.413 510 1HD LYS 64 1HD LYS 64 -14.693 -13.744 -0.872 511 2HD LYS 64 2HD LYS 64 -14.032 -13.639 -2.505 512 1HE LYS 64 1HE LYS 64 -15.732 -14.990 -3.398 513 2HE LYS 64 2HE LYS 64 -16.219 -15.572 -1.807 514 1HZ LYS 64 1HZ LYS 64 -17.742 -13.906 -2.792 515 2HZ LYS 64 2HZ LYS 64 -16.506 -12.756 -2.696 516 3HZ LYS 64 3HZ LYS 64 -17.129 -13.448 -1.283 517 H GLY 65 H GLY 65 -9.196 -16.593 0.409 518 1HA GLY 65 1HA GLY 65 -7.224 -16.155 -0.683 519 2HA GLY 65 2HA GLY 65 -8.155 -16.059 -2.171 520 H ASN 66 H ASN 66 -8.159 -14.097 0.804 521 HA ASN 66 HA ASN 66 -7.400 -11.774 -0.829 522 1HB ASN 66 1HB ASN 66 -9.894 -12.205 0.609 523 2HB ASN 66 2HB ASN 66 -9.075 -10.740 1.140 524 1HD2 ASN 66 1HD2 ASN 66 -11.334 -11.816 -0.890 525 2HD2 ASN 66 2HD2 ASN 66 -11.206 -10.650 -2.157 526 H TRP 67 H TRP 67 -6.385 -10.050 0.335 527 HA TRP 67 HA TRP 67 -5.261 -10.882 2.929 528 1HB TRP 67 1HB TRP 67 -3.636 -10.985 1.010 529 2HB TRP 67 2HB TRP 67 -3.823 -9.242 0.836 530 HD1 TRP 67 HD1 TRP 67 -3.106 -11.506 3.922 531 HE1 TRP 67 HE1 TRP 67 -1.117 -10.485 5.196 532 HE3 TRP 67 HE3 TRP 67 -2.155 -7.513 0.874 533 HZ2 TRP 67 HZ2 TRP 67 0.625 -8.279 4.942 534 HZ3 TRP 67 HZ3 TRP 67 -0.309 -5.996 1.461 535 HH2 TRP 67 HH2 TRP 67 1.051 -6.371 3.453 536 H HIS 68 H HIS 68 -5.973 -9.610 4.498 537 HA HIS 68 HA HIS 68 -6.792 -6.872 3.880 538 1HB HIS 68 1HB HIS 68 -8.232 -8.546 5.205 539 2HB HIS 68 2HB HIS 68 -7.121 -8.249 6.538 540 HD1 HIS 68 HD1 HIS 68 -10.302 -7.291 5.688 541 HD2 HIS 68 HD2 HIS 68 -6.906 -5.085 6.619 542 HE1 HIS 68 HE1 HIS 68 -11.145 -5.040 6.425 543 HE2 HIS 68 HE2 HIS 68 -9.069 -3.694 6.900 544 H GLY 69 H GLY 69 -5.581 -5.169 4.388 545 1HA GLY 69 1HA GLY 69 -3.501 -5.504 6.458 546 2HA GLY 69 2HA GLY 69 -3.148 -4.722 4.924 547 H LEU 70 H LEU 70 -4.058 -4.237 8.102 548 HA LEU 70 HA LEU 70 -4.836 -1.464 7.497 549 1HB LEU 70 1HB LEU 70 -6.296 -1.541 9.522 550 2HB LEU 70 2HB LEU 70 -6.848 -2.529 8.183 551 HG LEU 70 HG LEU 70 -5.490 -4.403 9.516 552 1HD1 LEU 70 1HD1 LEU 70 -5.196 -4.073 11.723 553 2HD1 LEU 70 2HD1 LEU 70 -6.640 -3.071 11.875 554 3HD1 LEU 70 3HD1 LEU 70 -5.145 -2.374 11.252 555 1HD2 LEU 70 1HD2 LEU 70 -8.038 -4.034 8.901 556 2HD2 LEU 70 2HD2 LEU 70 -8.163 -3.758 10.638 557 3HD2 LEU 70 3HD2 LEU 70 -7.527 -5.288 10.032 558 H TYR 71 H TYR 71 -3.672 0.045 8.512 559 HA TYR 71 HA TYR 71 -2.418 -0.487 11.065 560 1HB TYR 71 1HB TYR 71 -0.152 0.210 10.192 561 2HB TYR 71 2HB TYR 71 -0.695 -1.385 9.681 562 HD1 TYR 71 HD1 TYR 71 -0.455 -1.942 7.454 563 HD2 TYR 71 HD2 TYR 71 -0.806 2.165 8.510 564 HE1 TYR 71 HE1 TYR 71 -0.099 -1.313 5.104 565 HE2 TYR 71 HE2 TYR 71 -0.452 2.806 6.163 566 HH TYR 71 HH TYR 71 -0.663 0.650 3.617 567 H ALA 72 H ALA 72 -1.690 1.400 12.125 568 HA ALA 72 HA ALA 72 -2.779 3.876 10.969 569 1HB ALA 72 1HB ALA 72 -3.785 3.107 13.094 570 2HB ALA 72 2HB ALA 72 -3.027 4.694 13.224 571 3HB ALA 72 3HB ALA 72 -2.209 3.271 13.868 572 H MET 73 H MET 73 -1.416 5.420 10.366 573 HA MET 73 HA MET 73 1.404 5.174 11.060 574 1HB MET 73 1HB MET 73 0.011 7.018 9.111 575 2HB MET 73 2HB MET 73 1.752 6.892 9.323 576 1HG MET 73 1HG MET 73 1.682 4.571 8.585 577 2HG MET 73 2HG MET 73 -0.067 4.684 8.386 578 1HE MET 73 1HE MET 73 -1.245 5.438 6.814 579 2HE MET 73 2HE MET 73 -0.586 4.888 5.273 580 3HE MET 73 3HE MET 73 -0.865 6.608 5.550 581 H ALA 74 H ALA 74 2.570 7.359 11.358 582 HA ALA 74 HA ALA 74 1.023 9.334 12.823 583 1HB ALA 74 1HB ALA 74 3.373 8.104 14.223 584 2HB ALA 74 2HB ALA 74 1.744 7.459 14.417 585 3HB ALA 74 3HB ALA 74 2.095 9.122 14.887 586 H PHE 75 H PHE 75 1.901 11.342 12.724 587 HA PHE 75 HA PHE 75 4.594 11.576 11.552 588 1HB PHE 75 1HB PHE 75 2.034 12.675 10.655 589 2HB PHE 75 2HB PHE 75 3.294 13.897 10.809 590 HD1 PHE 75 HD1 PHE 75 3.956 14.417 8.661 591 HD2 PHE 75 HD2 PHE 75 3.508 10.331 9.763 592 HE1 PHE 75 HE1 PHE 75 4.886 13.733 6.488 593 HE2 PHE 75 HE2 PHE 75 4.438 9.640 7.592 594 HZ PHE 75 HZ PHE 75 5.129 11.342 5.951 595 H LYS 76 H LYS 76 5.822 13.421 12.158 596 HA LYS 76 HA LYS 76 5.031 14.506 14.774 597 1HB LYS 76 1HB LYS 76 7.250 13.174 14.320 598 2HB LYS 76 2HB LYS 76 7.812 14.715 13.685 599 1HG LYS 76 1HG LYS 76 6.522 14.796 16.335 600 2HG LYS 76 2HG LYS 76 8.082 13.976 16.246 601 1HD LYS 76 1HD LYS 76 7.925 16.563 14.846 602 2HD LYS 76 2HD LYS 76 7.785 16.641 16.604 603 1HE LYS 76 1HE LYS 76 10.031 16.666 16.552 604 2HE LYS 76 2HE LYS 76 9.866 14.925 16.324 605 1HZ LYS 76 1HZ LYS 76 10.001 15.252 13.940 606 2HZ LYS 76 2HZ LYS 76 11.364 15.906 14.698 607 3HZ LYS 76 3HZ LYS 76 10.133 16.927 14.146 608 H ASP 77 H ASP 77 4.117 16.444 14.610 609 HA ASP 77 HA ASP 77 4.348 18.189 12.434 610 1HB ASP 77 1HB ASP 77 2.678 18.076 14.521 611 2HB ASP 77 2HB ASP 77 3.754 19.337 15.115 612 HD2 ASP 77 HD2 ASP 77 1.068 20.329 12.534 613 H SER 78 H SER 78 5.236 20.402 12.470 614 HA SER 78 HA SER 78 7.956 20.351 13.523 615 1HB SER 78 1HB SER 78 6.809 22.490 11.739 616 2HB SER 78 2HB SER 78 8.492 21.993 11.919 617 HG SER 78 HG SER 78 8.051 20.127 10.807 618 H TRP 79 H TRP 79 4.926 21.747 14.251 619 HA TRP 79 HA TRP 79 6.112 23.264 16.414 620 1HB TRP 79 1HB TRP 79 4.819 25.331 15.801 621 2HB TRP 79 2HB TRP 79 6.160 24.962 14.722 622 HD1 TRP 79 HD1 TRP 79 5.144 23.246 12.527 623 HE1 TRP 79 HE1 TRP 79 3.164 23.869 11.005 624 HE3 TRP 79 HE3 TRP 79 2.841 26.667 15.549 625 HZ2 TRP 79 HZ2 TRP 79 0.923 25.584 11.076 626 HZ3 TRP 79 HZ3 TRP 79 0.784 27.753 14.747 627 HH2 TRP 79 HH2 TRP 79 -0.154 27.222 12.556 628 H ASN 80 H ASN 80 4.392 20.934 16.124 629 HA ASN 80 HA ASN 80 2.313 21.758 17.959 630 1HB ASN 80 1HB ASN 80 1.749 21.339 15.172 631 2HB ASN 80 2HB ASN 80 0.945 20.092 16.121 632 1HD2 ASN 80 1HD2 ASN 80 0.437 22.943 14.749 633 2HD2 ASN 80 2HD2 ASN 80 -0.732 23.621 15.826 634 H LYS 81 H LYS 81 0.801 19.458 17.985 635 HA LYS 81 HA LYS 81 2.715 17.570 19.111 636 1HB LYS 81 1HB LYS 81 0.786 16.509 20.148 637 2HB LYS 81 2HB LYS 81 0.760 18.242 20.452 638 1HG LYS 81 1HG LYS 81 -0.765 18.263 18.311 639 2HG LYS 81 2HG LYS 81 -1.041 16.581 18.770 640 1HD LYS 81 1HD LYS 81 -1.264 18.711 20.848 641 2HD LYS 81 2HD LYS 81 -2.582 18.497 19.694 642 1HE LYS 81 1HE LYS 81 -1.431 16.313 21.427 643 2HE LYS 81 2HE LYS 81 -2.899 17.219 21.790 644 1HZ LYS 81 1HZ LYS 81 -2.442 15.142 19.790 645 2HZ LYS 81 2HZ LYS 81 -3.497 16.394 19.366 646 3HZ LYS 81 3HZ LYS 81 -3.811 15.452 20.736 647 H TRP 82 H TRP 82 2.354 15.224 18.754 648 HA TRP 82 HA TRP 82 2.521 14.576 16.035 649 1HB TRP 82 1HB TRP 82 1.783 12.628 18.218 650 2HB TRP 82 2HB TRP 82 2.646 12.296 16.720 651 HD1 TRP 82 HD1 TRP 82 4.626 14.945 17.197 652 HE1 TRP 82 HE1 TRP 82 6.587 14.627 18.835 653 HE3 TRP 82 HE3 TRP 82 2.894 10.873 19.758 654 HZ2 TRP 82 HZ2 TRP 82 7.304 12.882 20.934 655 HZ3 TRP 82 HZ3 TRP 82 4.279 9.941 21.566 656 HH2 TRP 82 HH2 TRP 82 6.438 10.925 22.140 657 H GLU 83 H GLU 83 1.097 13.687 14.582 658 HA GLU 83 HA GLU 83 -1.735 13.703 15.393 659 1HB GLU 83 1HB GLU 83 -0.352 14.665 12.935 660 2HB GLU 83 2HB GLU 83 -1.966 13.992 12.759 661 1HG GLU 83 1HG GLU 83 -2.519 15.632 14.730 662 2HG GLU 83 2HG GLU 83 -1.082 16.470 14.143 663 HE2 GLU 83 HE2 GLU 83 -2.929 17.915 11.663 664 HA PRO 84 HA PRO 84 -1.484 9.369 14.301 665 1HB PRO 84 1HB PRO 84 -4.009 8.690 14.925 666 2HB PRO 84 2HB PRO 84 -2.804 9.043 16.170 667 1HG PRO 84 1HG PRO 84 -4.974 10.795 15.081 668 2HG PRO 84 2HG PRO 84 -4.459 10.566 16.763 669 1HD PRO 84 1HD PRO 84 -3.693 12.691 15.223 670 2HD PRO 84 2HD PRO 84 -2.720 12.045 16.560 671 H ILE 85 H ILE 85 -2.335 7.944 12.713 672 HA ILE 85 HA ILE 85 -4.236 9.060 10.792 673 HB ILE 85 HB ILE 85 -1.596 7.908 9.893 674 1HG1 ILE 85 1HG1 ILE 85 -1.436 10.447 9.080 675 2HG1 ILE 85 2HG1 ILE 85 -2.432 10.701 10.510 676 1HG2 ILE 85 1HG2 ILE 85 -2.557 9.307 7.803 677 2HG2 ILE 85 2HG2 ILE 85 -4.067 8.786 8.551 678 3HG2 ILE 85 3HG2 ILE 85 -2.867 7.589 8.059 679 1HD1 ILE 85 1HD1 ILE 85 -0.134 11.013 11.088 680 2HD1 ILE 85 2HD1 ILE 85 0.298 9.445 10.405 681 3HD1 ILE 85 3HD1 ILE 85 -0.710 9.530 11.849 682 H ALA 86 H ALA 86 -5.433 7.540 9.695 683 HA ALA 86 HA ALA 86 -4.986 4.739 10.501 684 1HB ALA 86 1HB ALA 86 -7.431 4.440 10.165 685 2HB ALA 86 2HB ALA 86 -7.564 6.177 9.891 686 3HB ALA 86 3HB ALA 86 -7.024 5.570 11.457 687 H GLY 87 H GLY 87 -5.208 3.106 8.970 688 1HA GLY 87 1HA GLY 87 -5.724 3.891 6.196 689 2HA GLY 87 2HA GLY 87 -4.158 3.182 6.564 690 H TYR 88 H TYR 88 -6.660 2.340 4.985 691 HA TYR 88 HA TYR 88 -6.576 -0.434 5.885 692 1HB TYR 88 1HB TYR 88 -9.188 1.001 5.366 693 2HB TYR 88 2HB TYR 88 -8.994 -0.690 5.818 694 HD1 TYR 88 HD1 TYR 88 -8.474 -1.316 8.103 695 HD2 TYR 88 HD2 TYR 88 -8.897 2.774 7.009 696 HE1 TYR 88 HE1 TYR 88 -8.621 -0.702 10.480 697 HE2 TYR 88 HE2 TYR 88 -9.044 3.399 9.382 698 HH TYR 88 HH TYR 88 -8.139 1.429 11.864 699 H GLY 89 H GLY 89 -6.395 -1.805 4.224 700 1HA GLY 89 1HA GLY 89 -7.453 -1.051 1.604 701 2HA GLY 89 2HA GLY 89 -5.723 -1.333 1.722 702 H TRP 90 H TRP 90 -7.695 -2.772 0.142 703 HA TRP 90 HA TRP 90 -7.266 -5.453 1.281 704 1HB TRP 90 1HB TRP 90 -9.714 -4.432 1.223 705 2HB TRP 90 2HB TRP 90 -9.645 -4.962 -0.455 706 HD1 TRP 90 HD1 TRP 90 -7.946 -7.044 2.258 707 HE1 TRP 90 HE1 TRP 90 -9.207 -9.273 2.501 708 HE3 TRP 90 HE3 TRP 90 -11.956 -6.042 -0.752 709 HZ2 TRP 90 HZ2 TRP 90 -11.586 -10.453 1.543 710 HZ3 TRP 90 HZ3 TRP 90 -13.680 -7.775 -1.035 711 HH2 TRP 90 HH2 TRP 90 -13.497 -9.934 0.089 712 H GLU 91 H GLU 91 -6.005 -6.636 0.022 713 HA GLU 91 HA GLU 91 -6.253 -6.398 -2.887 714 1HB GLU 91 1HB GLU 91 -3.563 -6.513 -1.526 715 2HB GLU 91 2HB GLU 91 -3.895 -6.243 -3.232 716 1HG GLU 91 1HG GLU 91 -3.642 -4.086 -2.762 717 2HG GLU 91 2HG GLU 91 -5.251 -4.188 -2.048 718 HE2 GLU 91 HE2 GLU 91 -2.125 -3.997 0.394 719 H SER 92 H SER 92 -5.550 -8.252 -4.057 720 HA SER 92 HA SER 92 -5.481 -10.685 -2.404 721 1HB SER 92 1HB SER 92 -6.615 -10.103 -5.123 722 2HB SER 92 2HB SER 92 -6.172 -11.753 -4.687 723 HG SER 92 HG SER 92 -7.570 -11.535 -2.866 724 H THR 93 H THR 93 -3.708 -11.901 -2.414 725 HA THR 93 HA THR 93 -1.590 -11.256 -4.332 726 HB THR 93 HB THR 93 -0.124 -12.532 -2.762 727 HG1 THR 93 HG1 THR 93 -0.929 -13.302 -0.895 728 1HG2 THR 93 1HG2 THR 93 -1.437 -10.641 -0.939 729 2HG2 THR 93 2HG2 THR 93 -0.922 -9.981 -2.491 730 3HG2 THR 93 3HG2 THR 93 0.251 -10.767 -1.434 731 H TRP 94 H TRP 94 -0.480 -12.878 -5.478 732 HA TRP 94 HA TRP 94 -1.763 -15.520 -5.548 733 1HB TRP 94 1HB TRP 94 -1.139 -13.772 -7.935 734 2HB TRP 94 2HB TRP 94 -1.555 -15.480 -8.049 735 HD1 TRP 94 HD1 TRP 94 -3.159 -12.380 -8.629 736 HE1 TRP 94 HE1 TRP 94 -5.697 -12.469 -8.217 737 HE3 TRP 94 HE3 TRP 94 -3.391 -16.701 -5.905 738 HZ2 TRP 94 HZ2 TRP 94 -7.553 -14.148 -6.910 739 HZ3 TRP 94 HZ3 TRP 94 -5.587 -17.479 -5.111 740 HH2 TRP 94 HH2 TRP 94 -7.623 -16.227 -5.604 741 H ARG 95 H ARG 95 -0.431 -17.216 -6.394 742 HA ARG 95 HA ARG 95 2.434 -16.572 -6.543 743 1HB ARG 95 1HB ARG 95 1.374 -17.702 -4.330 744 2HB ARG 95 2HB ARG 95 1.709 -19.146 -5.274 745 1HG ARG 95 1HG ARG 95 3.789 -17.037 -4.803 746 2HG ARG 95 2HG ARG 95 3.511 -18.360 -3.670 747 1HD ARG 95 1HD ARG 95 3.713 -19.815 -5.862 748 2HD ARG 95 2HD ARG 95 4.625 -18.416 -6.429 749 HE ARG 95 HE ARG 95 6.350 -19.081 -5.100 750 1HH1 ARG 95 1HH1 ARG 95 3.419 -20.541 -3.892 751 2HH1 ARG 95 2HH1 ARG 95 4.235 -21.481 -2.688 752 1HH2 ARG 95 1HH2 ARG 95 7.425 -20.317 -3.517 753 2HH2 ARG 95 2HH2 ARG 95 6.509 -21.353 -2.474 754 HA PRO 96 HA PRO 96 1.515 -19.065 -10.235 755 1HB PRO 96 1HB PRO 96 3.656 -18.236 -11.664 756 2HB PRO 96 2HB PRO 96 2.186 -17.266 -11.508 757 1HG PRO 96 1HG PRO 96 4.776 -17.030 -10.026 758 2HG PRO 96 2HG PRO 96 3.762 -15.750 -10.717 759 1HD PRO 96 1HD PRO 96 3.741 -16.384 -8.076 760 2HD PRO 96 2HD PRO 96 2.314 -15.759 -8.928 761 H LEU 97 H LEU 97 3.380 -20.258 -11.699 762 HA LEU 97 HA LEU 97 4.721 -22.017 -9.777 763 1HB LEU 97 1HB LEU 97 3.596 -22.355 -12.498 764 2HB LEU 97 2HB LEU 97 5.017 -23.307 -12.115 765 HG LEU 97 HG LEU 97 3.650 -23.973 -9.980 766 1HD1 LEU 97 1HD1 LEU 97 1.178 -24.183 -10.967 767 2HD1 LEU 97 2HD1 LEU 97 1.653 -22.661 -11.720 768 3HD1 LEU 97 3HD1 LEU 97 1.698 -22.828 -9.965 769 1HD2 LEU 97 1HD2 LEU 97 3.417 -24.997 -12.775 770 2HD2 LEU 97 2HD2 LEU 97 2.471 -25.743 -11.486 771 3HD2 LEU 97 3HD2 LEU 97 4.231 -25.708 -11.381 772 H ALA 98 H ALA 98 5.329 -19.930 -12.527 773 HA ALA 98 HA ALA 98 7.973 -20.667 -13.079 774 1HB ALA 98 1HB ALA 98 6.543 -19.207 -14.502 775 2HB ALA 98 2HB ALA 98 8.171 -18.579 -14.238 776 3HB ALA 98 3HB ALA 98 6.808 -17.900 -13.347 777 H ASP 99 H ASP 99 6.611 -18.652 -10.575 778 HA ASP 99 HA ASP 99 9.288 -17.849 -9.691 779 1HB ASP 99 1HB ASP 99 6.519 -16.853 -9.066 780 2HB ASP 99 2HB ASP 99 7.887 -16.442 -8.036 781 HD2 ASP 99 HD2 ASP 99 7.437 -14.537 -11.414 782 H GLU 100 H GLU 100 10.036 -18.276 -7.606 783 HA GLU 100 HA GLU 100 8.620 -20.461 -6.229 784 1HB GLU 100 1HB GLU 100 10.963 -20.828 -7.263 785 2HB GLU 100 2HB GLU 100 11.549 -19.879 -5.903 786 1HG GLU 100 1HG GLU 100 10.295 -21.533 -4.426 787 2HG GLU 100 2HG GLU 100 10.173 -22.540 -5.867 788 HE2 GLU 100 HE2 GLU 100 13.177 -23.775 -4.614 789 H ASN 101 H ASN 101 10.100 -17.328 -5.874 790 HA ASN 101 HA ASN 101 9.013 -17.175 -3.162 791 1HB ASN 101 1HB ASN 101 11.754 -17.460 -3.663 792 2HB ASN 101 2HB ASN 101 11.530 -15.750 -3.309 793 1HD2 ASN 101 1HD2 ASN 101 9.517 -15.791 -1.486 794 2HD2 ASN 101 2HD2 ASN 101 10.033 -16.606 -0.052 795 H PHE 102 H PHE 102 8.139 -16.103 -5.716 796 HA PHE 102 HA PHE 102 8.295 -13.235 -5.065 797 1HB PHE 102 1HB PHE 102 8.447 -14.570 -7.761 798 2HB PHE 102 2HB PHE 102 7.959 -12.888 -7.591 799 HD1 PHE 102 HD1 PHE 102 9.596 -11.320 -7.891 800 HD2 PHE 102 HD2 PHE 102 10.669 -15.137 -6.348 801 HE1 PHE 102 HE1 PHE 102 11.960 -10.638 -7.858 802 HE2 PHE 102 HE2 PHE 102 13.034 -14.462 -6.311 803 HZ PHE 102 HZ PHE 102 13.682 -12.209 -7.066 804 H HIS 103 H HIS 103 6.386 -12.427 -4.539 805 HA HIS 103 HA HIS 103 3.963 -13.817 -5.451 806 1HB HIS 103 1HB HIS 103 4.425 -11.962 -3.109 807 2HB HIS 103 2HB HIS 103 2.846 -12.581 -3.575 808 HD1 HIS 103 HD1 HIS 103 4.756 -15.378 -4.232 809 HD2 HIS 103 HD2 HIS 103 3.698 -13.491 -0.683 810 HE1 HIS 103 HE1 HIS 103 5.009 -17.125 -2.441 811 HE2 HIS 103 HE2 HIS 103 4.280 -15.985 -0.315 812 H LEU 104 H LEU 104 2.172 -12.620 -6.216 813 HA LEU 104 HA LEU 104 2.621 -9.811 -6.879 814 1HB LEU 104 1HB LEU 104 3.400 -11.352 -8.768 815 2HB LEU 104 2HB LEU 104 1.706 -11.745 -8.995 816 HG LEU 104 HG LEU 104 1.499 -9.090 -9.119 817 1HD1 LEU 104 1HD1 LEU 104 3.594 -8.245 -8.917 818 2HD1 LEU 104 2HD1 LEU 104 3.599 -8.539 -10.655 819 3HD1 LEU 104 3HD1 LEU 104 4.363 -9.694 -9.563 820 1HD2 LEU 104 1HD2 LEU 104 1.850 -9.358 -11.627 821 2HD2 LEU 104 2HD2 LEU 104 0.667 -10.422 -10.866 822 3HD2 LEU 104 3HD2 LEU 104 2.269 -11.036 -11.275 823 H GLY 105 H GLY 105 0.855 -8.657 -6.458 824 1HA GLY 105 1HA GLY 105 -1.786 -9.768 -6.943 825 2HA GLY 105 2HA GLY 105 -1.411 -9.427 -5.261 826 H LEU 106 H LEU 106 -3.524 -8.194 -6.553 827 HA LEU 106 HA LEU 106 -2.604 -5.407 -6.545 828 1HB LEU 106 1HB LEU 106 -4.688 -6.420 -8.469 829 2HB LEU 106 2HB LEU 106 -3.948 -4.831 -8.430 830 HG LEU 106 HG LEU 106 -2.158 -7.165 -8.863 831 1HD1 LEU 106 1HD1 LEU 106 -2.754 -6.637 -11.406 832 2HD1 LEU 106 2HD1 LEU 106 -4.338 -6.344 -10.688 833 3HD1 LEU 106 3HD1 LEU 106 -3.553 -7.911 -10.484 834 1HD2 LEU 106 1HD2 LEU 106 -0.904 -5.275 -8.932 835 2HD2 LEU 106 2HD2 LEU 106 -2.249 -4.269 -9.469 836 3HD2 LEU 106 3HD2 LEU 106 -1.411 -5.309 -10.621 837 H GLY 107 H GLY 107 -4.343 -3.851 -6.109 838 1HA GLY 107 1HA GLY 107 -6.929 -4.568 -5.311 839 2HA GLY 107 2HA GLY 107 -5.898 -4.624 -3.889 840 H PHE 108 H PHE 108 -7.436 -2.920 -3.183 841 HA PHE 108 HA PHE 108 -6.591 -0.281 -4.189 842 1HB PHE 108 1HB PHE 108 -9.277 -1.216 -3.188 843 2HB PHE 108 2HB PHE 108 -8.852 0.491 -3.260 844 HD1 PHE 108 HD1 PHE 108 -10.568 -1.954 -4.920 845 HD2 PHE 108 HD2 PHE 108 -7.677 1.079 -5.663 846 HE1 PHE 108 HE1 PHE 108 -11.247 -1.892 -7.284 847 HE2 PHE 108 HE2 PHE 108 -8.351 1.147 -8.029 848 HZ PHE 108 HZ PHE 108 -10.138 -0.340 -8.841 849 H THR 109 H THR 109 -5.662 1.050 -2.770 850 HA THR 109 HA THR 109 -5.730 0.293 0.073 851 HB THR 109 HB THR 109 -3.635 1.888 0.064 852 HG1 THR 109 HG1 THR 109 -3.210 2.552 -1.872 853 1HG2 THR 109 1HG2 THR 109 -3.632 -0.587 0.483 854 2HG2 THR 109 2HG2 THR 109 -2.162 0.071 -0.235 855 3HG2 THR 109 3HG2 THR 109 -3.322 -0.796 -1.241 856 H ALA 110 H ALA 110 -7.066 1.501 1.235 857 HA ALA 110 HA ALA 110 -7.501 4.300 0.455 858 1HB ALA 110 1HB ALA 110 -9.640 4.141 1.183 859 2HB ALA 110 2HB ALA 110 -9.223 3.061 2.513 860 3HB ALA 110 3HB ALA 110 -9.367 2.427 0.874 861 H GLY 111 H GLY 111 -7.723 5.899 2.183 862 1HA GLY 111 1HA GLY 111 -6.591 5.253 4.771 863 2HA GLY 111 2HA GLY 111 -5.574 6.266 3.759 864 H VAL 112 H VAL 112 -7.463 6.497 6.289 865 HA VAL 112 HA VAL 112 -8.687 9.046 5.449 866 HB VAL 112 HB VAL 112 -10.355 7.375 6.131 867 1HG1 VAL 112 1HG1 VAL 112 -9.086 6.032 7.658 868 2HG1 VAL 112 2HG1 VAL 112 -10.467 6.705 8.526 869 3HG1 VAL 112 3HG1 VAL 112 -8.860 7.401 8.747 870 1HG2 VAL 112 1HG2 VAL 112 -11.007 9.613 6.490 871 2HG2 VAL 112 2HG2 VAL 112 -9.979 9.767 7.915 872 3HG2 VAL 112 3HG2 VAL 112 -11.422 8.754 7.973 873 H THR 113 H THR 113 -8.323 10.864 6.653 874 HA THR 113 HA THR 113 -6.440 10.593 8.904 875 HB THR 113 HB THR 113 -5.660 12.915 8.227 876 HG1 THR 113 HG1 THR 113 -6.290 13.725 6.347 877 1HG2 THR 113 1HG2 THR 113 -4.703 10.526 7.442 878 2HG2 THR 113 2HG2 THR 113 -3.974 12.075 7.019 879 3HG2 THR 113 3HG2 THR 113 -5.050 11.266 5.879 880 H ALA 114 H ALA 114 -6.549 12.314 10.518 881 HA ALA 114 HA ALA 114 -9.290 13.363 10.793 882 1HB ALA 114 1HB ALA 114 -9.310 12.849 13.012 883 2HB ALA 114 2HB ALA 114 -7.564 13.034 13.186 884 3HB ALA 114 3HB ALA 114 -8.228 11.580 12.440 885 H ARG 115 H ARG 115 -9.594 15.475 11.393 886 HA ARG 115 HA ARG 115 -7.358 17.142 12.150 887 1HB ARG 115 1HB ARG 115 -8.762 17.482 9.501 888 2HB ARG 115 2HB ARG 115 -7.834 18.766 10.264 889 1HG ARG 115 1HG ARG 115 -5.957 16.926 10.324 890 2HG ARG 115 2HG ARG 115 -6.903 16.243 9.000 891 1HD ARG 115 1HD ARG 115 -6.452 19.125 8.779 892 2HD ARG 115 2HD ARG 115 -4.973 18.165 8.744 893 HE ARG 115 HE ARG 115 -6.881 18.398 6.669 894 1HH1 ARG 115 1HH1 ARG 115 -4.784 16.070 8.205 895 2HH1 ARG 115 2HH1 ARG 115 -4.627 15.089 6.787 896 1HH2 ARG 115 1HH2 ARG 115 -6.676 17.109 4.803 897 2HH2 ARG 115 2HH2 ARG 115 -5.701 15.678 4.855 898 H ASP 116 H ASP 116 -7.991 18.848 13.359 899 HA ASP 116 HA ASP 116 -10.880 19.184 13.748 900 1HB ASP 116 1HB ASP 116 -8.522 19.902 15.498 901 2HB ASP 116 2HB ASP 116 -10.185 20.348 15.871 902 HD2 ASP 116 HD2 ASP 116 -10.578 17.330 17.411 903 H ASN 117 H ASN 117 -9.811 20.344 11.458 904 HA ASN 117 HA ASN 117 -9.620 23.201 12.110 905 1HB ASN 117 1HB ASN 117 -8.955 21.731 9.550 906 2HB ASN 117 2HB ASN 117 -8.798 23.468 9.786 907 1HD2 ASN 117 1HD2 ASN 117 -6.593 22.387 9.009 908 2HD2 ASN 117 2HD2 ASN 117 -5.465 22.145 10.294 909 H TRP 118 H TRP 118 -11.540 24.168 12.136 910 HA TRP 118 HA TRP 118 -13.555 24.968 11.448 911 1HB TRP 118 1HB TRP 118 -12.136 24.638 9.105 912 2HB TRP 118 2HB TRP 118 -13.615 23.736 8.792 913 HD1 TRP 118 HD1 TRP 118 -15.838 25.109 8.454 914 HE1 TRP 118 HE1 TRP 118 -16.333 27.619 8.179 915 HE3 TRP 118 HE3 TRP 118 -11.317 26.995 9.920 916 HZ2 TRP 118 HZ2 TRP 118 -14.986 30.074 8.537 917 HZ3 TRP 118 HZ3 TRP 118 -11.002 29.435 9.925 918 HH2 TRP 118 HH2 TRP 118 -12.801 30.942 9.246 919 H ASN 119 H ASN 119 -13.403 21.935 9.583 920 HA ASN 119 HA ASN 119 -15.955 21.142 10.758 921 1HB ASN 119 1HB ASN 119 -14.443 20.441 8.304 922 2HB ASN 119 2HB ASN 119 -15.420 19.160 9.013 923 1HD2 ASN 119 1HD2 ASN 119 -17.668 20.048 9.735 924 2HD2 ASN 119 2HD2 ASN 119 -18.501 20.957 8.524 925 H TYR 120 H TYR 120 -16.087 18.599 11.007 926 HA TYR 120 HA TYR 120 -13.716 17.669 12.474 927 1HB TYR 120 1HB TYR 120 -16.567 17.776 13.420 928 2HB TYR 120 2HB TYR 120 -15.452 16.576 14.067 929 HD1 TYR 120 HD1 TYR 120 -13.741 17.191 15.619 930 HD2 TYR 120 HD2 TYR 120 -16.147 20.188 13.794 931 HE1 TYR 120 HE1 TYR 120 -12.886 18.847 17.223 932 HE2 TYR 120 HE2 TYR 120 -15.299 21.852 15.393 933 HH TYR 120 HH TYR 120 -13.986 21.248 18.154 934 H ILE 121 H ILE 121 -14.682 17.060 9.792 935 HA ILE 121 HA ILE 121 -15.432 14.232 10.111 936 HB ILE 121 HB ILE 121 -15.622 15.869 7.585 937 1HG1 ILE 121 1HG1 ILE 121 -17.085 16.807 9.335 938 2HG1 ILE 121 2HG1 ILE 121 -18.018 16.064 8.039 939 1HG2 ILE 121 1HG2 ILE 121 -17.312 13.497 8.051 940 2HG2 ILE 121 2HG2 ILE 121 -15.590 13.195 7.817 941 3HG2 ILE 121 3HG2 ILE 121 -16.511 14.052 6.582 942 1HD1 ILE 121 1HD1 ILE 121 -17.412 14.789 10.696 943 2HD1 ILE 121 2HD1 ILE 121 -18.405 14.107 9.409 944 3HD1 ILE 121 3HD1 ILE 121 -18.932 15.565 10.250 945 HA PRO 122 HA PRO 122 -11.234 13.158 9.033 946 1HB PRO 122 1HB PRO 122 -12.562 10.689 8.032 947 2HB PRO 122 2HB PRO 122 -11.198 10.863 9.141 948 1HG PRO 122 1HG PRO 122 -13.610 10.203 10.052 949 2HG PRO 122 2HG PRO 122 -12.564 11.309 10.962 950 1HD PRO 122 1HD PRO 122 -14.957 11.913 9.280 951 2HD PRO 122 2HD PRO 122 -14.419 12.670 10.793 952 H LEU 123 H LEU 123 -9.991 12.605 7.134 953 HA LEU 123 HA LEU 123 -11.386 13.322 4.642 954 1HB LEU 123 1HB LEU 123 -8.533 13.730 5.517 955 2HB LEU 123 2HB LEU 123 -9.047 13.923 3.851 956 HG LEU 123 HG LEU 123 -10.813 15.567 4.987 957 1HD1 LEU 123 1HD1 LEU 123 -10.136 16.594 6.928 958 2HD1 LEU 123 2HD1 LEU 123 -8.453 16.106 6.728 959 3HD1 LEU 123 3HD1 LEU 123 -9.659 14.924 7.239 960 1HD2 LEU 123 1HD2 LEU 123 -8.798 17.311 4.756 961 2HD2 LEU 123 2HD2 LEU 123 -9.609 16.589 3.366 962 3HD2 LEU 123 3HD2 LEU 123 -8.075 15.929 3.934 963 HA PRO 124 HA PRO 124 -10.207 8.914 4.033 964 1HB PRO 124 1HB PRO 124 -12.330 8.305 2.462 965 2HB PRO 124 2HB PRO 124 -12.413 8.292 4.228 966 1HG PRO 124 1HG PRO 124 -13.308 10.406 2.305 967 2HG PRO 124 2HG PRO 124 -14.129 9.787 3.749 968 1HD PRO 124 1HD PRO 124 -12.747 12.118 3.741 969 2HD PRO 124 2HD PRO 124 -12.866 11.081 5.177 970 H VAL 125 H VAL 125 -9.487 7.818 2.153 971 HA VAL 125 HA VAL 125 -9.574 9.192 -0.401 972 HB VAL 125 HB VAL 125 -6.890 8.563 0.830 973 1HG1 VAL 125 1HG1 VAL 125 -6.355 10.271 -1.143 974 2HG1 VAL 125 2HG1 VAL 125 -7.830 9.558 -1.799 975 3HG1 VAL 125 3HG1 VAL 125 -6.454 8.529 -1.400 976 1HG2 VAL 125 1HG2 VAL 125 -8.321 11.207 0.589 977 2HG2 VAL 125 2HG2 VAL 125 -6.607 11.031 0.970 978 3HG2 VAL 125 3HG2 VAL 125 -7.826 10.391 2.073 979 H LEU 126 H LEU 126 -9.134 7.854 -2.153 980 HA LEU 126 HA LEU 126 -8.466 5.058 -1.553 981 1HB LEU 126 1HB LEU 126 -11.018 5.786 -2.033 982 2HB LEU 126 2HB LEU 126 -10.472 5.520 -3.677 983 HG LEU 126 HG LEU 126 -10.191 3.458 -1.496 984 1HD1 LEU 126 1HD1 LEU 126 -12.455 4.057 -3.349 985 2HD1 LEU 126 2HD1 LEU 126 -12.487 3.607 -1.644 986 3HD1 LEU 126 3HD1 LEU 126 -12.121 2.392 -2.869 987 1HD2 LEU 126 1HD2 LEU 126 -9.642 3.566 -4.417 988 2HD2 LEU 126 2HD2 LEU 126 -10.217 2.049 -3.725 989 3HD2 LEU 126 3HD2 LEU 126 -8.732 2.787 -3.124 990 H LEU 127 H LEU 127 -6.914 4.283 -2.824 991 HA LEU 127 HA LEU 127 -6.628 5.248 -5.553 992 1HB LEU 127 1HB LEU 127 -5.165 6.495 -3.654 993 2HB LEU 127 2HB LEU 127 -4.090 5.164 -4.039 994 HG LEU 127 HG LEU 127 -3.997 5.844 -6.362 995 1HD1 LEU 127 1HD1 LEU 127 -5.094 8.263 -6.687 996 2HD1 LEU 127 2HD1 LEU 127 -6.246 7.576 -5.543 997 3HD1 LEU 127 3HD1 LEU 127 -5.936 6.762 -7.076 998 1HD2 LEU 127 1HD2 LEU 127 -3.034 8.169 -6.027 999 2HD2 LEU 127 2HD2 LEU 127 -2.342 6.876 -5.047 1000 3HD2 LEU 127 3HD2 LEU 127 -3.495 8.002 -4.332 1001 HA PRO 128 HA PRO 128 -5.748 0.946 -6.163 1002 1HB PRO 128 1HB PRO 128 -4.491 1.113 -8.584 1003 2HB PRO 128 2HB PRO 128 -6.244 1.224 -8.383 1004 1HG PRO 128 1HG PRO 128 -4.231 3.416 -8.705 1005 2HG PRO 128 2HG PRO 128 -5.832 3.248 -9.450 1006 1HD PRO 128 1HD PRO 128 -5.406 4.856 -7.332 1007 2HD PRO 128 2HD PRO 128 -6.931 3.974 -7.549 1008 H LEU 129 H LEU 129 -4.133 -0.395 -5.591 1009 HA LEU 129 HA LEU 129 -1.357 0.458 -5.895 1010 1HB LEU 129 1HB LEU 129 -1.956 1.225 -3.675 1011 2HB LEU 129 2HB LEU 129 -2.596 -0.355 -3.267 1012 HG LEU 129 HG LEU 129 0.257 -0.225 -4.080 1013 1HD1 LEU 129 1HD1 LEU 129 1.065 0.809 -2.230 1014 2HD1 LEU 129 2HD1 LEU 129 -0.316 0.351 -1.232 1015 3HD1 LEU 129 3HD1 LEU 129 -0.457 1.687 -2.374 1016 1HD2 LEU 129 1HD2 LEU 129 -1.324 -2.209 -3.215 1017 2HD2 LEU 129 2HD2 LEU 129 -0.695 -1.640 -1.669 1018 3HD2 LEU 129 3HD2 LEU 129 0.416 -2.168 -2.933 1019 H ALA 130 H ALA 130 0.166 -1.262 -5.791 1020 HA ALA 130 HA ALA 130 -1.044 -3.937 -6.075 1021 1HB ALA 130 1HB ALA 130 1.184 -2.649 -7.623 1022 2HB ALA 130 2HB ALA 130 -0.316 -3.351 -8.228 1023 3HB ALA 130 3HB ALA 130 0.952 -4.397 -7.590 1024 H SER 131 H SER 131 -0.112 -5.621 -5.011 1025 HA SER 131 HA SER 131 2.092 -4.942 -3.186 1026 1HB SER 131 1HB SER 131 1.290 -6.701 -1.733 1027 2HB SER 131 2HB SER 131 -0.073 -5.669 -2.164 1028 HG SER 131 HG SER 131 -0.504 -7.952 -2.324 1029 H VAL 132 H VAL 132 3.922 -6.174 -3.088 1030 HA VAL 132 HA VAL 132 4.109 -8.573 -4.744 1031 HB VAL 132 HB VAL 132 4.826 -6.730 -6.209 1032 1HG1 VAL 132 1HG1 VAL 132 6.239 -5.094 -5.612 1033 2HG1 VAL 132 2HG1 VAL 132 7.315 -6.200 -4.759 1034 3HG1 VAL 132 3HG1 VAL 132 5.864 -5.592 -3.962 1035 1HG2 VAL 132 1HG2 VAL 132 7.371 -7.666 -6.294 1036 2HG2 VAL 132 2HG2 VAL 132 5.977 -8.502 -6.977 1037 3HG2 VAL 132 3HG2 VAL 132 6.571 -8.942 -5.375 1038 H GLY 133 H GLY 133 5.113 -10.135 -3.660 1039 1HA GLY 133 1HA GLY 133 6.588 -9.432 -1.234 1040 2HA GLY 133 2HA GLY 133 6.003 -11.031 -1.665 1041 H TYR 134 H TYR 134 8.710 -9.173 -1.337 1042 HA TYR 134 HA TYR 134 10.241 -10.926 -3.145 1043 1HB TYR 134 1HB TYR 134 10.106 -8.449 -3.788 1044 2HB TYR 134 2HB TYR 134 11.109 -8.143 -2.374 1045 HD1 TYR 134 HD1 TYR 134 11.162 -8.739 -5.818 1046 HD2 TYR 134 HD2 TYR 134 13.292 -9.664 -2.253 1047 HE1 TYR 134 HE1 TYR 134 13.173 -9.216 -7.150 1048 HE2 TYR 134 HE2 TYR 134 15.309 -10.143 -3.575 1049 HH TYR 134 HH TYR 134 15.408 -10.843 -6.590 1050 H GLY 135 H GLY 135 11.393 -12.331 -2.005 1051 1HA GLY 135 1HA GLY 135 12.723 -13.234 -0.367 1052 2HA GLY 135 2HA GLY 135 13.321 -11.602 -0.108 1053 HA PRO 136 HA PRO 136 11.198 -12.736 3.796 1054 1HB PRO 136 1HB PRO 136 12.929 -11.489 5.445 1055 2HB PRO 136 2HB PRO 136 13.255 -13.091 4.773 1056 1HG PRO 136 1HG PRO 136 14.273 -10.421 3.880 1057 2HG PRO 136 2HG PRO 136 15.150 -11.952 4.051 1058 1HD PRO 136 1HD PRO 136 14.240 -11.011 1.662 1059 2HD PRO 136 2HD PRO 136 14.420 -12.740 2.021 1060 H VAL 137 H VAL 137 11.759 -9.854 2.128 1061 HA VAL 137 HA VAL 137 10.198 -8.301 4.085 1062 HB VAL 137 HB VAL 137 11.898 -7.188 1.852 1063 1HG1 VAL 137 1HG1 VAL 137 11.725 -5.178 3.536 1064 2HG1 VAL 137 2HG1 VAL 137 10.259 -6.016 4.045 1065 3HG1 VAL 137 3HG1 VAL 137 10.441 -5.496 2.370 1066 1HG2 VAL 137 1HG2 VAL 137 13.580 -6.681 3.516 1067 2HG2 VAL 137 2HG2 VAL 137 13.265 -8.415 3.501 1068 3HG2 VAL 137 3HG2 VAL 137 12.589 -7.408 4.780 1069 H THR 138 H THR 138 8.564 -6.871 3.277 1070 HA THR 138 HA THR 138 7.305 -7.903 0.835 1071 HB THR 138 HB THR 138 5.824 -6.057 2.623 1072 HG1 THR 138 HG1 THR 138 6.422 -8.725 3.370 1073 1HG2 THR 138 1HG2 THR 138 3.964 -7.355 2.115 1074 2HG2 THR 138 2HG2 THR 138 4.945 -8.742 1.641 1075 3HG2 THR 138 3HG2 THR 138 4.883 -7.312 0.610 1076 H PHE 139 H PHE 139 6.518 -6.512 -0.764 1077 HA PHE 139 HA PHE 139 7.551 -3.754 -0.643 1078 1HB PHE 139 1HB PHE 139 7.684 -5.786 -2.842 1079 2HB PHE 139 2HB PHE 139 7.631 -4.073 -3.246 1080 HD1 PHE 139 HD1 PHE 139 9.819 -6.551 -3.205 1081 HD2 PHE 139 HD2 PHE 139 9.268 -2.811 -1.252 1082 HE1 PHE 139 HE1 PHE 139 12.245 -6.394 -2.832 1083 HE2 PHE 139 HE2 PHE 139 11.693 -2.647 -0.875 1084 HZ PHE 139 HZ PHE 139 13.186 -4.440 -1.665 1085 H GLN 140 H GLN 140 6.284 -2.132 -1.542 1086 HA GLN 140 HA GLN 140 3.664 -2.878 -2.607 1087 1HB GLN 140 1HB GLN 140 3.988 -2.073 0.033 1088 2HB GLN 140 2HB GLN 140 3.468 -0.609 -0.790 1089 1HG GLN 140 1HG GLN 140 1.387 -1.362 -1.076 1090 2HG GLN 140 2HG GLN 140 1.928 -2.983 -1.511 1091 1HE2 GLN 140 1HE2 GLN 140 -0.293 -2.480 0.098 1092 2HE2 GLN 140 2HE2 GLN 140 0.031 -3.073 1.688 1093 H MET 141 H MET 141 3.197 -1.737 -4.365 1094 HA MET 141 HA MET 141 4.506 0.879 -4.729 1095 1HB MET 141 1HB MET 141 4.117 -1.382 -6.668 1096 2HB MET 141 2HB MET 141 4.291 0.269 -7.243 1097 1HG MET 141 1HG MET 141 6.487 0.355 -6.760 1098 2HG MET 141 2HG MET 141 6.318 -0.636 -5.311 1099 1HE MET 141 1HE MET 141 8.529 -0.483 -7.245 1100 2HE MET 141 2HE MET 141 8.774 -1.833 -8.353 1101 3HE MET 141 3HE MET 141 8.959 -2.073 -6.616 1102 H THR 142 H THR 142 3.147 2.521 -4.935 1103 HA THR 142 HA THR 142 0.322 1.976 -5.432 1104 HB THR 142 HB THR 142 1.286 4.735 -4.889 1105 HG1 THR 142 HG1 THR 142 1.394 2.624 -3.008 1106 1HG2 THR 142 1HG2 THR 142 -0.876 4.984 -4.505 1107 2HG2 THR 142 2HG2 THR 142 -0.675 3.985 -3.065 1108 3HG2 THR 142 3HG2 THR 142 -1.152 3.244 -4.593 1109 H TYR 143 H TYR 143 -0.800 2.714 -7.172 1110 HA TYR 143 HA TYR 143 0.800 3.889 -9.337 1111 1HB TYR 143 1HB TYR 143 -0.422 1.668 -9.652 1112 2HB TYR 143 2HB TYR 143 -1.913 2.604 -9.624 1113 HD1 TYR 143 HD1 TYR 143 -2.589 3.905 -11.510 1114 HD2 TYR 143 HD2 TYR 143 1.215 2.000 -11.484 1115 HE1 TYR 143 HE1 TYR 143 -2.346 4.369 -13.912 1116 HE2 TYR 143 HE2 TYR 143 1.469 2.460 -13.886 1117 HH TYR 143 HH TYR 143 0.597 4.040 -15.561 1118 H ILE 144 H ILE 144 0.075 5.675 -10.489 1119 HA ILE 144 HA ILE 144 -2.294 7.062 -9.451 1120 HB ILE 144 HB ILE 144 0.314 8.478 -9.991 1121 1HG1 ILE 144 1HG1 ILE 144 -0.892 7.960 -7.276 1122 2HG1 ILE 144 2HG1 ILE 144 0.309 6.887 -7.988 1123 1HG2 ILE 144 1HG2 ILE 144 -2.133 9.469 -8.545 1124 2HG2 ILE 144 2HG2 ILE 144 -1.841 9.733 -10.265 1125 3HG2 ILE 144 3HG2 ILE 144 -0.731 10.403 -9.070 1126 1HD1 ILE 144 1HD1 ILE 144 1.176 8.608 -6.378 1127 2HD1 ILE 144 2HD1 ILE 144 0.779 9.825 -7.592 1128 3HD1 ILE 144 3HD1 ILE 144 1.962 8.568 -7.956 1129 HA PRO 145 HA PRO 145 -3.085 7.498 -13.806 1130 1HB PRO 145 1HB PRO 145 -5.061 9.354 -13.679 1131 2HB PRO 145 2HB PRO 145 -5.311 7.657 -13.251 1132 1HG PRO 145 1HG PRO 145 -4.826 10.009 -11.462 1133 2HG PRO 145 2HG PRO 145 -5.986 8.681 -11.275 1134 1HD PRO 145 1HD PRO 145 -3.633 8.754 -9.941 1135 2HD PRO 145 2HD PRO 145 -4.390 7.233 -10.457 1136 H GLY 146 H GLY 146 -1.970 8.612 -15.275 1137 1HA GLY 146 1HA GLY 146 -1.002 11.293 -14.566 1138 2HA GLY 146 2HA GLY 146 -0.313 10.246 -15.797 1139 H THR 147 H THR 147 -0.424 11.508 -17.573 1140 HA THR 147 HA THR 147 -3.092 12.501 -18.340 1141 HB THR 147 HB THR 147 -0.555 13.699 -19.403 1142 HG1 THR 147 HG1 THR 147 -0.144 14.612 -17.576 1143 1HG2 THR 147 1HG2 THR 147 -2.151 14.807 -20.521 1144 2HG2 THR 147 2HG2 THR 147 -2.255 15.741 -19.029 1145 3HG2 THR 147 3HG2 THR 147 -3.398 14.433 -19.332 1146 H TYR 148 H TYR 148 0.039 11.858 -19.928 1147 HA TYR 148 HA TYR 148 -0.936 9.745 -21.530 1148 1HB TYR 148 1HB TYR 148 -2.050 11.898 -22.494 1149 2HB TYR 148 2HB TYR 148 -0.454 12.216 -23.164 1150 HD1 TYR 148 HD1 TYR 148 -0.562 11.831 -25.444 1151 HD2 TYR 148 HD2 TYR 148 -2.386 9.040 -22.799 1152 HE1 TYR 148 HE1 TYR 148 -1.069 10.363 -27.351 1153 HE2 TYR 148 HE2 TYR 148 -2.896 7.564 -24.699 1154 HH TYR 148 HH TYR 148 -2.704 8.565 -27.907 1155 H ASN 149 H ASN 149 0.726 8.638 -22.421 1156 HA ASN 149 HA ASN 149 2.852 8.024 -22.942 1157 1HB ASN 149 1HB ASN 149 2.783 10.903 -23.624 1158 2HB ASN 149 2HB ASN 149 4.387 10.206 -23.411 1159 1HD2 ASN 149 1HD2 ASN 149 2.556 11.104 -25.742 1160 2HD2 ASN 149 2HD2 ASN 149 2.760 9.836 -26.898 1161 H ASN 150 H ASN 150 3.681 11.126 -21.435 1162 HA ASN 150 HA ASN 150 4.998 9.619 -19.270 1163 1HB ASN 150 1HB ASN 150 6.110 11.461 -21.131 1164 2HB ASN 150 2HB ASN 150 6.144 12.225 -19.545 1165 1HD2 ASN 150 1HD2 ASN 150 7.611 10.004 -21.609 1166 2HD2 ASN 150 2HD2 ASN 150 8.741 9.331 -20.489 1167 H GLY 151 H GLY 151 5.467 11.188 -17.341 1168 1HA GLY 151 1HA GLY 151 4.682 12.974 -15.971 1169 2HA GLY 151 2HA GLY 151 3.199 13.006 -16.915 1170 H ASN 152 H ASN 152 4.576 10.017 -15.757 1171 HA ASN 152 HA ASN 152 2.291 9.753 -13.920 1172 1HB ASN 152 1HB ASN 152 3.762 7.782 -15.630 1173 2HB ASN 152 2HB ASN 152 2.952 7.225 -14.169 1174 1HD2 ASN 152 1HD2 ASN 152 2.469 8.905 -17.219 1175 2HD2 ASN 152 2HD2 ASN 152 0.797 8.502 -17.387 1176 H VAL 153 H VAL 153 2.647 9.482 -11.807 1177 HA VAL 153 HA VAL 153 5.435 9.173 -10.920 1178 HB VAL 153 HB VAL 153 4.533 10.031 -8.707 1179 1HG1 VAL 153 1HG1 VAL 153 5.765 11.351 -10.521 1180 2HG1 VAL 153 2HG1 VAL 153 4.865 12.267 -9.312 1181 3HG1 VAL 153 3HG1 VAL 153 4.186 12.027 -10.922 1182 1HG2 VAL 153 1HG2 VAL 153 2.100 9.571 -9.685 1183 2HG2 VAL 153 2HG2 VAL 153 2.271 11.254 -10.184 1184 3HG2 VAL 153 3HG2 VAL 153 2.411 10.821 -8.480 1185 H TYR 154 H TYR 154 5.995 7.657 -9.379 1186 HA TYR 154 HA TYR 154 3.907 5.721 -8.629 1187 1HB TYR 154 1HB TYR 154 6.754 4.949 -9.263 1188 2HB TYR 154 2HB TYR 154 5.368 3.887 -9.041 1189 HD1 TYR 154 HD1 TYR 154 7.218 5.951 -11.373 1190 HD2 TYR 154 HD2 TYR 154 3.605 3.780 -10.794 1191 HE1 TYR 154 HE1 TYR 154 6.816 5.984 -13.799 1192 HE2 TYR 154 HE2 TYR 154 3.194 3.808 -13.218 1193 HH TYR 154 HH TYR 154 5.498 4.513 -15.467 1194 H PHE 155 H PHE 155 3.928 5.001 -6.556 1195 HA PHE 155 HA PHE 155 5.979 6.154 -4.790 1196 1HB PHE 155 1HB PHE 155 3.112 6.068 -4.636 1197 2HB PHE 155 2HB PHE 155 3.793 5.210 -3.257 1198 HD1 PHE 155 HD1 PHE 155 2.508 8.206 -4.109 1199 HD2 PHE 155 HD2 PHE 155 6.067 6.603 -2.415 1200 HE1 PHE 155 HE1 PHE 155 2.940 10.356 -2.992 1201 HE2 PHE 155 HE2 PHE 155 6.505 8.749 -1.295 1202 HZ PHE 155 HZ PHE 155 4.940 10.629 -1.582 1203 H ALA 156 H ALA 156 6.873 4.888 -3.128 1204 HA ALA 156 HA ALA 156 6.424 1.988 -3.356 1205 1HB ALA 156 1HB ALA 156 8.954 3.504 -3.631 1206 2HB ALA 156 2HB ALA 156 8.434 2.010 -4.412 1207 3HB ALA 156 3HB ALA 156 9.017 1.980 -2.746 1208 H TRP 157 H TRP 157 7.012 0.760 -1.457 1209 HA TRP 157 HA TRP 157 7.709 2.050 0.986 1210 1HB TRP 157 1HB TRP 157 4.841 1.576 0.357 1211 2HB TRP 157 2HB TRP 157 5.380 1.198 1.990 1212 HD1 TRP 157 HD1 TRP 157 7.132 3.487 2.859 1213 HE1 TRP 157 HE1 TRP 157 6.310 5.923 2.966 1214 HE3 TRP 157 HE3 TRP 157 3.183 3.156 -0.372 1215 HZ2 TRP 157 HZ2 TRP 157 4.259 7.497 1.833 1216 HZ3 TRP 157 HZ3 TRP 157 1.842 5.173 -0.805 1217 HH2 TRP 157 HH2 TRP 157 2.369 7.297 0.275 1218 H MET 158 H MET 158 8.302 0.598 2.559 1219 HA MET 158 HA MET 158 8.205 -2.228 1.757 1220 1HB MET 158 1HB MET 158 10.229 -0.534 3.055 1221 2HB MET 158 2HB MET 158 10.027 -2.115 3.799 1222 1HG MET 158 1HG MET 158 10.907 -3.210 2.040 1223 2HG MET 158 2HG MET 158 10.230 -2.089 0.861 1224 1HE MET 158 1HE MET 158 12.912 -3.655 1.976 1225 2HE MET 158 2HE MET 158 14.297 -2.601 2.258 1226 3HE MET 158 3HE MET 158 13.784 -2.961 0.609 1227 H ARG 159 H ARG 159 7.600 -3.826 3.217 1228 HA ARG 159 HA ARG 159 6.307 -2.869 5.686 1229 1HB ARG 159 1HB ARG 159 4.926 -3.805 3.571 1230 2HB ARG 159 2HB ARG 159 5.253 -5.322 4.398 1231 1HG ARG 159 1HG ARG 159 4.131 -4.587 6.362 1232 2HG ARG 159 2HG ARG 159 4.003 -2.939 5.741 1233 1HD ARG 159 1HD ARG 159 2.505 -3.673 3.993 1234 2HD ARG 159 2HD ARG 159 2.702 -5.353 4.488 1235 HE ARG 159 HE ARG 159 1.774 -4.125 6.725 1236 1HH1 ARG 159 1HH1 ARG 159 0.656 -4.305 3.424 1237 2HH1 ARG 159 2HH1 ARG 159 -1.016 -4.161 3.851 1238 1HH2 ARG 159 1HH2 ARG 159 -0.424 -3.936 7.289 1239 2HH2 ARG 159 2HH2 ARG 159 -1.630 -3.950 6.045 1240 H PHE 160 H PHE 160 7.129 -3.722 7.471 1241 HA PHE 160 HA PHE 160 8.658 -6.223 7.259 1242 1HB PHE 160 1HB PHE 160 9.156 -3.719 8.590 1243 2HB PHE 160 2HB PHE 160 9.137 -5.025 9.770 1244 HD1 PHE 160 HD1 PHE 160 10.915 -6.558 9.923 1245 HD2 PHE 160 HD2 PHE 160 10.721 -3.845 6.651 1246 HE1 PHE 160 HE1 PHE 160 13.209 -7.175 9.280 1247 HE2 PHE 160 HE2 PHE 160 13.013 -4.457 6.002 1248 HZ PHE 160 HZ PHE 160 14.261 -6.124 7.317 1249 H GLN 161 H GLN 161 8.255 -7.936 8.611 1250 HA GLN 161 HA GLN 161 5.827 -7.723 10.267 1251 1HB GLN 161 1HB GLN 161 6.072 -9.289 8.089 1252 2HB GLN 161 2HB GLN 161 6.697 -10.389 9.310 1253 1HG GLN 161 1HG GLN 161 4.667 -10.328 10.531 1254 2HG GLN 161 2HG GLN 161 4.052 -8.987 9.565 1255 1HE2 GLN 161 1HE2 GLN 161 2.757 -9.468 7.939 1256 2HE2 GLN 161 2HE2 GLN 161 2.579 -11.023 7.209 1257 H PHE 162 H PHE 162 6.132 -7.967 12.373 1258 HA PHE 162 HA PHE 162 8.356 -9.657 13.296 1259 1HB PHE 162 1HB PHE 162 8.795 -7.141 13.459 1260 2HB PHE 162 2HB PHE 162 7.547 -7.115 14.701 1261 HD1 PHE 162 HD1 PHE 162 10.218 -9.617 14.027 1262 HD2 PHE 162 HD2 PHE 162 8.639 -6.702 16.694 1263 HE1 PHE 162 HE1 PHE 162 11.890 -10.260 15.713 1264 HE2 PHE 162 HE2 PHE 162 10.309 -7.338 18.385 1265 HZ PHE 162 HZ PHE 162 11.938 -9.119 17.896 1266 H LEU 163 H LEU 163 8.100 -10.264 15.643 1267 HA LEU 163 HA LEU 163 5.330 -10.340 16.557 1268 1HB LEU 163 1HB LEU 163 6.068 -12.403 15.092 1269 2HB LEU 163 2HB LEU 163 6.849 -12.910 16.577 1270 HG LEU 163 HG LEU 163 3.958 -12.148 16.631 1271 1HD1 LEU 163 1HD1 LEU 163 4.732 -13.949 14.795 1272 2HD1 LEU 163 2HD1 LEU 163 3.204 -14.046 15.673 1273 3HD1 LEU 163 3HD1 LEU 163 4.590 -14.996 16.208 1274 1HD2 LEU 163 1HD2 LEU 163 3.935 -13.184 18.636 1275 2HD2 LEU 163 2HD2 LEU 163 5.665 -12.845 18.584 1276 3HD2 LEU 163 3HD2 LEU 163 5.064 -14.438 18.124 1277 H GLU 164 H GLU 164 5.187 -10.090 18.698 1278 HA GLU 164 HA GLU 164 7.458 -10.837 20.389 1279 1HB GLU 164 1HB GLU 164 6.336 -8.095 20.021 1280 2HB GLU 164 2HB GLU 164 6.885 -8.566 21.624 1281 1HG GLU 164 1HG GLU 164 8.542 -8.606 19.111 1282 2HG GLU 164 2HG GLU 164 8.620 -7.392 20.387 1283 HE2 GLU 164 HE2 GLU 164 11.124 -10.067 20.879 1284 H HIS 165 H HIS 165 6.604 -12.263 21.751 1285 HA HIS 165 HA HIS 165 3.832 -12.173 22.515 1286 1HB HIS 165 1HB HIS 165 6.030 -14.078 22.681 1287 2HB HIS 165 2HB HIS 165 5.074 -14.038 24.159 1288 HD1 HIS 165 HD1 HIS 165 3.196 -15.631 24.138 1289 HD2 HIS 165 HD2 HIS 165 4.151 -14.333 20.308 1290 HE1 HIS 165 HE1 HIS 165 1.637 -16.867 22.600 1291 HE2 HIS 165 HE2 HIS 165 2.174 -16.000 20.297 1292 H HIS 166 H HIS 166 2.966 -11.346 24.317 1293 HA HIS 166 HA HIS 166 4.621 -9.771 26.064 1294 1HB HIS 166 1HB HIS 166 2.439 -9.245 27.189 1295 2HB HIS 166 2HB HIS 166 2.481 -8.868 25.469 1296 HD1 HIS 166 HD1 HIS 166 1.072 -10.405 23.888 1297 HD2 HIS 166 HD2 HIS 166 0.584 -11.163 27.944 1298 HE1 HIS 166 HE1 HIS 166 -0.985 -11.842 24.062 1299 HE2 HIS 166 HE2 HIS 166 -1.308 -12.216 26.531 1300 H HIS 167 H HIS 167 3.048 -12.880 26.172 1301 HA HIS 167 HA HIS 167 3.126 -14.590 27.669 1302 1HB HIS 167 1HB HIS 167 5.641 -13.618 27.649 1303 2HB HIS 167 2HB HIS 167 5.233 -13.342 29.339 1304 HD1 HIS 167 HD1 HIS 167 4.120 -16.333 27.318 1305 HD2 HIS 167 HD2 HIS 167 6.700 -15.388 30.434 1306 HE1 HIS 167 HE1 HIS 167 4.936 -18.539 28.207 1307 HE2 HIS 167 HE2 HIS 167 6.430 -17.943 30.147 1308 H HIS 168 H HIS 168 3.345 -14.901 30.278 1309 HA HIS 168 HA HIS 168 2.272 -14.622 32.264 1310 1HB HIS 168 1HB HIS 168 3.636 -12.526 32.272 1311 2HB HIS 168 2HB HIS 168 2.265 -11.682 31.559 1312 HD1 HIS 168 HD1 HIS 168 0.830 -10.537 33.205 1313 HD2 HIS 168 HD2 HIS 168 2.803 -13.785 34.882 1314 HE1 HIS 168 HE1 HIS 168 0.184 -10.534 35.635 1315 HE2 HIS 168 HE2 HIS 168 1.323 -12.558 36.612 1316 H HIS 169 H HIS 169 0.447 -15.739 31.323 1317 HA HIS 169 HA HIS 169 -1.703 -14.475 30.051 1318 1HB HIS 169 1HB HIS 169 -1.731 -16.946 31.797 1319 2HB HIS 169 2HB HIS 169 -3.012 -16.465 30.688 1320 HD1 HIS 169 HD1 HIS 169 -1.794 -16.004 28.101 1321 HD2 HIS 169 HD2 HIS 169 -0.266 -18.897 30.662 1322 HE1 HIS 169 HE1 HIS 169 -0.502 -17.585 26.634 1323 HE2 HIS 169 HE2 HIS 169 0.488 -19.275 28.217 1324 H HIS 170 H HIS 170 -3.290 -13.202 30.757 1325 HA HIS 170 HA HIS 170 -3.369 -12.470 33.555 1326 1HB HIS 170 1HB HIS 170 -4.996 -10.765 32.828 1327 2HB HIS 170 2HB HIS 170 -3.521 -10.713 31.868 1328 HD1 HIS 170 HD1 HIS 170 -3.698 -11.674 29.407 1329 HD2 HIS 170 HD2 HIS 170 -7.310 -11.235 31.412 1330 HE1 HIS 170 HE1 HIS 170 -5.472 -11.813 27.631 1331 HE2 HIS 170 HE2 HIS 170 -7.645 -11.459 28.858 Start of MODEL 4 1 1H MET 1 1H MET 1 -12.928 -41.695 15.425 2 2H MET 1 2H MET 1 -13.230 -40.375 16.480 3 H MET 1 H MET 1 -13.755 -42.115 16.000 4 3H MET 1 3H MET 1 -14.016 -41.879 16.737 5 HA MET 1 HA MET 1 -12.365 -41.839 18.295 6 1HB MET 1 1HB MET 1 -11.842 -43.417 15.827 7 2HB MET 1 2HB MET 1 -10.581 -43.407 17.052 8 1HG MET 1 1HG MET 1 -11.729 -45.187 17.810 9 2HG MET 1 2HG MET 1 -12.679 -43.938 18.613 10 1HE MET 1 1HE MET 1 -13.985 -47.071 17.812 11 2HE MET 1 2HE MET 1 -15.549 -46.257 17.821 12 3HE MET 1 3HE MET 1 -14.301 -45.783 18.974 13 H ASN 2 H ASN 2 -11.185 -40.700 15.175 14 HA ASN 2 HA ASN 2 -9.090 -39.204 16.594 15 1HB ASN 2 1HB ASN 2 -8.806 -40.817 14.061 16 2HB ASN 2 2HB ASN 2 -7.660 -39.557 14.512 17 1HD2 ASN 2 1HD2 ASN 2 -5.890 -40.438 15.279 18 2HD2 ASN 2 2HD2 ASN 2 -5.805 -41.774 16.370 19 H ALA 3 H ALA 3 -10.691 -39.520 13.423 20 HA ALA 3 HA ALA 3 -10.203 -36.911 12.543 21 1HB ALA 3 1HB ALA 3 -11.787 -37.322 10.835 22 2HB ALA 3 2HB ALA 3 -12.625 -38.534 11.803 23 3HB ALA 3 3HB ALA 3 -11.013 -38.869 11.174 24 H ASP 4 H ASP 4 -12.413 -38.077 14.903 25 HA ASP 4 HA ASP 4 -14.283 -35.908 14.713 26 1HB ASP 4 1HB ASP 4 -13.817 -38.069 16.767 27 2HB ASP 4 2HB ASP 4 -15.031 -36.812 16.982 28 HD2 ASP 4 HD2 ASP 4 -17.195 -38.813 15.251 29 H GLU 5 H GLU 5 -11.864 -36.842 17.157 30 HA GLU 5 HA GLU 5 -12.027 -34.405 18.588 31 1HB GLU 5 1HB GLU 5 -10.220 -36.767 18.583 32 2HB GLU 5 2HB GLU 5 -9.608 -35.289 19.314 33 1HG GLU 5 1HG GLU 5 -10.627 -35.930 21.173 34 2HG GLU 5 2HG GLU 5 -12.145 -35.534 20.370 35 HE2 GLU 5 HE2 GLU 5 -13.094 -38.816 20.410 36 H TRP 6 H TRP 6 -10.280 -35.400 15.764 37 HA TRP 6 HA TRP 6 -8.233 -33.441 15.836 38 1HB TRP 6 1HB TRP 6 -9.221 -35.441 13.954 39 2HB TRP 6 2HB TRP 6 -8.668 -33.976 13.149 40 HD1 TRP 6 HD1 TRP 6 -7.393 -37.172 14.388 41 HE1 TRP 6 HE1 TRP 6 -4.826 -37.143 14.557 42 HE3 TRP 6 HE3 TRP 6 -6.607 -32.139 13.948 43 HZ2 TRP 6 HZ2 TRP 6 -2.742 -35.239 14.511 44 HZ3 TRP 6 HZ3 TRP 6 -4.297 -31.296 14.020 45 HH2 TRP 6 HH2 TRP 6 -2.405 -32.814 14.297 46 H MET 7 H MET 7 -11.486 -33.491 14.469 47 HA MET 7 HA MET 7 -11.355 -31.101 13.016 48 1HB MET 7 1HB MET 7 -13.555 -32.733 14.196 49 2HB MET 7 2HB MET 7 -13.935 -31.110 13.636 50 1HG MET 7 1HG MET 7 -12.472 -33.014 11.859 51 2HG MET 7 2HG MET 7 -14.223 -33.118 12.036 52 1HE MET 7 1HE MET 7 -15.877 -30.836 10.397 53 2HE MET 7 2HE MET 7 -15.256 -29.545 11.426 54 3HE MET 7 3HE MET 7 -15.609 -31.129 12.116 55 H THR 8 H THR 8 -11.837 -31.716 16.421 56 HA THR 8 HA THR 8 -12.820 -29.163 17.138 57 HB THR 8 HB THR 8 -11.158 -30.652 19.094 58 HG1 THR 8 HG1 THR 8 -13.533 -31.710 17.967 59 1HG2 THR 8 1HG2 THR 8 -13.495 -30.469 20.280 60 2HG2 THR 8 2HG2 THR 8 -13.741 -29.196 19.086 61 3HG2 THR 8 3HG2 THR 8 -12.386 -29.100 20.211 62 H THR 9 H THR 9 -9.608 -30.437 16.628 63 HA THR 9 HA THR 9 -8.195 -28.309 17.872 64 HB THR 9 HB THR 9 -7.110 -30.000 15.631 65 HG1 THR 9 HG1 THR 9 -7.349 -30.757 18.353 66 1HG2 THR 9 1HG2 THR 9 -5.877 -28.108 17.130 67 2HG2 THR 9 2HG2 THR 9 -5.068 -29.474 16.362 68 3HG2 THR 9 3HG2 THR 9 -5.539 -29.569 18.059 69 H PHE 10 H PHE 10 -9.525 -28.816 14.684 70 HA PHE 10 HA PHE 10 -8.113 -26.774 13.336 71 1HB PHE 10 1HB PHE 10 -9.746 -28.732 12.505 72 2HB PHE 10 2HB PHE 10 -10.893 -27.397 12.493 73 HD1 PHE 10 HD1 PHE 10 -7.554 -28.415 11.230 74 HD2 PHE 10 HD2 PHE 10 -10.961 -25.921 10.701 75 HE1 PHE 10 HE1 PHE 10 -6.681 -27.693 9.045 76 HE2 PHE 10 HE2 PHE 10 -10.095 -25.194 8.516 77 HZ PHE 10 HZ PHE 10 -7.953 -26.081 7.685 78 H ARG 11 H ARG 11 -11.432 -26.802 14.645 79 HA ARG 11 HA ARG 11 -11.979 -24.098 14.171 80 1HB ARG 11 1HB ARG 11 -13.586 -25.990 14.834 81 2HB ARG 11 2HB ARG 11 -13.117 -25.641 16.492 82 1HG ARG 11 1HG ARG 11 -13.969 -23.331 14.868 83 2HG ARG 11 2HG ARG 11 -15.217 -24.511 15.278 84 1HD ARG 11 1HD ARG 11 -14.382 -24.322 17.674 85 2HD ARG 11 2HD ARG 11 -13.484 -22.904 17.136 86 HE ARG 11 HE ARG 11 -16.210 -22.709 16.390 87 1HH1 ARG 11 1HH1 ARG 11 -14.087 -22.439 19.147 88 2HH1 ARG 11 2HH1 ARG 11 -15.120 -21.336 19.992 89 1HH2 ARG 11 1HH2 ARG 11 -17.570 -21.257 17.499 90 2HH2 ARG 11 2HH2 ARG 11 -17.097 -20.664 19.057 91 H GLU 12 H GLU 12 -10.276 -25.691 16.770 92 HA GLU 12 HA GLU 12 -10.294 -23.493 18.577 93 1HB GLU 12 1HB GLU 12 -9.717 -26.072 18.898 94 2HB GLU 12 2HB GLU 12 -8.080 -25.484 18.637 95 1HG GLU 12 1HG GLU 12 -8.315 -23.940 20.494 96 2HG GLU 12 2HG GLU 12 -9.980 -24.465 20.739 97 HE2 GLU 12 HE2 GLU 12 -8.675 -26.710 22.985 98 H ASN 13 H ASN 13 -8.257 -24.458 15.913 99 HA ASN 13 HA ASN 13 -6.089 -22.707 16.533 100 1HB ASN 13 1HB ASN 13 -5.894 -24.749 15.095 101 2HB ASN 13 2HB ASN 13 -6.805 -23.902 13.849 102 1HD2 ASN 13 1HD2 ASN 13 -5.026 -24.132 12.449 103 2HD2 ASN 13 2HD2 ASN 13 -3.639 -23.113 12.591 104 H ILE 14 H ILE 14 -8.955 -22.497 14.487 105 HA ILE 14 HA ILE 14 -8.271 -20.003 13.296 106 HB ILE 14 HB ILE 14 -11.046 -21.141 13.622 107 1HG1 ILE 14 1HG1 ILE 14 -9.613 -22.844 12.633 108 2HG1 ILE 14 2HG1 ILE 14 -10.686 -22.181 11.403 109 1HG2 ILE 14 1HG2 ILE 14 -11.059 -19.918 11.246 110 2HG2 ILE 14 2HG2 ILE 14 -9.842 -18.937 12.063 111 3HG2 ILE 14 3HG2 ILE 14 -11.458 -19.092 12.752 112 1HD1 ILE 14 1HD1 ILE 14 -8.931 -21.752 10.138 113 2HD1 ILE 14 2HD1 ILE 14 -7.854 -22.347 11.401 114 3HD1 ILE 14 3HD1 ILE 14 -8.318 -20.646 11.368 115 H ALA 15 H ALA 15 -10.291 -20.935 16.054 116 HA ALA 15 HA ALA 15 -11.272 -18.358 16.639 117 1HB ALA 15 1HB ALA 15 -12.315 -19.332 18.393 118 2HB ALA 15 2HB ALA 15 -10.878 -20.225 18.893 119 3HB ALA 15 3HB ALA 15 -11.857 -20.812 17.549 120 H GLN 16 H GLN 16 -8.320 -20.029 17.517 121 HA GLN 16 HA GLN 16 -7.511 -18.207 19.546 122 1HB GLN 16 1HB GLN 16 -6.657 -20.661 18.761 123 2HB GLN 16 2HB GLN 16 -5.406 -19.647 18.057 124 1HG GLN 16 1HG GLN 16 -5.581 -18.612 20.559 125 2HG GLN 16 2HG GLN 16 -5.946 -20.311 20.856 126 1HE2 GLN 16 1HE2 GLN 16 -3.776 -19.540 22.035 127 2HE2 GLN 16 2HE2 GLN 16 -2.344 -20.036 21.207 128 H THR 17 H THR 17 -6.930 -18.440 16.077 129 HA THR 17 HA THR 17 -5.045 -16.286 16.010 130 HB THR 17 HB THR 17 -6.621 -17.206 13.625 131 HG1 THR 17 HG1 THR 17 -4.391 -18.573 14.713 132 1HG2 THR 17 1HG2 THR 17 -3.830 -16.207 14.060 133 2HG2 THR 17 2HG2 THR 17 -5.094 -15.543 13.024 134 3HG2 THR 17 3HG2 THR 17 -4.309 -17.063 12.594 135 H TRP 18 H TRP 18 -8.510 -16.599 15.655 136 HA TRP 18 HA TRP 18 -8.944 -13.995 14.574 137 1HB TRP 18 1HB TRP 18 -10.618 -16.226 15.555 138 2HB TRP 18 2HB TRP 18 -11.335 -14.624 15.692 139 HD1 TRP 18 HD1 TRP 18 -10.053 -17.106 13.054 140 HE1 TRP 18 HE1 TRP 18 -11.078 -16.473 10.779 141 HE3 TRP 18 HE3 TRP 18 -12.329 -12.721 14.376 142 HZ2 TRP 18 HZ2 TRP 18 -12.643 -14.392 9.689 143 HZ3 TRP 18 HZ3 TRP 18 -13.568 -11.471 12.658 144 HH2 TRP 18 HH2 TRP 18 -13.721 -12.291 10.363 145 H GLN 19 H GLN 19 -8.715 -15.330 17.795 146 HA GLN 19 HA GLN 19 -9.673 -12.901 19.051 147 1HB GLN 19 1HB GLN 19 -9.280 -14.066 21.154 148 2HB GLN 19 2HB GLN 19 -10.183 -15.092 20.048 149 1HG GLN 19 1HG GLN 19 -8.041 -16.216 19.456 150 2HG GLN 19 2HG GLN 19 -7.260 -15.280 20.728 151 1HE2 GLN 19 1HE2 GLN 19 -6.703 -17.197 21.804 152 2HE2 GLN 19 2HE2 GLN 19 -7.869 -18.098 22.706 153 H GLN 20 H GLN 20 -6.613 -14.575 18.532 154 HA GLN 20 HA GLN 20 -5.222 -12.149 19.456 155 1HB GLN 20 1HB GLN 20 -5.090 -14.505 20.773 156 2HB GLN 20 2HB GLN 20 -3.770 -14.722 19.632 157 1HG GLN 20 1HG GLN 20 -3.802 -12.132 21.007 158 2HG GLN 20 2HG GLN 20 -3.540 -13.532 22.047 159 1HE2 GLN 20 1HE2 GLN 20 -2.071 -15.197 20.568 160 2HE2 GLN 20 2HE2 GLN 20 -0.561 -14.479 20.133 161 HA PRO 21 HA PRO 21 -3.446 -12.196 15.392 162 1HB PRO 21 1HB PRO 21 -1.389 -10.489 15.790 163 2HB PRO 21 2HB PRO 21 -3.069 -9.946 15.719 164 1HG PRO 21 1HG PRO 21 -1.345 -10.460 18.111 165 2HG PRO 21 2HG PRO 21 -2.459 -9.116 17.803 166 1HD PRO 21 1HD PRO 21 -3.107 -11.242 19.364 167 2HD PRO 21 2HD PRO 21 -4.307 -10.343 18.415 168 H GLU 22 H GLU 22 -0.892 -12.036 14.628 169 HA GLU 22 HA GLU 22 0.551 -14.164 16.054 170 1HB GLU 22 1HB GLU 22 -0.304 -14.086 13.200 171 2HB GLU 22 2HB GLU 22 1.268 -14.784 13.568 172 1HG GLU 22 1HG GLU 22 0.001 -16.195 15.302 173 2HG GLU 22 2HG GLU 22 -1.445 -15.712 14.416 174 HE2 GLU 22 HE2 GLU 22 1.114 -17.783 12.204 175 H HIS 23 H HIS 23 0.990 -12.057 13.206 176 HA HIS 23 HA HIS 23 3.629 -11.317 14.288 177 1HB HIS 23 1HB HIS 23 2.677 -11.412 11.418 178 2HB HIS 23 2HB HIS 23 4.248 -10.804 11.928 179 HD1 HIS 23 HD1 HIS 23 2.879 -13.683 10.497 180 HD2 HIS 23 HD2 HIS 23 5.545 -13.053 13.621 181 HE1 HIS 23 HE1 HIS 23 4.126 -15.851 10.766 182 HE2 HIS 23 HE2 HIS 23 5.792 -15.418 12.605 183 H TYR 24 H TYR 24 4.338 -9.117 13.152 184 HA TYR 24 HA TYR 24 2.128 -7.214 13.583 185 1HB TYR 24 1HB TYR 24 4.271 -7.369 15.170 186 2HB TYR 24 2HB TYR 24 4.949 -6.329 13.921 187 HD1 TYR 24 HD1 TYR 24 4.540 -4.032 13.966 188 HD2 TYR 24 HD2 TYR 24 2.041 -6.629 16.228 189 HE1 TYR 24 HE1 TYR 24 3.458 -2.081 15.000 190 HE2 TYR 24 HE2 TYR 24 0.951 -4.685 17.267 191 HH TYR 24 HH TYR 24 2.196 -1.523 17.009 192 H ASP 25 H ASP 25 2.453 -5.092 12.466 193 HA ASP 25 HA ASP 25 3.841 -5.422 9.891 194 1HB ASP 25 1HB ASP 25 1.021 -4.516 10.407 195 2HB ASP 25 2HB ASP 25 1.882 -4.009 8.958 196 HD2 ASP 25 HD2 ASP 25 1.180 -6.982 7.440 197 H LEU 26 H LEU 26 5.250 -3.855 9.503 198 HA LEU 26 HA LEU 26 4.813 -1.224 10.754 199 1HB LEU 26 1HB LEU 26 6.762 -2.880 11.543 200 2HB LEU 26 2HB LEU 26 7.587 -2.115 10.198 201 HG LEU 26 HG LEU 26 6.254 -0.358 12.200 202 1HD1 LEU 26 1HD1 LEU 26 7.432 -1.993 13.579 203 2HD1 LEU 26 2HD1 LEU 26 8.218 -0.416 13.641 204 3HD1 LEU 26 3HD1 LEU 26 8.910 -1.708 12.661 205 1HD2 LEU 26 1HD2 LEU 26 7.207 0.954 10.603 206 2HD2 LEU 26 2HD2 LEU 26 8.467 -0.223 10.228 207 3HD2 LEU 26 3HD2 LEU 26 8.597 0.776 11.676 208 H TYR 27 H TYR 27 4.696 0.402 9.357 209 HA TYR 27 HA TYR 27 5.708 -0.025 6.630 210 1HB TYR 27 1HB TYR 27 3.426 1.572 7.740 211 2HB TYR 27 2HB TYR 27 4.143 2.026 6.197 212 HD1 TYR 27 HD1 TYR 27 3.486 0.944 4.231 213 HD2 TYR 27 HD2 TYR 27 2.577 -0.836 7.987 214 HE1 TYR 27 HE1 TYR 27 2.104 -0.740 3.092 215 HE2 TYR 27 HE2 TYR 27 1.194 -2.526 6.858 216 HH TYR 27 HH TYR 27 0.111 -2.241 3.754 217 H ILE 28 H ILE 28 7.361 1.150 5.914 218 HA ILE 28 HA ILE 28 7.910 3.762 7.102 219 HB ILE 28 HB ILE 28 9.268 2.144 8.380 220 1HG1 ILE 28 1HG1 ILE 28 10.846 3.962 6.544 221 2HG1 ILE 28 2HG1 ILE 28 10.090 4.424 8.066 222 1HG2 ILE 28 1HG2 ILE 28 9.502 0.509 6.508 223 2HG2 ILE 28 2HG2 ILE 28 11.003 0.854 7.367 224 3HG2 ILE 28 3HG2 ILE 28 10.701 1.585 5.791 225 1HD1 ILE 28 1HD1 ILE 28 11.909 2.179 8.353 226 2HD1 ILE 28 2HD1 ILE 28 11.817 3.692 9.256 227 3HD1 ILE 28 3HD1 ILE 28 12.691 3.630 7.725 228 HA PRO 29 HA PRO 29 8.612 4.640 2.797 229 1HB PRO 29 1HB PRO 29 9.675 7.117 3.052 230 2HB PRO 29 2HB PRO 29 7.954 6.790 3.286 231 1HG PRO 29 1HG PRO 29 10.116 7.113 5.333 232 2HG PRO 29 2HG PRO 29 8.468 7.772 5.332 233 1HD PRO 29 1HD PRO 29 9.163 5.569 6.751 234 2HD PRO 29 2HD PRO 29 7.542 5.793 6.063 235 H ALA 30 H ALA 30 10.350 5.048 1.303 236 HA ALA 30 HA ALA 30 12.915 4.072 2.317 237 1HB ALA 30 1HB ALA 30 12.470 2.757 0.519 238 2HB ALA 30 2HB ALA 30 13.302 4.068 -0.317 239 3HB ALA 30 3HB ALA 30 11.540 4.008 -0.307 240 H ILE 31 H ILE 31 14.161 5.695 3.037 241 HA ILE 31 HA ILE 31 15.077 7.677 1.156 242 HB ILE 31 HB ILE 31 14.623 9.582 2.761 243 1HG1 ILE 31 1HG1 ILE 31 12.265 8.114 3.794 244 2HG1 ILE 31 2HG1 ILE 31 13.820 7.663 4.488 245 1HG2 ILE 31 1HG2 ILE 31 13.348 8.938 0.600 246 2HG2 ILE 31 2HG2 ILE 31 12.650 10.138 1.686 247 3HG2 ILE 31 3HG2 ILE 31 12.053 8.479 1.705 248 1HD1 ILE 31 1HD1 ILE 31 13.799 10.450 4.485 249 2HD1 ILE 31 2HD1 ILE 31 13.603 9.375 5.869 250 3HD1 ILE 31 3HD1 ILE 31 12.185 9.963 5.003 251 H THR 32 H THR 32 17.046 8.596 1.734 252 HA THR 32 HA THR 32 18.283 7.453 4.153 253 HB THR 32 HB THR 32 19.304 6.557 2.149 254 HG1 THR 32 HG1 THR 32 20.757 6.996 3.794 255 1HG2 THR 32 1HG2 THR 32 18.703 8.410 0.610 256 2HG2 THR 32 2HG2 THR 32 20.376 7.869 0.476 257 3HG2 THR 32 3HG2 THR 32 19.998 9.364 1.332 258 H TRP 33 H TRP 33 18.346 10.277 1.990 259 HA TRP 33 HA TRP 33 18.267 12.158 4.066 260 1HB TRP 33 1HB TRP 33 20.574 11.265 4.472 261 2HB TRP 33 2HB TRP 33 21.029 11.846 2.874 262 HD1 TRP 33 HD1 TRP 33 22.383 13.992 3.108 263 HE1 TRP 33 HE1 TRP 33 22.281 16.097 4.586 264 HE3 TRP 33 HE3 TRP 33 18.405 12.722 6.056 265 HZ2 TRP 33 HZ2 TRP 33 20.722 17.087 6.720 266 HZ3 TRP 33 HZ3 TRP 33 17.671 14.303 7.792 267 HH2 TRP 33 HH2 TRP 33 18.806 16.440 8.117 268 H HIS 34 H HIS 34 20.224 12.033 1.087 269 HA HIS 34 HA HIS 34 18.385 13.332 -0.572 270 1HB HIS 34 1HB HIS 34 19.079 15.149 1.210 271 2HB HIS 34 2HB HIS 34 20.512 15.290 0.198 272 HD1 HIS 34 HD1 HIS 34 19.949 15.819 -2.426 273 HD2 HIS 34 HD2 HIS 34 16.967 16.621 0.355 274 HE1 HIS 34 HE1 HIS 34 18.358 17.388 -3.581 275 HE2 HIS 34 HE2 HIS 34 16.522 17.800 -1.905 276 H ALA 35 H ALA 35 19.075 13.308 -2.658 277 HA ALA 35 HA ALA 35 20.364 12.787 -4.460 278 1HB ALA 35 1HB ALA 35 22.549 13.719 -4.578 279 2HB ALA 35 2HB ALA 35 22.701 13.750 -2.822 280 3HB ALA 35 3HB ALA 35 21.562 14.829 -3.628 281 H ARG 36 H ARG 36 22.856 11.757 -4.814 282 HA ARG 36 HA ARG 36 23.634 9.715 -3.057 283 1HB ARG 36 1HB ARG 36 21.268 9.080 -4.391 284 2HB ARG 36 2HB ARG 36 22.515 8.222 -5.285 285 1HG ARG 36 1HG ARG 36 21.945 8.011 -2.336 286 2HG ARG 36 2HG ARG 36 21.617 6.795 -3.573 287 1HD ARG 36 1HD ARG 36 24.181 6.998 -4.033 288 2HD ARG 36 2HD ARG 36 24.225 7.659 -2.399 289 HE ARG 36 HE ARG 36 23.825 5.560 -1.572 290 1HH1 ARG 36 1HH1 ARG 36 23.144 5.580 -4.995 291 2HH1 ARG 36 2HH1 ARG 36 22.943 3.862 -5.092 292 1HH2 ARG 36 1HH2 ARG 36 23.561 3.302 -1.698 293 2HH2 ARG 36 2HH2 ARG 36 23.179 2.569 -3.221 294 H PHE 37 H PHE 37 23.275 10.556 -6.481 295 HA PHE 37 HA PHE 37 25.923 9.456 -7.049 296 1HB PHE 37 1HB PHE 37 23.520 10.087 -8.633 297 2HB PHE 37 2HB PHE 37 25.043 10.482 -9.425 298 HD1 PHE 37 HD1 PHE 37 22.849 7.829 -8.286 299 HD2 PHE 37 HD2 PHE 37 26.680 8.718 -9.913 300 HE1 PHE 37 HE1 PHE 37 23.119 5.469 -8.928 301 HE2 PHE 37 HE2 PHE 37 26.957 6.360 -10.559 302 HZ PHE 37 HZ PHE 37 25.175 4.732 -10.067 303 H ALA 38 H ALA 38 27.168 10.873 -8.751 304 HA ALA 38 HA ALA 38 27.756 13.360 -7.409 305 1HB ALA 38 1HB ALA 38 29.323 11.574 -8.677 306 2HB ALA 38 2HB ALA 38 29.775 13.258 -8.411 307 3HB ALA 38 3HB ALA 38 29.099 12.760 -9.963 308 H TYR 39 H TYR 39 26.557 15.099 -7.803 309 HA TYR 39 HA TYR 39 25.822 15.679 -10.596 310 1HB TYR 39 1HB TYR 39 23.963 14.998 -8.826 311 2HB TYR 39 2HB TYR 39 24.108 16.693 -8.374 312 HD1 TYR 39 HD1 TYR 39 22.514 18.057 -9.313 313 HD2 TYR 39 HD2 TYR 39 23.949 14.750 -11.571 314 HE1 TYR 39 HE1 TYR 39 21.021 18.681 -11.164 315 HE2 TYR 39 HE2 TYR 39 22.461 15.365 -13.430 316 HH TYR 39 HH TYR 39 20.981 18.318 -13.699 317 H ASP 40 H ASP 40 26.730 17.478 -11.317 318 HA ASP 40 HA ASP 40 27.730 19.441 -9.388 319 1HB ASP 40 1HB ASP 40 28.992 18.325 -11.500 320 2HB ASP 40 2HB ASP 40 28.333 19.764 -12.271 321 HD2 ASP 40 HD2 ASP 40 31.517 20.179 -10.157 322 H LYS 41 H LYS 41 27.281 21.653 -9.574 323 HA LYS 41 HA LYS 41 25.968 23.479 -9.907 324 1HB LYS 41 1HB LYS 41 25.370 22.190 -12.576 325 2HB LYS 41 2HB LYS 41 25.114 23.879 -12.159 326 1HG LYS 41 1HG LYS 41 27.105 24.169 -13.143 327 2HG LYS 41 2HG LYS 41 27.742 23.624 -11.590 328 1HD LYS 41 1HD LYS 41 28.581 21.765 -12.494 329 2HD LYS 41 2HD LYS 41 27.057 21.390 -13.301 330 1HE LYS 41 1HE LYS 41 28.860 21.671 -14.918 331 2HE LYS 41 2HE LYS 41 27.632 22.919 -15.114 332 1HZ LYS 41 1HZ LYS 41 29.306 24.126 -13.434 333 2HZ LYS 41 2HZ LYS 41 29.420 24.259 -15.116 334 3HZ LYS 41 3HZ LYS 41 30.403 23.160 -14.287 335 H GLU 42 H GLU 42 24.494 22.950 -8.274 336 HA GLU 42 HA GLU 42 22.148 21.376 -8.922 337 1HB GLU 42 1HB GLU 42 23.498 21.684 -6.618 338 2HB GLU 42 2HB GLU 42 22.271 22.923 -6.394 339 1HG GLU 42 1HG GLU 42 20.632 21.428 -6.082 340 2HG GLU 42 2HG GLU 42 21.248 20.339 -7.323 341 HE2 GLU 42 HE2 GLU 42 23.167 18.580 -4.999 342 H LYS 43 H LYS 43 19.981 22.341 -8.119 343 HA LYS 43 HA LYS 43 19.704 25.190 -8.564 344 1HB LYS 43 1HB LYS 43 19.656 23.911 -10.828 345 2HB LYS 43 2HB LYS 43 18.057 23.394 -10.314 346 1HG LYS 43 1HG LYS 43 17.242 25.275 -11.143 347 2HG LYS 43 2HG LYS 43 18.124 26.160 -9.897 348 1HD LYS 43 1HD LYS 43 18.732 27.093 -12.008 349 2HD LYS 43 2HD LYS 43 20.110 26.157 -11.426 350 1HE LYS 43 1HE LYS 43 19.705 24.413 -12.943 351 2HE LYS 43 2HE LYS 43 18.067 24.971 -13.279 352 1HZ LYS 43 1HZ LYS 43 20.239 26.809 -13.913 353 2HZ LYS 43 2HZ LYS 43 18.794 26.513 -14.741 354 3HZ LYS 43 3HZ LYS 43 20.092 25.441 -14.899 355 H THR 44 H THR 44 17.685 26.021 -7.898 356 HA THR 44 HA THR 44 16.223 24.203 -6.118 357 HB THR 44 HB THR 44 15.923 27.193 -6.134 358 HG1 THR 44 HG1 THR 44 18.008 27.198 -5.753 359 1HG2 THR 44 1HG2 THR 44 14.538 25.505 -4.698 360 2HG2 THR 44 2HG2 THR 44 15.137 27.010 -3.999 361 3HG2 THR 44 3HG2 THR 44 15.988 25.496 -3.695 362 H ASP 45 H ASP 45 14.003 23.993 -6.197 363 HA ASP 45 HA ASP 45 12.589 25.369 -8.368 364 1HB ASP 45 1HB ASP 45 13.423 22.830 -8.734 365 2HB ASP 45 2HB ASP 45 11.879 22.522 -7.946 366 HD2 ASP 45 HD2 ASP 45 10.217 24.159 -10.672 367 H ARG 46 H ARG 46 12.206 23.156 -5.605 368 HA ARG 46 HA ARG 46 10.140 24.856 -4.506 369 1HB ARG 46 1HB ARG 46 9.236 22.959 -6.195 370 2HB ARG 46 2HB ARG 46 9.291 22.024 -4.706 371 1HG ARG 46 1HG ARG 46 7.574 23.151 -3.772 372 2HG ARG 46 2HG ARG 46 8.027 24.683 -4.525 373 1HD ARG 46 1HD ARG 46 7.304 23.225 -6.696 374 2HD ARG 46 2HD ARG 46 6.221 22.565 -5.471 375 HE ARG 46 HE ARG 46 6.259 25.423 -5.474 376 1HH1 ARG 46 1HH1 ARG 46 4.897 22.623 -7.048 377 2HH1 ARG 46 2HH1 ARG 46 3.480 23.459 -7.587 378 1HH2 ARG 46 1HH2 ARG 46 4.395 26.525 -6.182 379 2HH2 ARG 46 2HH2 ARG 46 3.196 25.675 -7.097 380 H TYR 47 H TYR 47 9.170 23.522 -2.483 381 HA TYR 47 HA TYR 47 11.420 22.210 -1.120 382 1HB TYR 47 1HB TYR 47 10.859 23.452 0.945 383 2HB TYR 47 2HB TYR 47 11.383 24.519 -0.354 384 HD1 TYR 47 HD1 TYR 47 8.989 24.054 2.153 385 HD2 TYR 47 HD2 TYR 47 9.390 25.468 -1.839 386 HE1 TYR 47 HE1 TYR 47 6.933 25.376 2.422 387 HE2 TYR 47 HE2 TYR 47 7.336 26.794 -1.582 388 HH TYR 47 HH TYR 47 6.072 27.841 0.529 389 H ASN 48 H ASN 48 10.425 20.201 -1.413 390 HA ASN 48 HA ASN 48 7.789 19.814 -0.200 391 1HB ASN 48 1HB ASN 48 9.325 18.482 -2.308 392 2HB ASN 48 2HB ASN 48 8.573 17.356 -1.182 393 1HD2 ASN 48 1HD2 ASN 48 7.164 16.619 -2.771 394 2HD2 ASN 48 2HD2 ASN 48 5.815 17.557 -3.306 395 H GLU 49 H GLU 49 7.597 19.062 1.797 396 HA GLU 49 HA GLU 49 9.946 17.905 3.106 397 1HB GLU 49 1HB GLU 49 8.526 18.219 5.194 398 2HB GLU 49 2HB GLU 49 9.050 19.684 4.375 399 1HG GLU 49 1HG GLU 49 6.898 20.027 3.433 400 2HG GLU 49 2HG GLU 49 6.352 18.432 3.950 401 HE2 GLU 49 HE2 GLU 49 5.019 20.111 6.644 402 H ARG 50 H ARG 50 10.104 15.768 3.055 403 HA ARG 50 HA ARG 50 7.789 14.091 2.669 404 1HB ARG 50 1HB ARG 50 10.728 13.497 3.004 405 2HB ARG 50 2HB ARG 50 9.515 12.237 2.827 406 1HG ARG 50 1HG ARG 50 8.858 13.559 0.680 407 2HG ARG 50 2HG ARG 50 10.485 14.226 0.831 408 1HD ARG 50 1HD ARG 50 11.126 11.686 1.129 409 2HD ARG 50 2HD ARG 50 9.614 11.435 0.259 410 HE ARG 50 HE ARG 50 11.300 13.348 -1.027 411 1HH1 ARG 50 1HH1 ARG 50 10.746 9.929 -0.599 412 2HH1 ARG 50 2HH1 ARG 50 11.482 9.496 -2.106 413 1HH2 ARG 50 1HH2 ARG 50 12.269 12.780 -3.008 414 2HH2 ARG 50 2HH2 ARG 50 12.347 11.113 -3.472 415 HA PRO 51 HA PRO 51 6.691 13.139 6.826 416 1HB PRO 51 1HB PRO 51 6.747 10.285 5.972 417 2HB PRO 51 2HB PRO 51 5.457 11.198 6.764 418 1HG PRO 51 1HG PRO 51 5.304 10.605 4.174 419 2HG PRO 51 2HG PRO 51 4.751 12.177 4.783 420 1HD PRO 51 1HD PRO 51 7.249 11.487 3.300 421 2HD PRO 51 2HD PRO 51 6.244 12.948 3.204 422 H TRP 52 H TRP 52 7.341 11.691 8.678 423 HA TRP 52 HA TRP 52 9.864 10.344 8.544 424 1HB TRP 52 1HB TRP 52 10.319 12.925 8.634 425 2HB TRP 52 2HB TRP 52 9.906 12.746 10.336 426 HD1 TRP 52 HD1 TRP 52 11.371 9.748 10.452 427 HE1 TRP 52 HE1 TRP 52 13.934 9.735 10.687 428 HE3 TRP 52 HE3 TRP 52 12.360 14.497 8.836 429 HZ2 TRP 52 HZ2 TRP 52 16.090 11.504 10.246 430 HZ3 TRP 52 HZ3 TRP 52 14.698 15.259 8.772 431 HH2 TRP 52 HH2 TRP 52 16.524 13.792 9.464 432 H GLY 53 H GLY 53 7.136 9.849 9.435 433 1HA GLY 53 1HA GLY 53 7.543 9.510 12.336 434 2HA GLY 53 2HA GLY 53 5.981 9.527 11.533 435 H GLY 54 H GLY 54 5.170 7.659 10.640 436 1HA GLY 54 1HA GLY 54 6.192 5.388 9.765 437 2HA GLY 54 2HA GLY 54 6.533 5.214 11.480 438 H GLY 55 H GLY 55 4.971 3.363 10.188 439 1HA GLY 55 1HA GLY 55 2.337 3.906 11.401 440 2HA GLY 55 2HA GLY 55 2.459 3.195 9.799 441 H PHE 56 H PHE 56 1.106 2.006 11.969 442 HA PHE 56 HA PHE 56 2.511 -0.530 12.048 443 1HB PHE 56 1HB PHE 56 2.071 -0.697 14.560 444 2HB PHE 56 2HB PHE 56 3.408 0.331 14.055 445 HD1 PHE 56 HD1 PHE 56 2.990 2.834 13.899 446 HD2 PHE 56 HD2 PHE 56 0.353 0.148 15.884 447 HE1 PHE 56 HE1 PHE 56 2.016 4.718 15.146 448 HE2 PHE 56 HE2 PHE 56 -0.627 2.027 17.134 449 HZ PHE 56 HZ PHE 56 0.204 4.316 16.765 450 H GLY 57 H GLY 57 1.154 -2.310 12.591 451 1HA GLY 57 1HA GLY 57 -1.478 -2.211 13.443 452 2HA GLY 57 2HA GLY 57 -1.530 -1.999 11.699 453 H LEU 58 H LEU 58 -2.792 -4.024 11.848 454 HA LEU 58 HA LEU 58 -0.981 -6.336 11.724 455 1HB LEU 58 1HB LEU 58 -3.660 -6.173 13.089 456 2HB LEU 58 2HB LEU 58 -2.920 -7.696 12.640 457 HG LEU 58 HG LEU 58 -1.316 -5.816 14.297 458 1HD1 LEU 58 1HD1 LEU 58 -3.831 -7.134 15.153 459 2HD1 LEU 58 2HD1 LEU 58 -3.099 -5.624 15.696 460 3HD1 LEU 58 3HD1 LEU 58 -2.464 -7.168 16.265 461 1HD2 LEU 58 1HD2 LEU 58 -0.323 -7.787 15.108 462 2HD2 LEU 58 2HD2 LEU 58 -0.547 -8.060 13.380 463 3HD2 LEU 58 3HD2 LEU 58 -1.656 -8.791 14.539 464 H SER 59 H SER 59 -2.213 -8.258 10.664 465 HA SER 59 HA SER 59 -4.079 -7.376 8.603 466 1HB SER 59 1HB SER 59 -1.468 -7.381 7.940 467 2HB SER 59 2HB SER 59 -1.854 -9.070 7.608 468 HG SER 59 HG SER 59 -2.297 -7.968 5.757 469 H ARG 60 H ARG 60 -4.848 -9.294 7.281 470 HA ARG 60 HA ARG 60 -4.662 -11.859 8.633 471 1HB ARG 60 1HB ARG 60 -6.667 -10.215 9.433 472 2HB ARG 60 2HB ARG 60 -7.452 -11.047 8.098 473 1HG ARG 60 1HG ARG 60 -7.975 -12.566 9.654 474 2HG ARG 60 2HG ARG 60 -6.322 -13.132 9.406 475 1HD ARG 60 1HD ARG 60 -6.832 -12.855 11.783 476 2HD ARG 60 2HD ARG 60 -5.554 -11.758 11.261 477 HE ARG 60 HE ARG 60 -6.899 -10.009 11.832 478 1HH1 ARG 60 1HH1 ARG 60 -8.900 -12.838 11.410 479 2HH1 ARG 60 2HH1 ARG 60 -10.346 -12.049 11.947 480 1HH2 ARG 60 1HH2 ARG 60 -8.799 -8.971 12.539 481 2HH2 ARG 60 2HH2 ARG 60 -10.288 -9.853 12.588 482 H TRP 61 H TRP 61 -6.293 -13.433 7.427 483 HA TRP 61 HA TRP 61 -6.365 -12.814 4.569 484 1HB TRP 61 1HB TRP 61 -5.564 -15.323 4.297 485 2HB TRP 61 2HB TRP 61 -4.407 -14.005 4.430 486 HD1 TRP 61 HD1 TRP 61 -6.215 -15.461 7.498 487 HE1 TRP 61 HE1 TRP 61 -4.460 -16.555 9.029 488 HE3 TRP 61 HE3 TRP 61 -2.118 -15.043 4.467 489 HZ2 TRP 61 HZ2 TRP 61 -1.704 -17.161 8.961 490 HZ3 TRP 61 HZ3 TRP 61 0.039 -15.906 5.275 491 HH2 TRP 61 HH2 TRP 61 0.241 -16.942 7.477 492 H ASP 62 H ASP 62 -8.477 -12.938 4.168 493 HA ASP 62 HA ASP 62 -10.321 -14.512 5.581 494 1HB ASP 62 1HB ASP 62 -10.478 -12.519 3.679 495 2HB ASP 62 2HB ASP 62 -11.106 -13.923 2.823 496 HD2 ASP 62 HD2 ASP 62 -14.074 -13.700 4.494 497 H GLU 63 H GLU 63 -11.284 -16.466 5.164 498 HA GLU 63 HA GLU 63 -9.739 -18.477 3.987 499 1HB GLU 63 1HB GLU 63 -11.742 -19.906 4.260 500 2HB GLU 63 2HB GLU 63 -11.357 -18.986 5.708 501 1HG GLU 63 1HG GLU 63 -13.229 -17.643 3.913 502 2HG GLU 63 2HG GLU 63 -13.819 -19.173 4.562 503 HE2 GLU 63 HE2 GLU 63 -13.164 -16.208 7.127 504 H LYS 64 H LYS 64 -11.849 -16.215 2.528 505 HA LYS 64 HA LYS 64 -12.363 -17.872 0.196 506 1HB LYS 64 1HB LYS 64 -14.037 -16.237 1.214 507 2HB LYS 64 2HB LYS 64 -13.052 -14.957 0.518 508 1HG LYS 64 1HG LYS 64 -13.380 -16.447 -1.666 509 2HG LYS 64 2HG LYS 64 -14.849 -16.900 -0.798 510 1HD LYS 64 1HD LYS 64 -14.834 -14.195 -0.476 511 2HD LYS 64 2HD LYS 64 -14.117 -14.363 -2.079 512 1HE LYS 64 1HE LYS 64 -16.432 -14.185 -2.450 513 2HE LYS 64 2HE LYS 64 -16.063 -15.901 -2.622 514 1HZ LYS 64 1HZ LYS 64 -16.679 -15.936 -0.106 515 2HZ LYS 64 2HZ LYS 64 -17.896 -15.967 -1.281 516 3HZ LYS 64 3HZ LYS 64 -17.527 -14.521 -0.486 517 H GLY 65 H GLY 65 -9.597 -17.003 0.927 518 1HA GLY 65 1HA GLY 65 -7.706 -16.417 -0.232 519 2HA GLY 65 2HA GLY 65 -8.689 -16.417 -1.689 520 H ASN 66 H ASN 66 -8.656 -14.425 1.271 521 HA ASN 66 HA ASN 66 -8.226 -12.068 -0.432 522 1HB ASN 66 1HB ASN 66 -10.401 -12.540 1.569 523 2HB ASN 66 2HB ASN 66 -9.787 -10.906 1.334 524 1HD2 ASN 66 1HD2 ASN 66 -12.241 -10.942 0.765 525 2HD2 ASN 66 2HD2 ASN 66 -12.585 -11.087 -0.922 526 H TRP 67 H TRP 67 -7.327 -10.220 0.682 527 HA TRP 67 HA TRP 67 -6.006 -10.873 3.226 528 1HB TRP 67 1HB TRP 67 -4.766 -10.194 0.639 529 2HB TRP 67 2HB TRP 67 -4.144 -9.288 2.014 530 HD1 TRP 67 HD1 TRP 67 -4.856 -13.032 1.223 531 HE1 TRP 67 HE1 TRP 67 -2.933 -14.422 2.221 532 HE3 TRP 67 HE3 TRP 67 -2.151 -9.257 3.364 533 HZ2 TRP 67 HZ2 TRP 67 -0.581 -13.977 3.717 534 HZ3 TRP 67 HZ3 TRP 67 -0.077 -9.825 4.559 535 HH2 TRP 67 HH2 TRP 67 0.691 -12.136 4.732 536 H HIS 68 H HIS 68 -6.847 -9.497 4.649 537 HA HIS 68 HA HIS 68 -7.066 -6.661 3.878 538 1HB HIS 68 1HB HIS 68 -9.004 -6.500 5.429 539 2HB HIS 68 2HB HIS 68 -9.303 -7.566 4.061 540 HD1 HIS 68 HD1 HIS 68 -9.518 -7.440 7.665 541 HD2 HIS 68 HD2 HIS 68 -8.977 -10.411 4.811 542 HE1 HIS 68 HE1 HIS 68 -10.068 -9.599 8.830 543 HE2 HIS 68 HE2 HIS 68 -9.646 -11.390 7.109 544 H GLY 69 H GLY 69 -6.230 -5.180 5.261 545 1HA GLY 69 1HA GLY 69 -5.550 -5.936 7.986 546 2HA GLY 69 2HA GLY 69 -4.185 -5.607 6.929 547 H LEU 70 H LEU 70 -5.378 -4.233 9.361 548 HA LEU 70 HA LEU 70 -5.849 -1.580 8.188 549 1HB LEU 70 1HB LEU 70 -6.642 -0.984 10.491 550 2HB LEU 70 2HB LEU 70 -7.616 -2.178 9.653 551 HG LEU 70 HG LEU 70 -5.492 -3.189 11.469 552 1HD1 LEU 70 1HD1 LEU 70 -6.806 -2.895 13.439 553 2HD1 LEU 70 2HD1 LEU 70 -8.119 -2.159 12.519 554 3HD1 LEU 70 3HD1 LEU 70 -6.583 -1.310 12.695 555 1HD2 LEU 70 1HD2 LEU 70 -8.312 -4.134 11.377 556 2HD2 LEU 70 2HD2 LEU 70 -6.820 -5.048 11.599 557 3HD2 LEU 70 3HD2 LEU 70 -7.264 -4.461 9.996 558 H TYR 71 H TYR 71 -4.398 0.007 8.417 559 HA TYR 71 HA TYR 71 -2.216 -0.371 10.358 560 1HB TYR 71 1HB TYR 71 -1.893 0.833 7.605 561 2HB TYR 71 2HB TYR 71 -0.618 0.488 8.769 562 HD1 TYR 71 HD1 TYR 71 -0.777 -2.133 9.597 563 HD2 TYR 71 HD2 TYR 71 -1.958 -0.598 5.810 564 HE1 TYR 71 HE1 TYR 71 -0.473 -4.363 8.607 565 HE2 TYR 71 HE2 TYR 71 -1.659 -2.824 4.808 566 HH TYR 71 HH TYR 71 -1.258 -5.640 6.669 567 H ALA 72 H ALA 72 -1.434 1.465 11.374 568 HA ALA 72 HA ALA 72 -2.960 3.940 10.888 569 1HB ALA 72 1HB ALA 72 -3.465 2.605 13.031 570 2HB ALA 72 2HB ALA 72 -3.184 4.341 13.169 571 3HB ALA 72 3HB ALA 72 -1.903 3.204 13.594 572 H MET 73 H MET 73 -1.635 5.373 9.986 573 HA MET 73 HA MET 73 1.210 5.340 10.581 574 1HB MET 73 1HB MET 73 -0.381 7.077 8.684 575 2HB MET 73 2HB MET 73 1.373 7.041 8.806 576 1HG MET 73 1HG MET 73 1.202 5.602 7.100 577 2HG MET 73 2HG MET 73 0.881 4.434 8.379 578 1HE MET 73 1HE MET 73 -1.534 5.644 4.923 579 2HE MET 73 2HE MET 73 -0.087 6.424 5.564 580 3HE MET 73 3HE MET 73 -1.685 6.995 6.048 581 H ALA 74 H ALA 74 2.330 7.419 11.017 582 HA ALA 74 HA ALA 74 0.717 9.389 12.452 583 1HB ALA 74 1HB ALA 74 3.172 8.570 13.868 584 2HB ALA 74 2HB ALA 74 1.833 7.422 13.901 585 3HB ALA 74 3HB ALA 74 1.604 9.064 14.503 586 H PHE 75 H PHE 75 1.499 11.436 12.328 587 HA PHE 75 HA PHE 75 3.951 11.801 10.756 588 1HB PHE 75 1HB PHE 75 1.494 12.830 10.295 589 2HB PHE 75 2HB PHE 75 2.183 14.119 11.276 590 HD1 PHE 75 HD1 PHE 75 2.233 12.432 8.070 591 HD2 PHE 75 HD2 PHE 75 4.185 15.322 10.506 592 HE1 PHE 75 HE1 PHE 75 3.405 13.301 6.090 593 HE2 PHE 75 HE2 PHE 75 5.361 16.199 8.530 594 HZ PHE 75 HZ PHE 75 4.971 15.189 6.319 595 H LYS 76 H LYS 76 5.414 13.523 11.324 596 HA LYS 76 HA LYS 76 5.577 13.883 14.232 597 1HB LYS 76 1HB LYS 76 7.468 13.043 12.414 598 2HB LYS 76 2HB LYS 76 7.888 14.734 12.646 599 1HG LYS 76 1HG LYS 76 7.342 13.390 15.157 600 2HG LYS 76 2HG LYS 76 8.638 12.613 14.245 601 1HD LYS 76 1HD LYS 76 8.710 15.568 14.416 602 2HD LYS 76 2HD LYS 76 9.053 14.677 15.900 603 1HE LYS 76 1HE LYS 76 10.961 13.722 15.048 604 2HE LYS 76 2HE LYS 76 10.404 13.843 13.380 605 1HZ LYS 76 1HZ LYS 76 11.909 15.512 13.370 606 2HZ LYS 76 2HZ LYS 76 11.774 15.819 15.028 607 3HZ LYS 76 3HZ LYS 76 10.599 16.405 13.963 608 H ASP 77 H ASP 77 5.017 15.776 15.059 609 HA ASP 77 HA ASP 77 4.531 18.055 13.384 610 1HB ASP 77 1HB ASP 77 3.422 17.223 15.694 611 2HB ASP 77 2HB ASP 77 4.578 18.389 16.330 612 HD2 ASP 77 HD2 ASP 77 1.790 19.863 13.907 613 H SER 78 H SER 78 5.295 20.259 14.583 614 HA SER 78 HA SER 78 8.137 20.313 14.160 615 1HB SER 78 1HB SER 78 6.996 22.207 13.332 616 2HB SER 78 2HB SER 78 6.083 22.414 14.826 617 HG SER 78 HG SER 78 8.777 23.025 14.288 618 H TRP 79 H TRP 79 5.961 20.483 16.906 619 HA TRP 79 HA TRP 79 8.281 20.711 18.704 620 1HB TRP 79 1HB TRP 79 6.130 22.303 18.718 621 2HB TRP 79 2HB TRP 79 5.512 21.018 19.750 622 HD1 TRP 79 HD1 TRP 79 6.645 20.711 22.149 623 HE1 TRP 79 HE1 TRP 79 8.117 22.271 23.572 624 HE3 TRP 79 HE3 TRP 79 7.961 24.093 18.548 625 HZ2 TRP 79 HZ2 TRP 79 9.635 24.624 23.215 626 HZ3 TRP 79 HZ3 TRP 79 9.426 25.969 19.171 627 HH2 TRP 79 HH2 TRP 79 10.244 26.228 21.457 628 H ASN 80 H ASN 80 5.017 19.281 18.906 629 HA ASN 80 HA ASN 80 5.886 16.619 19.150 630 1HB ASN 80 1HB ASN 80 5.860 18.218 21.628 631 2HB ASN 80 2HB ASN 80 5.011 16.679 21.733 632 1HD2 ASN 80 1HD2 ASN 80 7.615 17.760 22.825 633 2HD2 ASN 80 2HD2 ASN 80 8.772 16.540 22.431 634 H LYS 81 H LYS 81 4.079 16.712 17.641 635 HA LYS 81 HA LYS 81 1.564 16.195 19.022 636 1HB LYS 81 1HB LYS 81 2.076 18.501 17.276 637 2HB LYS 81 2HB LYS 81 0.653 17.570 16.829 638 1HG LYS 81 1HG LYS 81 0.578 17.904 19.631 639 2HG LYS 81 2HG LYS 81 0.969 19.473 18.924 640 1HD LYS 81 1HD LYS 81 -1.385 19.392 19.016 641 2HD LYS 81 2HD LYS 81 -0.968 19.071 17.331 642 1HE LYS 81 1HE LYS 81 -1.173 16.643 17.797 643 2HE LYS 81 2HE LYS 81 -1.716 17.037 19.428 644 1HZ LYS 81 1HZ LYS 81 -3.576 16.602 17.947 645 2HZ LYS 81 2HZ LYS 81 -3.077 17.846 16.914 646 3HZ LYS 81 3HZ LYS 81 -3.602 18.207 18.481 647 H TRP 82 H TRP 82 2.269 14.025 18.406 648 HA TRP 82 HA TRP 82 2.626 13.191 15.756 649 1HB TRP 82 1HB TRP 82 2.072 10.917 16.625 650 2HB TRP 82 2HB TRP 82 3.286 11.759 17.583 651 HD1 TRP 82 HD1 TRP 82 2.526 12.632 20.027 652 HE1 TRP 82 HE1 TRP 82 0.652 11.832 21.599 653 HE3 TRP 82 HE3 TRP 82 -0.269 9.974 16.672 654 HZ2 TRP 82 HZ2 TRP 82 -1.700 10.279 21.438 655 HZ3 TRP 82 HZ3 TRP 82 -2.316 8.861 17.461 656 HH2 TRP 82 HH2 TRP 82 -3.015 9.010 19.797 657 H GLU 83 H GLU 83 1.182 13.655 14.211 658 HA GLU 83 HA GLU 83 -1.611 13.855 14.649 659 1HB GLU 83 1HB GLU 83 -0.220 13.449 12.001 660 2HB GLU 83 2HB GLU 83 -1.799 14.173 12.274 661 1HG GLU 83 1HG GLU 83 -0.291 15.808 13.769 662 2HG GLU 83 2HG GLU 83 0.895 15.330 12.557 663 HE2 GLU 83 HE2 GLU 83 -2.294 17.303 11.225 664 HA PRO 84 HA PRO 84 -2.448 9.464 14.421 665 1HB PRO 84 1HB PRO 84 -5.112 9.583 14.772 666 2HB PRO 84 2HB PRO 84 -3.981 9.880 16.098 667 1HG PRO 84 1HG PRO 84 -5.471 11.847 14.403 668 2HG PRO 84 2HG PRO 84 -5.205 11.857 16.156 669 1HD PRO 84 1HD PRO 84 -3.739 13.351 14.401 670 2HD PRO 84 2HD PRO 84 -3.110 12.769 15.955 671 H ILE 85 H ILE 85 -2.869 8.122 12.760 672 HA ILE 85 HA ILE 85 -4.645 9.003 10.606 673 HB ILE 85 HB ILE 85 -1.917 7.860 10.022 674 1HG1 ILE 85 1HG1 ILE 85 -1.744 10.120 11.028 675 2HG1 ILE 85 2HG1 ILE 85 -1.231 10.091 9.345 676 1HG2 ILE 85 1HG2 ILE 85 -3.509 7.375 8.301 677 2HG2 ILE 85 2HG2 ILE 85 -2.443 8.655 7.723 678 3HG2 ILE 85 3HG2 ILE 85 -4.069 9.047 8.282 679 1HD1 ILE 85 1HD1 ILE 85 -4.032 10.704 9.539 680 2HD1 ILE 85 2HD1 ILE 85 -2.723 11.630 8.803 681 3HD1 ILE 85 3HD1 ILE 85 -3.072 11.809 10.523 682 H ALA 86 H ALA 86 -5.866 7.400 9.777 683 HA ALA 86 HA ALA 86 -5.087 4.618 10.284 684 1HB ALA 86 1HB ALA 86 -7.501 6.005 11.303 685 2HB ALA 86 2HB ALA 86 -6.551 4.704 12.020 686 3HB ALA 86 3HB ALA 86 -7.695 4.350 10.725 687 H GLY 87 H GLY 87 -6.010 3.084 8.855 688 1HA GLY 87 1HA GLY 87 -7.844 3.802 6.803 689 2HA GLY 87 2HA GLY 87 -6.195 3.841 6.197 690 H TYR 88 H TYR 88 -8.521 2.068 5.589 691 HA TYR 88 HA TYR 88 -7.387 -0.524 6.387 692 1HB TYR 88 1HB TYR 88 -9.954 0.277 6.591 693 2HB TYR 88 2HB TYR 88 -9.992 -0.419 4.973 694 HD1 TYR 88 HD1 TYR 88 -10.166 -2.736 4.685 695 HD2 TYR 88 HD2 TYR 88 -9.079 -1.188 8.496 696 HE1 TYR 88 HE1 TYR 88 -10.385 -4.985 5.655 697 HE2 TYR 88 HE2 TYR 88 -9.294 -3.432 9.476 698 HH TYR 88 HH TYR 88 -9.273 -5.743 8.810 699 H GLY 89 H GLY 89 -7.000 -2.139 4.833 700 1HA GLY 89 1HA GLY 89 -7.126 -1.315 2.018 701 2HA GLY 89 2HA GLY 89 -5.573 -1.793 2.685 702 H TRP 90 H TRP 90 -7.228 -2.977 0.527 703 HA TRP 90 HA TRP 90 -7.195 -5.721 1.550 704 1HB TRP 90 1HB TRP 90 -9.296 -6.165 0.197 705 2HB TRP 90 2HB TRP 90 -9.515 -5.217 1.665 706 HD1 TRP 90 HD1 TRP 90 -9.234 -4.677 -2.159 707 HE1 TRP 90 HE1 TRP 90 -10.588 -2.575 -2.767 708 HE3 TRP 90 HE3 TRP 90 -10.574 -3.187 2.544 709 HZ2 TRP 90 HZ2 TRP 90 -12.033 -0.551 -1.429 710 HZ3 TRP 90 HZ3 TRP 90 -11.942 -1.157 2.793 711 HH2 TRP 90 HH2 TRP 90 -12.655 0.132 0.847 712 H GLU 91 H GLU 91 -6.047 -7.007 0.269 713 HA GLU 91 HA GLU 91 -5.879 -6.385 -2.597 714 1HB GLU 91 1HB GLU 91 -3.595 -6.888 -0.698 715 2HB GLU 91 2HB GLU 91 -3.433 -7.133 -2.432 716 1HG GLU 91 1HG GLU 91 -3.414 -4.924 -2.885 717 2HG GLU 91 2HG GLU 91 -4.535 -4.534 -1.581 718 HE2 GLU 91 HE2 GLU 91 -0.731 -4.058 -0.955 719 H SER 92 H SER 92 -5.398 -8.179 -3.955 720 HA SER 92 HA SER 92 -6.144 -10.746 -2.738 721 1HB SER 92 1HB SER 92 -7.303 -9.514 -4.845 722 2HB SER 92 2HB SER 92 -6.097 -10.483 -5.690 723 HG SER 92 HG SER 92 -8.173 -11.362 -3.982 724 H THR 93 H THR 93 -4.825 -12.480 -2.821 725 HA THR 93 HA THR 93 -2.078 -12.083 -3.481 726 HB THR 93 HB THR 93 -2.184 -14.732 -3.106 727 HG1 THR 93 HG1 THR 93 -4.427 -14.853 -3.009 728 1HG2 THR 93 1HG2 THR 93 -1.657 -14.432 -0.865 729 2HG2 THR 93 2HG2 THR 93 -2.669 -12.995 -0.721 730 3HG2 THR 93 3HG2 THR 93 -1.156 -12.922 -1.625 731 H TRP 94 H TRP 94 -0.891 -12.848 -5.181 732 HA TRP 94 HA TRP 94 -2.115 -14.555 -7.178 733 1HB TRP 94 1HB TRP 94 -2.235 -11.762 -7.487 734 2HB TRP 94 2HB TRP 94 -0.952 -12.301 -8.565 735 HD1 TRP 94 HD1 TRP 94 -4.546 -13.581 -7.777 736 HE1 TRP 94 HE1 TRP 94 -5.689 -14.127 -10.019 737 HE3 TRP 94 HE3 TRP 94 -0.725 -12.374 -10.953 738 HZ2 TRP 94 HZ2 TRP 94 -5.054 -14.055 -12.769 739 HZ3 TRP 94 HZ3 TRP 94 -1.073 -12.641 -13.374 740 HH2 TRP 94 HH2 TRP 94 -3.194 -13.465 -14.261 741 H ARG 95 H ARG 95 -0.636 -15.691 -8.373 742 HA ARG 95 HA ARG 95 2.199 -15.004 -8.026 743 1HB ARG 95 1HB ARG 95 0.965 -17.117 -6.724 744 2HB ARG 95 2HB ARG 95 1.719 -17.881 -8.116 745 1HG ARG 95 1HG ARG 95 3.437 -15.983 -6.688 746 2HG ARG 95 2HG ARG 95 2.953 -17.398 -5.751 747 1HD ARG 95 1HD ARG 95 4.244 -17.445 -8.477 748 2HD ARG 95 2HD ARG 95 5.059 -17.773 -6.948 749 HE ARG 95 HE ARG 95 3.414 -19.570 -8.440 750 1HH1 ARG 95 1HH1 ARG 95 4.467 -18.737 -5.219 751 2HH1 ARG 95 2HH1 ARG 95 4.211 -20.328 -4.588 752 1HH2 ARG 95 1HH2 ARG 95 3.075 -21.664 -7.613 753 2HH2 ARG 95 2HH2 ARG 95 3.420 -21.992 -5.947 754 HA PRO 96 HA PRO 96 2.324 -15.432 -12.434 755 1HB PRO 96 1HB PRO 96 4.999 -16.095 -12.663 756 2HB PRO 96 2HB PRO 96 4.375 -14.449 -12.524 757 1HG PRO 96 1HG PRO 96 5.548 -16.216 -10.423 758 2HG PRO 96 2HG PRO 96 5.742 -14.470 -10.660 759 1HD PRO 96 1HD PRO 96 4.113 -15.475 -8.770 760 2HD PRO 96 2HD PRO 96 3.723 -13.980 -9.645 761 H LEU 97 H LEU 97 4.727 -17.766 -11.252 762 HA LEU 97 HA LEU 97 3.157 -20.074 -11.635 763 1HB LEU 97 1HB LEU 97 3.661 -19.061 -14.031 764 2HB LEU 97 2HB LEU 97 5.192 -19.886 -13.803 765 HG LEU 97 HG LEU 97 2.691 -21.438 -13.343 766 1HD1 LEU 97 1HD1 LEU 97 2.284 -21.844 -15.615 767 2HD1 LEU 97 2HD1 LEU 97 3.789 -21.070 -16.112 768 3HD1 LEU 97 3HD1 LEU 97 2.457 -20.093 -15.495 769 1HD2 LEU 97 1HD2 LEU 97 5.525 -21.924 -14.064 770 2HD2 LEU 97 2HD2 LEU 97 4.319 -23.038 -14.711 771 3HD2 LEU 97 3HD2 LEU 97 4.463 -22.809 -12.967 772 H ALA 98 H ALA 98 5.019 -19.036 -9.744 773 HA ALA 98 HA ALA 98 6.737 -19.717 -8.416 774 1HB ALA 98 1HB ALA 98 5.920 -21.806 -8.044 775 2HB ALA 98 2HB ALA 98 7.398 -22.248 -8.896 776 3HB ALA 98 3HB ALA 98 5.861 -22.210 -9.759 777 H ASP 99 H ASP 99 7.312 -18.472 -10.994 778 HA ASP 99 HA ASP 99 9.826 -19.738 -11.788 779 1HB ASP 99 1HB ASP 99 8.122 -18.928 -13.490 780 2HB ASP 99 2HB ASP 99 8.554 -17.289 -13.014 781 HD2 ASP 99 HD2 ASP 99 11.824 -17.786 -14.385 782 H GLU 100 H GLU 100 8.560 -16.840 -10.278 783 HA GLU 100 HA GLU 100 11.287 -15.802 -9.950 784 1HB GLU 100 1HB GLU 100 8.593 -14.566 -10.062 785 2HB GLU 100 2HB GLU 100 9.750 -13.823 -8.966 786 1HG GLU 100 1HG GLU 100 10.281 -14.344 -11.881 787 2HG GLU 100 2HG GLU 100 9.682 -12.816 -11.235 788 HE2 GLU 100 HE2 GLU 100 12.930 -12.733 -9.442 789 H ASN 101 H ASN 101 8.649 -17.223 -8.240 790 HA ASN 101 HA ASN 101 8.416 -17.920 -6.089 791 1HB ASN 101 1HB ASN 101 11.053 -18.266 -6.571 792 2HB ASN 101 2HB ASN 101 11.138 -17.109 -5.245 793 1HD2 ASN 101 1HD2 ASN 101 12.140 -19.637 -4.973 794 2HD2 ASN 101 2HD2 ASN 101 11.168 -20.532 -3.861 795 H PHE 102 H PHE 102 7.888 -15.167 -6.876 796 HA PHE 102 HA PHE 102 8.115 -13.907 -4.223 797 1HB PHE 102 1HB PHE 102 8.507 -12.677 -6.945 798 2HB PHE 102 2HB PHE 102 8.077 -11.697 -5.546 799 HD1 PHE 102 HD1 PHE 102 9.638 -12.901 -3.407 800 HD2 PHE 102 HD2 PHE 102 10.694 -12.151 -7.461 801 HE1 PHE 102 HE1 PHE 102 12.009 -12.775 -2.762 802 HE2 PHE 102 HE2 PHE 102 13.066 -12.025 -6.824 803 HZ PHE 102 HZ PHE 102 13.727 -12.338 -4.471 804 H HIS 103 H HIS 103 6.231 -13.380 -3.331 805 HA HIS 103 HA HIS 103 3.782 -13.841 -4.747 806 1HB HIS 103 1HB HIS 103 4.500 -13.958 -2.115 807 2HB HIS 103 2HB HIS 103 3.623 -12.433 -2.164 808 HD1 HIS 103 HD1 HIS 103 1.638 -13.634 -4.472 809 HD2 HIS 103 HD2 HIS 103 2.392 -15.150 -0.677 810 HE1 HIS 103 HE1 HIS 103 -0.369 -15.036 -3.897 811 HE2 HIS 103 HE2 HIS 103 0.071 -15.874 -1.562 812 H LEU 104 H LEU 104 2.532 -12.423 -5.783 813 HA LEU 104 HA LEU 104 3.071 -9.551 -5.399 814 1HB LEU 104 1HB LEU 104 3.941 -10.300 -7.549 815 2HB LEU 104 2HB LEU 104 2.382 -10.991 -7.962 816 HG LEU 104 HG LEU 104 2.504 -8.079 -7.343 817 1HD1 LEU 104 1HD1 LEU 104 3.116 -7.554 -9.637 818 2HD1 LEU 104 2HD1 LEU 104 3.359 -9.267 -9.979 819 3HD1 LEU 104 3HD1 LEU 104 4.413 -8.439 -8.833 820 1HD2 LEU 104 1HD2 LEU 104 0.922 -8.349 -9.481 821 2HD2 LEU 104 2HD2 LEU 104 0.350 -8.585 -7.829 822 3HD2 LEU 104 3HD2 LEU 104 0.785 -9.978 -8.819 823 H GLY 105 H GLY 105 1.384 -8.495 -4.604 824 1HA GLY 105 1HA GLY 105 -1.311 -9.602 -5.093 825 2HA GLY 105 2HA GLY 105 -0.854 -8.715 -3.646 826 H LEU 106 H LEU 106 -3.086 -8.039 -5.156 827 HA LEU 106 HA LEU 106 -2.352 -5.331 -5.951 828 1HB LEU 106 1HB LEU 106 -3.630 -7.368 -7.730 829 2HB LEU 106 2HB LEU 106 -4.059 -5.677 -7.910 830 HG LEU 106 HG LEU 106 -1.165 -6.365 -7.893 831 1HD1 LEU 106 1HD1 LEU 106 -2.631 -6.582 -10.473 832 2HD1 LEU 106 2HD1 LEU 106 -2.578 -7.983 -9.402 833 3HD1 LEU 106 3HD1 LEU 106 -1.078 -7.267 -9.993 834 1HD2 LEU 106 1HD2 LEU 106 -2.946 -4.341 -9.211 835 2HD2 LEU 106 2HD2 LEU 106 -1.280 -4.595 -9.733 836 3HD2 LEU 106 3HD2 LEU 106 -1.617 -4.075 -8.082 837 H GLY 107 H GLY 107 -3.698 -3.908 -5.060 838 1HA GLY 107 1HA GLY 107 -6.522 -4.380 -4.859 839 2HA GLY 107 2HA GLY 107 -5.711 -4.488 -3.304 840 H PHE 108 H PHE 108 -7.067 -2.674 -2.698 841 HA PHE 108 HA PHE 108 -5.832 -0.130 -3.488 842 1HB PHE 108 1HB PHE 108 -8.804 -0.421 -3.050 843 2HB PHE 108 2HB PHE 108 -7.937 0.976 -3.683 844 HD1 PHE 108 HD1 PHE 108 -8.626 -2.602 -4.448 845 HD2 PHE 108 HD2 PHE 108 -7.800 1.288 -5.963 846 HE1 PHE 108 HE1 PHE 108 -8.990 -3.422 -6.740 847 HE2 PHE 108 HE2 PHE 108 -8.164 0.475 -8.258 848 HZ PHE 108 HZ PHE 108 -8.761 -1.882 -8.648 849 H THR 109 H THR 109 -5.888 1.512 -1.895 850 HA THR 109 HA THR 109 -6.494 0.527 0.816 851 HB THR 109 HB THR 109 -4.079 0.764 0.422 852 HG1 THR 109 HG1 THR 109 -3.674 2.043 2.223 853 1HG2 THR 109 1HG2 THR 109 -4.077 3.680 0.404 854 2HG2 THR 109 2HG2 THR 109 -4.660 2.949 -1.092 855 3HG2 THR 109 3HG2 THR 109 -3.063 2.533 -0.471 856 H ALA 110 H ALA 110 -8.136 1.547 1.729 857 HA ALA 110 HA ALA 110 -8.558 4.395 1.093 858 1HB ALA 110 1HB ALA 110 -10.457 2.130 1.061 859 2HB ALA 110 2HB ALA 110 -10.423 3.600 0.087 860 3HB ALA 110 3HB ALA 110 -11.045 3.649 1.736 861 H GLY 111 H GLY 111 -8.327 5.663 2.808 862 1HA GLY 111 1HA GLY 111 -9.353 4.797 5.398 863 2HA GLY 111 2HA GLY 111 -7.630 5.135 5.311 864 H VAL 112 H VAL 112 -8.373 6.698 7.031 865 HA VAL 112 HA VAL 112 -9.091 9.249 5.745 866 HB VAL 112 HB VAL 112 -10.234 9.918 7.843 867 1HG1 VAL 112 1HG1 VAL 112 -11.660 7.450 7.065 868 2HG1 VAL 112 2HG1 VAL 112 -11.248 8.566 5.762 869 3HG1 VAL 112 3HG1 VAL 112 -12.225 9.119 7.122 870 1HG2 VAL 112 1HG2 VAL 112 -9.196 8.483 9.445 871 2HG2 VAL 112 2HG2 VAL 112 -9.743 7.040 8.591 872 3HG2 VAL 112 3HG2 VAL 112 -10.913 8.081 9.402 873 H THR 113 H THR 113 -7.885 10.996 6.293 874 HA THR 113 HA THR 113 -5.963 10.731 8.494 875 HB THR 113 HB THR 113 -4.595 10.201 6.650 876 HG1 THR 113 HG1 THR 113 -3.189 11.889 6.620 877 1HG2 THR 113 1HG2 THR 113 -5.728 10.621 4.701 878 2HG2 THR 113 2HG2 THR 113 -4.503 11.891 4.682 879 3HG2 THR 113 3HG2 THR 113 -6.154 12.265 5.176 880 H ALA 114 H ALA 114 -5.126 12.765 9.277 881 HA ALA 114 HA ALA 114 -7.055 14.944 8.882 882 1HB ALA 114 1HB ALA 114 -6.512 13.874 11.188 883 2HB ALA 114 2HB ALA 114 -6.671 15.626 11.056 884 3HB ALA 114 3HB ALA 114 -5.070 14.886 11.117 885 H ARG 115 H ARG 115 -6.429 16.974 8.292 886 HA ARG 115 HA ARG 115 -3.803 17.212 7.091 887 1HB ARG 115 1HB ARG 115 -6.366 18.707 6.944 888 2HB ARG 115 2HB ARG 115 -4.894 19.613 6.620 889 1HG ARG 115 1HG ARG 115 -4.448 17.474 5.069 890 2HG ARG 115 2HG ARG 115 -6.212 17.503 5.038 891 1HD ARG 115 1HD ARG 115 -4.974 20.128 4.677 892 2HD ARG 115 2HD ARG 115 -4.567 18.970 3.413 893 HE ARG 115 HE ARG 115 -7.256 18.731 3.647 894 1HH1 ARG 115 1HH1 ARG 115 -5.117 21.444 3.151 895 2HH1 ARG 115 2HH1 ARG 115 -6.279 22.355 2.246 896 1HH2 ARG 115 1HH2 ARG 115 -8.785 19.928 2.456 897 2HH2 ARG 115 2HH2 ARG 115 -8.361 21.495 1.851 898 H ASP 116 H ASP 116 -2.592 19.302 7.378 899 HA ASP 116 HA ASP 116 -1.974 19.649 10.134 900 1HB ASP 116 1HB ASP 116 -0.979 20.757 7.558 901 2HB ASP 116 2HB ASP 116 -0.628 21.671 9.021 902 HD2 ASP 116 HD2 ASP 116 1.072 18.107 8.607 903 H ASN 117 H ASN 117 -3.033 22.063 7.728 904 HA ASN 117 HA ASN 117 -3.667 24.056 9.585 905 1HB ASN 117 1HB ASN 117 -3.400 24.218 7.021 906 2HB ASN 117 2HB ASN 117 -5.099 23.762 6.954 907 1HD2 ASN 117 1HD2 ASN 117 -5.953 25.627 6.236 908 2HD2 ASN 117 2HD2 ASN 117 -5.886 27.126 7.093 909 H TRP 118 H TRP 118 -5.117 23.930 11.160 910 HA TRP 118 HA TRP 118 -7.040 23.538 12.306 911 1HB TRP 118 1HB TRP 118 -7.924 23.964 9.517 912 2HB TRP 118 2HB TRP 118 -9.087 23.159 10.566 913 HD1 TRP 118 HD1 TRP 118 -8.691 26.402 9.361 914 HE1 TRP 118 HE1 TRP 118 -9.365 28.229 11.043 915 HE3 TRP 118 HE3 TRP 118 -8.605 23.626 13.654 916 HZ2 TRP 118 HZ2 TRP 118 -9.804 28.463 13.821 917 HZ3 TRP 118 HZ3 TRP 118 -9.164 24.728 15.781 918 HH2 TRP 118 HH2 TRP 118 -9.751 27.096 15.862 919 H ASN 119 H ASN 119 -9.123 21.922 12.163 920 HA ASN 119 HA ASN 119 -8.697 19.373 11.034 921 1HB ASN 119 1HB ASN 119 -6.867 19.318 12.708 922 2HB ASN 119 2HB ASN 119 -8.055 19.568 13.984 923 1HD2 ASN 119 1HD2 ASN 119 -6.506 17.429 14.210 924 2HD2 ASN 119 2HD2 ASN 119 -7.372 15.978 13.847 925 H TYR 120 H TYR 120 -10.802 19.117 10.593 926 HA TYR 120 HA TYR 120 -12.625 18.696 12.800 927 1HB TYR 120 1HB TYR 120 -14.357 20.215 11.715 928 2HB TYR 120 2HB TYR 120 -13.038 21.015 12.562 929 HD1 TYR 120 HD1 TYR 120 -10.994 21.696 11.069 930 HD2 TYR 120 HD2 TYR 120 -14.891 20.892 9.565 931 HE1 TYR 120 HE1 TYR 120 -10.472 22.989 9.043 932 HE2 TYR 120 HE2 TYR 120 -14.380 22.181 7.535 933 HH TYR 120 HH TYR 120 -12.059 24.320 7.249 934 H ILE 121 H ILE 121 -12.302 18.978 9.274 935 HA ILE 121 HA ILE 121 -14.283 16.852 8.930 936 HB ILE 121 HB ILE 121 -14.057 17.391 6.487 937 1HG1 ILE 121 1HG1 ILE 121 -12.838 20.007 7.147 938 2HG1 ILE 121 2HG1 ILE 121 -11.747 18.626 7.175 939 1HG2 ILE 121 1HG2 ILE 121 -15.020 19.860 6.972 940 2HG2 ILE 121 2HG2 ILE 121 -15.138 19.154 8.584 941 3HG2 ILE 121 3HG2 ILE 121 -15.946 18.379 7.221 942 1HD1 ILE 121 1HD1 ILE 121 -11.551 18.802 4.984 943 2HD1 ILE 121 2HD1 ILE 121 -12.767 20.079 4.943 944 3HD1 ILE 121 3HD1 ILE 121 -13.258 18.389 4.824 945 HA PRO 122 HA PRO 122 -11.107 13.856 8.167 946 1HB PRO 122 1HB PRO 122 -12.556 11.951 6.932 947 2HB PRO 122 2HB PRO 122 -12.743 12.304 8.654 948 1HG PRO 122 1HG PRO 122 -14.433 13.185 6.346 949 2HG PRO 122 2HG PRO 122 -14.937 12.594 7.940 950 1HD PRO 122 1HD PRO 122 -14.860 15.239 7.278 951 2HD PRO 122 2HD PRO 122 -14.630 14.641 8.933 952 H LEU 123 H LEU 123 -9.805 13.017 6.516 953 HA LEU 123 HA LEU 123 -10.351 14.101 3.830 954 1HB LEU 123 1HB LEU 123 -8.425 15.140 5.004 955 2HB LEU 123 2HB LEU 123 -7.663 13.562 5.092 956 HG LEU 123 HG LEU 123 -8.106 13.741 2.422 957 1HD1 LEU 123 1HD1 LEU 123 -7.990 15.851 1.584 958 2HD1 LEU 123 2HD1 LEU 123 -7.134 16.485 2.990 959 3HD1 LEU 123 3HD1 LEU 123 -8.871 16.192 3.074 960 1HD2 LEU 123 1HD2 LEU 123 -6.010 13.090 3.348 961 2HD2 LEU 123 2HD2 LEU 123 -5.749 14.692 4.036 962 3HD2 LEU 123 3HD2 LEU 123 -5.712 14.468 2.288 963 HA PRO 124 HA PRO 124 -10.399 9.531 3.321 964 1HB PRO 124 1HB PRO 124 -12.089 9.560 1.192 965 2HB PRO 124 2HB PRO 124 -12.650 9.602 2.867 966 1HG PRO 124 1HG PRO 124 -12.318 11.856 0.925 967 2HG PRO 124 2HG PRO 124 -13.648 11.539 2.054 968 1HD PRO 124 1HD PRO 124 -11.707 13.344 2.577 969 2HD PRO 124 2HD PRO 124 -12.489 12.393 3.857 970 H VAL 125 H VAL 125 -9.023 8.410 2.077 971 HA VAL 125 HA VAL 125 -8.221 9.500 -0.524 972 HB VAL 125 HB VAL 125 -5.849 8.949 -0.050 973 1HG1 VAL 125 1HG1 VAL 125 -5.354 10.964 1.052 974 2HG1 VAL 125 2HG1 VAL 125 -6.846 10.915 1.990 975 3HG1 VAL 125 3HG1 VAL 125 -6.903 11.247 0.258 976 1HG2 VAL 125 1HG2 VAL 125 -5.479 8.964 2.603 977 2HG2 VAL 125 2HG2 VAL 125 -5.638 7.481 1.662 978 3HG2 VAL 125 3HG2 VAL 125 -7.029 8.126 2.532 979 H LEU 126 H LEU 126 -8.313 7.994 -2.052 980 HA LEU 126 HA LEU 126 -7.924 5.178 -1.292 981 1HB LEU 126 1HB LEU 126 -9.683 4.608 -2.995 982 2HB LEU 126 2HB LEU 126 -10.269 5.382 -1.535 983 HG LEU 126 HG LEU 126 -9.699 7.028 -3.972 984 1HD1 LEU 126 1HD1 LEU 126 -12.464 6.081 -3.568 985 2HD1 LEU 126 2HD1 LEU 126 -11.325 4.912 -4.236 986 3HD1 LEU 126 3HD1 LEU 126 -11.593 6.450 -5.056 987 1HD2 LEU 126 1HD2 LEU 126 -11.134 7.317 -1.405 988 2HD2 LEU 126 2HD2 LEU 126 -11.869 8.083 -2.813 989 3HD2 LEU 126 3HD2 LEU 126 -10.223 8.504 -2.339 990 H LEU 127 H LEU 127 -6.243 4.375 -2.341 991 HA LEU 127 HA LEU 127 -5.897 4.970 -5.177 992 1HB LEU 127 1HB LEU 127 -3.748 5.363 -3.096 993 2HB LEU 127 2HB LEU 127 -3.446 5.317 -4.823 994 HG LEU 127 HG LEU 127 -5.457 7.280 -3.871 995 1HD1 LEU 127 1HD1 LEU 127 -3.890 7.727 -2.191 996 2HD1 LEU 127 2HD1 LEU 127 -3.519 8.888 -3.466 997 3HD1 LEU 127 3HD1 LEU 127 -2.522 7.446 -3.269 998 1HD2 LEU 127 1HD2 LEU 127 -4.033 8.633 -5.574 999 2HD2 LEU 127 2HD2 LEU 127 -5.137 7.385 -6.154 1000 3HD2 LEU 127 3HD2 LEU 127 -3.409 7.048 -6.034 1001 HA PRO 128 HA PRO 128 -5.028 0.619 -5.160 1002 1HB PRO 128 1HB PRO 128 -4.100 0.339 -7.673 1003 2HB PRO 128 2HB PRO 128 -5.803 0.668 -7.333 1004 1HG PRO 128 1HG PRO 128 -3.643 2.557 -8.185 1005 2HG PRO 128 2HG PRO 128 -5.320 2.448 -8.750 1006 1HD PRO 128 1HD PRO 128 -4.474 4.280 -6.914 1007 2HD PRO 128 2HD PRO 128 -6.130 3.643 -6.965 1008 H LEU 129 H LEU 129 -3.279 -0.878 -5.216 1009 HA LEU 129 HA LEU 129 -0.593 0.053 -5.678 1010 1HB LEU 129 1HB LEU 129 0.067 -0.717 -3.297 1011 2HB LEU 129 2HB LEU 129 -0.577 0.896 -3.530 1012 HG LEU 129 HG LEU 129 -1.439 -0.368 -1.520 1013 1HD1 LEU 129 1HD1 LEU 129 -2.600 1.523 -3.006 1014 2HD1 LEU 129 2HD1 LEU 129 -3.358 0.823 -1.576 1015 3HD1 LEU 129 3HD1 LEU 129 -3.801 0.244 -3.183 1016 1HD2 LEU 129 1HD2 LEU 129 -3.192 -1.826 -3.466 1017 2HD2 LEU 129 2HD2 LEU 129 -2.946 -2.132 -1.747 1018 3HD2 LEU 129 3HD2 LEU 129 -1.672 -2.520 -2.903 1019 H ALA 130 H ALA 130 0.986 -1.777 -4.831 1020 HA ALA 130 HA ALA 130 -0.190 -4.428 -5.042 1021 1HB ALA 130 1HB ALA 130 0.224 -3.656 -7.381 1022 2HB ALA 130 2HB ALA 130 1.096 -5.121 -6.933 1023 3HB ALA 130 3HB ALA 130 1.943 -3.576 -6.992 1024 H SER 131 H SER 131 0.838 -5.819 -3.755 1025 HA SER 131 HA SER 131 3.390 -4.982 -2.582 1026 1HB SER 131 1HB SER 131 2.898 -6.465 -0.755 1027 2HB SER 131 2HB SER 131 1.436 -5.539 -1.092 1028 HG SER 131 HG SER 131 0.658 -7.344 -2.259 1029 H VAL 132 H VAL 132 5.195 -5.850 -3.333 1030 HA VAL 132 HA VAL 132 5.123 -8.618 -4.335 1031 HB VAL 132 HB VAL 132 6.949 -7.910 -5.949 1032 1HG1 VAL 132 1HG1 VAL 132 4.107 -6.970 -6.211 1033 2HG1 VAL 132 2HG1 VAL 132 4.853 -8.425 -6.873 1034 3HG1 VAL 132 3HG1 VAL 132 5.264 -6.843 -7.537 1035 1HG2 VAL 132 1HG2 VAL 132 7.591 -5.806 -5.016 1036 2HG2 VAL 132 2HG2 VAL 132 5.943 -5.187 -5.138 1037 3HG2 VAL 132 3HG2 VAL 132 6.879 -5.496 -6.599 1038 H GLY 133 H GLY 133 6.388 -9.887 -3.155 1039 1HA GLY 133 1HA GLY 133 9.088 -9.530 -2.683 1040 2HA GLY 133 2HA GLY 133 8.271 -8.856 -1.281 1041 H TYR 134 H TYR 134 9.398 -10.527 -0.079 1042 HA TYR 134 HA TYR 134 7.795 -12.958 0.051 1043 1HB TYR 134 1HB TYR 134 10.008 -13.182 -1.387 1044 2HB TYR 134 2HB TYR 134 10.757 -13.315 0.201 1045 HD1 TYR 134 HD1 TYR 134 8.651 -14.951 -2.275 1046 HD2 TYR 134 HD2 TYR 134 10.202 -15.207 1.679 1047 HE1 TYR 134 HE1 TYR 134 8.048 -17.333 -2.199 1048 HE2 TYR 134 HE2 TYR 134 9.604 -17.592 1.765 1049 HH TYR 134 HH TYR 134 9.146 -19.431 0.282 1050 H GLY 135 H GLY 135 7.699 -13.881 2.087 1051 1HA GLY 135 1HA GLY 135 7.754 -13.908 4.381 1052 2HA GLY 135 2HA GLY 135 9.427 -13.395 4.222 1053 HA PRO 136 HA PRO 136 7.436 -9.956 6.483 1054 1HB PRO 136 1HB PRO 136 9.744 -9.051 7.606 1055 2HB PRO 136 2HB PRO 136 8.790 -10.375 8.287 1056 1HG PRO 136 1HG PRO 136 11.250 -10.490 6.585 1057 2HG PRO 136 2HG PRO 136 10.838 -11.443 8.023 1058 1HD PRO 136 1HD PRO 136 10.566 -12.419 5.518 1059 2HD PRO 136 2HD PRO 136 9.469 -12.874 6.837 1060 H VAL 137 H VAL 137 10.045 -10.053 4.194 1061 HA VAL 137 HA VAL 137 10.075 -7.160 3.859 1062 HB VAL 137 HB VAL 137 11.588 -9.237 2.272 1063 1HG1 VAL 137 1HG1 VAL 137 12.640 -7.554 1.207 1064 2HG1 VAL 137 2HG1 VAL 137 12.648 -6.515 2.632 1065 3HG1 VAL 137 3HG1 VAL 137 11.194 -6.642 1.640 1066 1HG2 VAL 137 1HG2 VAL 137 13.038 -7.649 4.269 1067 2HG2 VAL 137 2HG2 VAL 137 13.185 -9.356 3.849 1068 3HG2 VAL 137 3HG2 VAL 137 11.904 -8.822 4.939 1069 H THR 138 H THR 138 8.484 -6.290 2.703 1070 HA THR 138 HA THR 138 7.821 -7.494 0.114 1071 HB THR 138 HB THR 138 5.738 -6.454 2.041 1072 HG1 THR 138 HG1 THR 138 6.626 -8.450 2.725 1073 1HG2 THR 138 1HG2 THR 138 4.108 -7.374 0.558 1074 2HG2 THR 138 2HG2 THR 138 5.365 -8.023 -0.495 1075 3HG2 THR 138 3HG2 THR 138 5.146 -6.278 -0.355 1076 H PHE 139 H PHE 139 7.817 -6.056 -1.492 1077 HA PHE 139 HA PHE 139 8.158 -3.242 -0.838 1078 1HB PHE 139 1HB PHE 139 9.016 -4.988 -2.962 1079 2HB PHE 139 2HB PHE 139 8.192 -3.588 -3.638 1080 HD1 PHE 139 HD1 PHE 139 10.754 -4.403 -1.052 1081 HD2 PHE 139 HD2 PHE 139 9.436 -1.712 -4.075 1082 HE1 PHE 139 HE1 PHE 139 12.792 -3.059 -0.740 1083 HE2 PHE 139 HE2 PHE 139 11.472 -0.364 -3.769 1084 HZ PHE 139 HZ PHE 139 13.153 -1.038 -2.100 1085 H GLN 140 H GLN 140 6.605 -1.766 -1.002 1086 HA GLN 140 HA GLN 140 4.101 -2.534 -2.344 1087 1HB GLN 140 1HB GLN 140 4.719 -1.062 0.125 1088 2HB GLN 140 2HB GLN 140 3.479 -0.311 -0.869 1089 1HG GLN 140 1HG GLN 140 2.426 -1.744 0.723 1090 2HG GLN 140 2HG GLN 140 2.247 -2.455 -0.881 1091 1HE2 GLN 140 1HE2 GLN 140 3.144 -3.008 2.284 1092 2HE2 GLN 140 2HE2 GLN 140 3.952 -4.520 2.073 1093 H MET 141 H MET 141 3.323 -1.362 -4.002 1094 HA MET 141 HA MET 141 4.704 1.152 -4.675 1095 1HB MET 141 1HB MET 141 4.439 0.564 -7.063 1096 2HB MET 141 2HB MET 141 5.468 -0.570 -6.198 1097 1HG MET 141 1HG MET 141 3.037 -1.752 -5.943 1098 2HG MET 141 2HG MET 141 2.894 -0.988 -7.524 1099 1HE MET 141 1HE MET 141 6.267 -1.594 -8.737 1100 2HE MET 141 2HE MET 141 4.668 -0.988 -9.168 1101 3HE MET 141 3HE MET 141 5.221 -2.541 -9.796 1102 H THR 142 H THR 142 3.359 2.815 -4.615 1103 HA THR 142 HA THR 142 0.487 2.359 -4.869 1104 HB THR 142 HB THR 142 1.523 5.082 -4.334 1105 HG1 THR 142 HG1 THR 142 2.932 4.129 -3.006 1106 1HG2 THR 142 1HG2 THR 142 -0.451 5.375 -3.377 1107 2HG2 THR 142 2HG2 THR 142 -0.256 3.938 -2.373 1108 3HG2 THR 142 3HG2 THR 142 -0.902 3.792 -4.007 1109 H TYR 143 H TYR 143 -0.570 2.754 -6.689 1110 HA TYR 143 HA TYR 143 0.687 4.515 -8.689 1111 1HB TYR 143 1HB TYR 143 0.269 1.942 -9.112 1112 2HB TYR 143 2HB TYR 143 -1.370 2.485 -9.454 1113 HD1 TYR 143 HD1 TYR 143 -1.339 4.734 -11.019 1114 HD2 TYR 143 HD2 TYR 143 1.607 1.665 -10.958 1115 HE1 TYR 143 HE1 TYR 143 -0.663 5.345 -13.303 1116 HE2 TYR 143 HE2 TYR 143 2.293 2.269 -13.242 1117 HH TYR 143 HH TYR 143 0.517 3.999 -15.297 1118 H ILE 144 H ILE 144 -0.438 6.218 -9.439 1119 HA ILE 144 HA ILE 144 -3.165 6.581 -8.406 1120 HB ILE 144 HB ILE 144 -1.541 8.287 -7.707 1121 1HG1 ILE 144 1HG1 ILE 144 -3.582 9.361 -9.668 1122 2HG1 ILE 144 2HG1 ILE 144 -3.928 8.871 -8.013 1123 1HG2 ILE 144 1HG2 ILE 144 -0.585 9.838 -9.330 1124 2HG2 ILE 144 2HG2 ILE 144 -1.308 8.915 -10.647 1125 3HG2 ILE 144 3HG2 ILE 144 -0.057 8.186 -9.641 1126 1HD1 ILE 144 1HD1 ILE 144 -3.201 11.398 -8.905 1127 2HD1 ILE 144 2HD1 ILE 144 -1.770 10.771 -8.086 1128 3HD1 ILE 144 3HD1 ILE 144 -3.313 10.847 -7.233 1129 HA PRO 145 HA PRO 145 -4.901 6.045 -12.455 1130 1HB PRO 145 1HB PRO 145 -6.750 8.210 -11.574 1131 2HB PRO 145 2HB PRO 145 -7.120 6.615 -12.241 1132 1HG PRO 145 1HG PRO 145 -7.418 7.098 -9.641 1133 2HG PRO 145 2HG PRO 145 -6.783 5.544 -10.210 1134 1HD PRO 145 1HD PRO 145 -5.338 7.851 -8.987 1135 2HD PRO 145 2HD PRO 145 -5.045 6.108 -8.806 1136 H GLY 146 H GLY 146 -5.535 7.389 -14.369 1137 1HA GLY 146 1HA GLY 146 -4.727 10.127 -14.498 1138 2HA GLY 146 2HA GLY 146 -3.514 9.064 -15.197 1139 H THR 147 H THR 147 -3.834 9.998 -17.251 1140 HA THR 147 HA THR 147 -5.945 8.737 -18.757 1141 HB THR 147 HB THR 147 -6.400 11.165 -19.776 1142 HG1 THR 147 HG1 THR 147 -5.961 11.693 -17.028 1143 1HG2 THR 147 1HG2 THR 147 -7.774 10.395 -17.224 1144 2HG2 THR 147 2HG2 THR 147 -8.070 9.579 -18.758 1145 3HG2 THR 147 3HG2 THR 147 -8.425 11.299 -18.590 1146 H TYR 148 H TYR 148 -3.367 11.176 -18.794 1147 HA TYR 148 HA TYR 148 -2.677 10.376 -21.527 1148 1HB TYR 148 1HB TYR 148 -2.531 12.855 -20.034 1149 2HB TYR 148 2HB TYR 148 -0.969 12.453 -20.738 1150 HD1 TYR 148 HD1 TYR 148 -3.618 14.433 -21.312 1151 HD2 TYR 148 HD2 TYR 148 -1.496 11.316 -23.282 1152 HE1 TYR 148 HE1 TYR 148 -4.382 15.294 -23.484 1153 HE2 TYR 148 HE2 TYR 148 -2.255 12.168 -25.460 1154 HH TYR 148 HH TYR 148 -3.213 14.974 -26.106 1155 H ASN 149 H ASN 149 -0.501 9.864 -22.087 1156 HA ASN 149 HA ASN 149 0.756 8.068 -20.345 1157 1HB ASN 149 1HB ASN 149 1.441 9.322 -22.956 1158 2HB ASN 149 2HB ASN 149 2.754 8.576 -22.050 1159 1HD2 ASN 149 1HD2 ASN 149 3.035 6.948 -23.548 1160 2HD2 ASN 149 2HD2 ASN 149 1.906 5.654 -23.737 1161 H ASN 150 H ASN 150 1.264 11.488 -20.920 1162 HA ASN 150 HA ASN 150 3.695 11.597 -19.376 1163 1HB ASN 150 1HB ASN 150 1.922 13.741 -20.554 1164 2HB ASN 150 2HB ASN 150 3.390 14.091 -19.644 1165 1HD2 ASN 150 1HD2 ASN 150 2.074 12.817 -22.588 1166 2HD2 ASN 150 2HD2 ASN 150 3.556 12.780 -23.475 1167 H GLY 151 H GLY 151 3.960 12.305 -17.299 1168 1HA GLY 151 1HA GLY 151 3.188 13.444 -15.327 1169 2HA GLY 151 2HA GLY 151 1.540 13.072 -15.808 1170 H ASN 152 H ASN 152 4.112 10.708 -15.930 1171 HA ASN 152 HA ASN 152 2.630 8.952 -14.201 1172 1HB ASN 152 1HB ASN 152 4.798 8.718 -16.109 1173 2HB ASN 152 2HB ASN 152 5.163 7.832 -14.632 1174 1HD2 ASN 152 1HD2 ASN 152 3.001 6.707 -13.797 1175 2HD2 ASN 152 2HD2 ASN 152 2.247 5.713 -14.993 1176 H VAL 153 H VAL 153 2.962 8.528 -12.101 1177 HA VAL 153 HA VAL 153 5.442 9.393 -10.821 1178 HB VAL 153 HB VAL 153 4.061 10.339 -8.905 1179 1HG1 VAL 153 1HG1 VAL 153 3.728 11.981 -11.384 1180 2HG1 VAL 153 2HG1 VAL 153 5.336 11.598 -10.771 1181 3HG1 VAL 153 3HG1 VAL 153 4.198 12.489 -9.761 1182 1HG2 VAL 153 1HG2 VAL 153 1.835 10.640 -9.062 1183 2HG2 VAL 153 2HG2 VAL 153 1.934 9.350 -10.260 1184 3HG2 VAL 153 3HG2 VAL 153 1.906 11.034 -10.780 1185 H TYR 154 H TYR 154 6.153 7.517 -10.024 1186 HA TYR 154 HA TYR 154 4.240 5.667 -8.794 1187 1HB TYR 154 1HB TYR 154 7.148 5.123 -9.386 1188 2HB TYR 154 2HB TYR 154 5.873 3.952 -9.068 1189 HD1 TYR 154 HD1 TYR 154 4.641 3.029 -10.837 1190 HD2 TYR 154 HD2 TYR 154 6.996 6.505 -11.527 1191 HE1 TYR 154 HE1 TYR 154 4.226 2.823 -13.251 1192 HE2 TYR 154 HE2 TYR 154 6.586 6.309 -13.944 1193 HH TYR 154 HH TYR 154 4.221 4.597 -15.276 1194 H PHE 155 H PHE 155 4.256 5.204 -6.667 1195 HA PHE 155 HA PHE 155 6.222 6.629 -5.007 1196 1HB PHE 155 1HB PHE 155 3.380 5.777 -4.514 1197 2HB PHE 155 2HB PHE 155 4.457 6.160 -3.175 1198 HD1 PHE 155 HD1 PHE 155 4.469 8.313 -2.385 1199 HD2 PHE 155 HD2 PHE 155 3.333 7.609 -6.425 1200 HE1 PHE 155 HE1 PHE 155 3.952 10.703 -2.652 1201 HE2 PHE 155 HE2 PHE 155 2.814 9.998 -6.700 1202 HZ PHE 155 HZ PHE 155 3.123 11.549 -4.812 1203 H ALA 156 H ALA 156 7.366 5.574 -3.422 1204 HA ALA 156 HA ALA 156 7.263 2.634 -3.539 1205 1HB ALA 156 1HB ALA 156 9.617 2.910 -2.486 1206 2HB ALA 156 2HB ALA 156 9.497 4.566 -3.079 1207 3HB ALA 156 3HB ALA 156 9.398 3.217 -4.210 1208 H TRP 157 H TRP 157 7.255 1.416 -1.662 1209 HA TRP 157 HA TRP 157 7.201 2.769 0.913 1210 1HB TRP 157 1HB TRP 157 4.815 2.445 -0.297 1211 2HB TRP 157 2HB TRP 157 4.952 0.882 0.500 1212 HD1 TRP 157 HD1 TRP 157 6.605 2.478 3.023 1213 HE1 TRP 157 HE1 TRP 157 5.096 3.575 4.795 1214 HE3 TRP 157 HE3 TRP 157 2.252 2.709 0.352 1215 HZ2 TRP 157 HZ2 TRP 157 2.414 4.426 5.032 1216 HZ3 TRP 157 HZ3 TRP 157 0.260 3.680 1.425 1217 HH2 TRP 157 HH2 TRP 157 0.341 4.519 3.716 1218 H MET 158 H MET 158 8.276 1.603 2.365 1219 HA MET 158 HA MET 158 8.910 -1.180 1.728 1220 1HB MET 158 1HB MET 158 10.548 0.799 2.513 1221 2HB MET 158 2HB MET 158 10.119 0.150 4.090 1222 1HG MET 158 1HG MET 158 11.082 -1.914 3.644 1223 2HG MET 158 2HG MET 158 11.065 -1.652 1.900 1224 1HE MET 158 1HE MET 158 13.679 -2.826 2.794 1225 2HE MET 158 2HE MET 158 13.342 -2.355 4.460 1226 3HE MET 158 3HE MET 158 14.820 -1.804 3.670 1227 H ARG 159 H ARG 159 8.018 -2.834 2.772 1228 HA ARG 159 HA ARG 159 6.587 -2.284 5.289 1229 1HB ARG 159 1HB ARG 159 5.238 -2.916 3.182 1230 2HB ARG 159 2HB ARG 159 5.891 -4.532 3.415 1231 1HG ARG 159 1HG ARG 159 4.930 -3.858 5.912 1232 2HG ARG 159 2HG ARG 159 3.739 -3.175 4.805 1233 1HD ARG 159 1HD ARG 159 4.654 -5.904 4.174 1234 2HD ARG 159 2HD ARG 159 3.722 -5.738 5.661 1235 HE ARG 159 HE ARG 159 2.307 -4.368 3.739 1236 1HH1 ARG 159 1HH1 ARG 159 3.419 -7.645 4.193 1237 2HH1 ARG 159 2HH1 ARG 159 2.104 -8.346 3.311 1238 1HH2 ARG 159 1HH2 ARG 159 0.578 -5.288 2.579 1239 2HH2 ARG 159 2HH2 ARG 159 0.491 -7.009 2.394 1240 H PHE 160 H PHE 160 7.361 -3.282 7.021 1241 HA PHE 160 HA PHE 160 8.849 -5.798 6.652 1242 1HB PHE 160 1HB PHE 160 10.142 -3.585 7.287 1243 2HB PHE 160 2HB PHE 160 9.533 -3.946 8.899 1244 HD1 PHE 160 HD1 PHE 160 9.928 -6.422 9.696 1245 HD2 PHE 160 HD2 PHE 160 12.163 -4.467 6.647 1246 HE1 PHE 160 HE1 PHE 160 11.778 -8.007 10.041 1247 HE2 PHE 160 HE2 PHE 160 14.017 -6.049 6.985 1248 HZ PHE 160 HZ PHE 160 13.826 -7.822 8.684 1249 H GLN 161 H GLN 161 8.221 -7.460 7.888 1250 HA GLN 161 HA GLN 161 6.103 -6.972 9.849 1251 1HB GLN 161 1HB GLN 161 7.007 -9.433 8.364 1252 2HB GLN 161 2HB GLN 161 5.894 -9.522 9.723 1253 1HG GLN 161 1HG GLN 161 4.632 -7.671 8.283 1254 2HG GLN 161 2HG GLN 161 5.469 -8.511 6.979 1255 1HE2 GLN 161 1HE2 GLN 161 3.196 -8.950 6.368 1256 2HE2 GLN 161 2HE2 GLN 161 2.438 -10.353 7.031 1257 H PHE 162 H PHE 162 6.337 -7.354 11.977 1258 HA PHE 162 HA PHE 162 9.003 -8.022 12.935 1259 1HB PHE 162 1HB PHE 162 7.018 -6.256 13.802 1260 2HB PHE 162 2HB PHE 162 7.039 -7.531 15.014 1261 HD1 PHE 162 HD1 PHE 162 9.621 -8.278 15.559 1262 HD2 PHE 162 HD2 PHE 162 8.290 -4.432 14.314 1263 HE1 PHE 162 HE1 PHE 162 11.606 -7.259 16.595 1264 HE2 PHE 162 HE2 PHE 162 10.274 -3.407 15.348 1265 HZ PHE 162 HZ PHE 162 11.935 -4.820 16.490 1266 H LEU 163 H LEU 163 9.546 -9.872 13.938 1267 HA LEU 163 HA LEU 163 7.447 -11.906 14.227 1268 1HB LEU 163 1HB LEU 163 9.808 -12.062 12.896 1269 2HB LEU 163 2HB LEU 163 10.276 -12.707 14.457 1270 HG LEU 163 HG LEU 163 8.063 -14.161 14.070 1271 1HD1 LEU 163 1HD1 LEU 163 8.044 -12.854 11.735 1272 2HD1 LEU 163 2HD1 LEU 163 7.438 -14.499 11.925 1273 3HD1 LEU 163 3HD1 LEU 163 9.061 -14.224 11.292 1274 1HD2 LEU 163 1HD2 LEU 163 10.544 -14.798 14.394 1275 2HD2 LEU 163 2HD2 LEU 163 10.564 -14.978 12.640 1276 3HD2 LEU 163 3HD2 LEU 163 9.465 -15.954 13.616 1277 H GLU 164 H GLU 164 7.281 -13.150 16.103 1278 HA GLU 164 HA GLU 164 8.209 -11.797 18.503 1279 1HB GLU 164 1HB GLU 164 6.404 -14.208 18.248 1280 2HB GLU 164 2HB GLU 164 6.665 -13.246 19.696 1281 1HG GLU 164 1HG GLU 164 5.848 -11.355 17.917 1282 2HG GLU 164 2HG GLU 164 4.923 -12.763 17.399 1283 HE2 GLU 164 HE2 GLU 164 3.815 -10.895 20.627 1284 H HIS 165 H HIS 165 10.415 -12.305 18.509 1285 HA HIS 165 HA HIS 165 10.997 -15.095 19.240 1286 1HB HIS 165 1HB HIS 165 13.180 -14.890 18.088 1287 2HB HIS 165 2HB HIS 165 11.819 -14.751 16.978 1288 HD1 HIS 165 HD1 HIS 165 12.205 -12.994 15.300 1289 HD2 HIS 165 HD2 HIS 165 13.951 -12.036 18.947 1290 HE1 HIS 165 HE1 HIS 165 13.307 -10.760 14.952 1291 HE2 HIS 165 HE2 HIS 165 14.283 -10.162 17.196 1292 H HIS 166 H HIS 166 13.494 -15.027 20.063 1293 HA HIS 166 HA HIS 166 13.996 -12.712 21.734 1294 1HB HIS 166 1HB HIS 166 12.392 -14.397 22.926 1295 2HB HIS 166 2HB HIS 166 13.853 -15.356 23.143 1296 HD1 HIS 166 HD1 HIS 166 15.760 -12.894 23.698 1297 HD2 HIS 166 HD2 HIS 166 12.118 -13.629 25.559 1298 HE1 HIS 166 HE1 HIS 166 15.868 -11.671 25.893 1299 HE2 HIS 166 HE2 HIS 166 13.620 -12.060 26.963 1300 H HIS 167 H HIS 167 14.918 -16.112 21.192 1301 HA HIS 167 HA HIS 167 17.664 -15.257 20.721 1302 1HB HIS 167 1HB HIS 167 17.101 -16.029 23.223 1303 2HB HIS 167 2HB HIS 167 17.372 -17.614 22.508 1304 HD1 HIS 167 HD1 HIS 167 19.288 -16.583 24.646 1305 HD2 HIS 167 HD2 HIS 167 19.870 -16.025 20.569 1306 HE1 HIS 167 HE1 HIS 167 21.759 -16.208 24.365 1307 HE2 HIS 167 HE2 HIS 167 22.076 -15.791 21.899 1308 H HIS 168 H HIS 168 17.275 -15.874 18.568 1309 HA HIS 168 HA HIS 168 16.738 -18.715 18.086 1310 1HB HIS 168 1HB HIS 168 15.795 -16.444 16.825 1311 2HB HIS 168 2HB HIS 168 17.047 -17.012 15.726 1312 HD1 HIS 168 HD1 HIS 168 14.037 -17.084 14.979 1313 HD2 HIS 168 HD2 HIS 168 16.154 -20.281 16.578 1314 HE1 HIS 168 HE1 HIS 168 12.767 -19.142 14.291 1315 HE2 HIS 168 HE2 HIS 168 14.114 -21.069 15.198 1316 H HIS 169 H HIS 169 18.114 -20.001 16.843 1317 HA HIS 169 HA HIS 169 20.113 -20.816 16.128 1318 1HB HIS 169 1HB HIS 169 20.267 -17.938 15.314 1319 2HB HIS 169 2HB HIS 169 21.693 -18.957 15.141 1320 HD1 HIS 169 HD1 HIS 169 18.027 -19.626 14.340 1321 HD2 HIS 169 HD2 HIS 169 21.773 -19.687 12.544 1322 HE1 HIS 169 HE1 HIS 169 17.639 -20.478 12.007 1323 HE2 HIS 169 HE2 HIS 169 19.931 -20.587 10.967 1324 H HIS 170 H HIS 170 22.534 -20.692 16.497 1325 HA HIS 170 HA HIS 170 23.160 -19.398 19.061 1326 1HB HIS 170 1HB HIS 170 22.689 -22.074 18.884 1327 2HB HIS 170 2HB HIS 170 24.427 -22.024 18.609 1328 HD1 HIS 170 HD1 HIS 170 25.917 -21.234 20.579 1329 HD2 HIS 170 HD2 HIS 170 21.864 -21.442 21.474 1330 HE1 HIS 170 HE1 HIS 170 25.773 -21.072 23.084 1331 HE2 HIS 170 HE2 HIS 170 23.318 -21.288 23.608 Start of MODEL 5 1 1H MET 1 1H MET 1 -30.094 -5.618 32.979 2 2H MET 1 2H MET 1 -29.640 -7.041 33.826 3 H MET 1 H MET 1 -30.755 -5.954 34.408 4 3H MET 1 3H MET 1 -30.921 -6.062 34.413 5 HA MET 1 HA MET 1 -31.526 -8.161 33.231 6 1HB MET 1 1HB MET 1 -32.546 -5.394 32.718 7 2HB MET 1 2HB MET 1 -33.284 -6.745 31.867 8 1HG MET 1 1HG MET 1 -33.348 -7.727 34.345 9 2HG MET 1 2HG MET 1 -33.397 -6.006 34.723 10 1HE MET 1 1HE MET 1 -35.651 -8.635 34.963 11 2HE MET 1 2HE MET 1 -35.204 -9.075 33.314 12 3HE MET 1 3HE MET 1 -36.855 -8.568 33.675 13 H ASN 2 H ASN 2 -28.996 -7.360 31.967 14 HA ASN 2 HA ASN 2 -29.712 -8.079 29.220 15 1HB ASN 2 1HB ASN 2 -28.930 -5.499 29.899 16 2HB ASN 2 2HB ASN 2 -27.452 -6.239 29.289 17 1HD2 ASN 2 1HD2 ASN 2 -29.887 -4.380 28.380 18 2HD2 ASN 2 2HD2 ASN 2 -30.051 -4.838 26.721 19 H ALA 3 H ALA 3 -28.609 -9.556 31.489 20 HA ALA 3 HA ALA 3 -25.832 -9.933 31.237 21 1HB ALA 3 1HB ALA 3 -26.575 -12.303 32.200 22 2HB ALA 3 2HB ALA 3 -28.069 -11.412 32.493 23 3HB ALA 3 3HB ALA 3 -26.551 -10.841 33.187 24 H ASP 4 H ASP 4 -28.400 -10.869 29.191 25 HA ASP 4 HA ASP 4 -27.137 -13.189 28.069 26 1HB ASP 4 1HB ASP 4 -28.925 -12.923 26.295 27 2HB ASP 4 2HB ASP 4 -29.519 -13.120 27.941 28 HD2 ASP 4 HD2 ASP 4 -30.683 -9.815 28.025 29 H GLU 5 H GLU 5 -27.673 -9.847 26.994 30 HA GLU 5 HA GLU 5 -26.086 -10.166 24.631 31 1HB GLU 5 1HB GLU 5 -27.997 -8.395 25.352 32 2HB GLU 5 2HB GLU 5 -26.558 -7.445 25.696 33 1HG GLU 5 1HG GLU 5 -26.812 -6.842 23.544 34 2HG GLU 5 2HG GLU 5 -25.906 -8.328 23.263 35 HE2 GLU 5 HE2 GLU 5 -28.783 -9.967 22.084 36 H TRP 6 H TRP 6 -25.500 -9.282 27.930 37 HA TRP 6 HA TRP 6 -23.078 -7.869 27.580 38 1HB TRP 6 1HB TRP 6 -24.689 -8.694 29.751 39 2HB TRP 6 2HB TRP 6 -23.079 -9.335 30.055 40 HD1 TRP 6 HD1 TRP 6 -23.756 -5.942 28.355 41 HE1 TRP 6 HE1 TRP 6 -22.762 -4.087 29.836 42 HE3 TRP 6 HE3 TRP 6 -22.340 -8.777 32.367 43 HZ2 TRP 6 HZ2 TRP 6 -21.538 -3.857 32.370 44 HZ3 TRP 6 HZ3 TRP 6 -21.264 -7.663 34.279 45 HH2 TRP 6 HH2 TRP 6 -20.873 -5.253 34.278 46 H MET 7 H MET 7 -23.779 -11.296 28.140 47 HA MET 7 HA MET 7 -21.094 -12.146 28.321 48 1HB MET 7 1HB MET 7 -23.724 -13.470 27.883 49 2HB MET 7 2HB MET 7 -22.277 -14.382 27.478 50 1HG MET 7 1HG MET 7 -21.472 -13.744 29.834 51 2HG MET 7 2HG MET 7 -23.160 -13.341 30.139 52 1HE MET 7 1HE MET 7 -21.344 -16.009 31.685 53 2HE MET 7 2HE MET 7 -20.487 -15.669 30.181 54 3HE MET 7 3HE MET 7 -21.173 -17.270 30.464 55 H THR 8 H THR 8 -23.220 -11.541 25.620 56 HA THR 8 HA THR 8 -21.858 -12.940 23.617 57 HB THR 8 HB THR 8 -23.046 -10.319 22.899 58 HG1 THR 8 HG1 THR 8 -24.613 -12.434 23.951 59 1HG2 THR 8 1HG2 THR 8 -22.623 -11.732 21.075 60 2HG2 THR 8 2HG2 THR 8 -24.362 -11.819 21.353 61 3HG2 THR 8 3HG2 THR 8 -23.315 -13.131 21.894 62 H THR 9 H THR 9 -21.559 -9.514 24.558 63 HA THR 9 HA THR 9 -19.390 -8.987 22.808 64 HB THR 9 HB THR 9 -19.168 -6.883 24.014 65 HG1 THR 9 HG1 THR 9 -20.916 -8.081 25.894 66 1HG2 THR 9 1HG2 THR 9 -21.550 -7.725 22.804 67 2HG2 THR 9 2HG2 THR 9 -20.974 -6.075 23.040 68 3HG2 THR 9 3HG2 THR 9 -22.012 -6.830 24.250 69 H PHE 10 H PHE 10 -19.620 -10.171 26.087 70 HA PHE 10 HA PHE 10 -16.940 -9.732 26.860 71 1HB PHE 10 1HB PHE 10 -19.091 -10.486 28.222 72 2HB PHE 10 2HB PHE 10 -18.438 -12.091 27.908 73 HD1 PHE 10 HD1 PHE 10 -17.702 -8.818 29.454 74 HD2 PHE 10 HD2 PHE 10 -16.588 -12.911 29.111 75 HE1 PHE 10 HE1 PHE 10 -16.156 -8.553 31.350 76 HE2 PHE 10 HE2 PHE 10 -15.040 -12.653 31.005 77 HZ PHE 10 HZ PHE 10 -14.823 -10.471 32.128 78 H ARG 11 H ARG 11 -18.544 -12.377 25.181 79 HA ARG 11 HA ARG 11 -16.284 -14.123 25.221 80 1HB ARG 11 1HB ARG 11 -18.833 -14.099 23.609 81 2HB ARG 11 2HB ARG 11 -17.597 -15.335 23.411 82 1HG ARG 11 1HG ARG 11 -18.172 -16.394 25.301 83 2HG ARG 11 2HG ARG 11 -18.453 -14.891 26.181 84 1HD ARG 11 1HD ARG 11 -20.584 -15.748 26.061 85 2HD ARG 11 2HD ARG 11 -20.547 -14.712 24.635 86 HE ARG 11 HE ARG 11 -19.711 -17.240 23.841 87 1HH1 ARG 11 1HH1 ARG 11 -22.592 -15.740 25.118 88 2HH1 ARG 11 2HH1 ARG 11 -23.666 -16.854 24.341 89 1HH2 ARG 11 1HH2 ARG 11 -21.122 -18.705 22.817 90 2HH2 ARG 11 2HH2 ARG 11 -22.833 -18.538 23.036 91 H GLU 12 H GLU 12 -17.466 -11.636 23.066 92 HA GLU 12 HA GLU 12 -15.683 -12.318 20.916 93 1HB GLU 12 1HB GLU 12 -17.988 -10.936 20.988 94 2HB GLU 12 2HB GLU 12 -16.852 -9.597 21.070 95 1HG GLU 12 1HG GLU 12 -16.864 -9.695 18.848 96 2HG GLU 12 2HG GLU 12 -15.806 -11.091 19.047 97 HE2 GLU 12 HE2 GLU 12 -18.151 -13.161 17.671 98 H ASN 13 H ASN 13 -15.662 -10.134 23.650 99 HA ASN 13 HA ASN 13 -13.388 -8.628 22.791 100 1HB ASN 13 1HB ASN 13 -15.097 -7.780 24.405 101 2HB ASN 13 2HB ASN 13 -14.486 -8.927 25.594 102 1HD2 ASN 13 1HD2 ASN 13 -12.250 -8.712 26.246 103 2HD2 ASN 13 2HD2 ASN 13 -11.521 -7.146 26.259 104 H ILE 14 H ILE 14 -13.898 -11.397 24.923 105 HA ILE 14 HA ILE 14 -11.223 -11.557 25.857 106 HB ILE 14 HB ILE 14 -13.094 -12.626 27.040 107 1HG1 ILE 14 1HG1 ILE 14 -11.103 -14.702 26.113 108 2HG1 ILE 14 2HG1 ILE 14 -10.717 -13.430 27.268 109 1HG2 ILE 14 1HG2 ILE 14 -13.118 -14.643 24.804 110 2HG2 ILE 14 2HG2 ILE 14 -14.307 -13.356 24.997 111 3HG2 ILE 14 3HG2 ILE 14 -14.160 -14.611 26.226 112 1HD1 ILE 14 1HD1 ILE 14 -13.089 -14.812 28.087 113 2HD1 ILE 14 2HD1 ILE 14 -11.549 -14.626 28.929 114 3HD1 ILE 14 3HD1 ILE 14 -11.780 -15.957 27.794 115 H ALA 15 H ALA 15 -12.976 -13.185 23.238 116 HA ALA 15 HA ALA 15 -10.883 -14.886 22.433 117 1HB ALA 15 1HB ALA 15 -12.261 -15.538 20.747 118 2HB ALA 15 2HB ALA 15 -12.780 -13.891 20.385 119 3HB ALA 15 3HB ALA 15 -13.456 -14.743 21.773 120 H GLN 16 H GLN 16 -11.797 -11.622 21.422 121 HA GLN 16 HA GLN 16 -9.999 -11.352 19.292 122 1HB GLN 16 1HB GLN 16 -11.951 -9.810 20.136 123 2HB GLN 16 2HB GLN 16 -10.669 -9.017 21.041 124 1HG GLN 16 1HG GLN 16 -10.192 -9.494 18.161 125 2HG GLN 16 2HG GLN 16 -11.387 -8.272 18.592 126 1HE2 GLN 16 1HE2 GLN 16 -10.566 -6.812 20.458 127 2HE2 GLN 16 2HE2 GLN 16 -8.971 -6.182 20.244 128 H THR 17 H THR 17 -9.653 -10.302 22.680 129 HA THR 17 HA THR 17 -7.024 -9.360 22.457 130 HB THR 17 HB THR 17 -8.492 -8.837 24.359 131 HG1 THR 17 HG1 THR 17 -6.120 -10.186 25.132 132 1HG2 THR 17 1HG2 THR 17 -8.602 -10.507 26.231 133 2HG2 THR 17 2HG2 THR 17 -8.120 -11.731 25.056 134 3HG2 THR 17 3HG2 THR 17 -9.628 -10.846 24.837 135 H TRP 18 H TRP 18 -8.304 -12.577 22.926 136 HA TRP 18 HA TRP 18 -5.810 -13.761 23.685 137 1HB TRP 18 1HB TRP 18 -8.458 -14.561 23.748 138 2HB TRP 18 2HB TRP 18 -7.764 -15.577 22.488 139 HD1 TRP 18 HD1 TRP 18 -7.347 -17.851 23.597 140 HE1 TRP 18 HE1 TRP 18 -6.187 -18.663 25.747 141 HE3 TRP 18 HE3 TRP 18 -6.323 -13.319 25.729 142 HZ2 TRP 18 HZ2 TRP 18 -4.996 -17.531 28.042 143 HZ3 TRP 18 HZ3 TRP 18 -5.172 -13.270 27.903 144 HH2 TRP 18 HH2 TRP 18 -4.523 -15.334 29.035 145 H GLN 19 H GLN 19 -7.486 -13.157 20.681 146 HA GLN 19 HA GLN 19 -5.861 -14.888 19.087 147 1HB GLN 19 1HB GLN 19 -8.089 -13.055 18.672 148 2HB GLN 19 2HB GLN 19 -6.908 -12.970 17.373 149 1HG GLN 19 1HG GLN 19 -7.595 -15.694 18.167 150 2HG GLN 19 2HG GLN 19 -8.956 -14.761 17.545 151 1HE2 GLN 19 1HE2 GLN 19 -7.484 -17.055 16.416 152 2HE2 GLN 19 2HE2 GLN 19 -6.951 -16.538 14.857 153 H GLN 20 H GLN 20 -6.108 -11.326 19.120 154 HA GLN 20 HA GLN 20 -4.575 -9.691 18.735 155 1HB GLN 20 1HB GLN 20 -2.994 -11.852 20.015 156 2HB GLN 20 2HB GLN 20 -2.086 -10.583 19.204 157 1HG GLN 20 1HG GLN 20 -4.185 -9.505 20.879 158 2HG GLN 20 2HG GLN 20 -3.071 -10.528 21.785 159 1HE2 GLN 20 1HE2 GLN 20 -3.634 -7.465 20.658 160 2HE2 GLN 20 2HE2 GLN 20 -2.037 -6.819 20.797 161 HA PRO 21 HA PRO 21 -3.028 -10.095 14.633 162 1HB PRO 21 1HB PRO 21 -0.801 -8.527 14.626 163 2HB PRO 21 2HB PRO 21 -2.444 -7.876 14.652 164 1HG PRO 21 1HG PRO 21 -0.524 -8.258 16.915 165 2HG PRO 21 2HG PRO 21 -1.586 -6.881 16.569 166 1HD PRO 21 1HD PRO 21 -2.205 -8.752 18.416 167 2HD PRO 21 2HD PRO 21 -3.446 -7.935 17.443 168 H GLU 22 H GLU 22 -2.087 -11.814 13.753 169 HA GLU 22 HA GLU 22 0.028 -13.220 15.102 170 1HB GLU 22 1HB GLU 22 -0.142 -14.794 13.183 171 2HB GLU 22 2HB GLU 22 -1.675 -14.517 13.999 172 1HG GLU 22 1HG GLU 22 -1.109 -12.755 11.712 173 2HG GLU 22 2HG GLU 22 -1.352 -14.459 11.332 174 HE2 GLU 22 HE2 GLU 22 -4.462 -12.277 12.171 175 H HIS 23 H HIS 23 -0.261 -11.070 12.361 176 HA HIS 23 HA HIS 23 2.643 -11.308 11.917 177 1HB HIS 23 1HB HIS 23 0.393 -10.720 10.004 178 2HB HIS 23 2HB HIS 23 2.058 -10.290 9.626 179 HD1 HIS 23 HD1 HIS 23 3.580 -12.742 10.487 180 HD2 HIS 23 HD2 HIS 23 -0.079 -12.936 8.529 181 HE1 HIS 23 HE1 HIS 23 3.507 -15.020 9.426 182 HE2 HIS 23 HE2 HIS 23 1.318 -15.086 8.182 183 H TYR 24 H TYR 24 3.853 -9.572 12.307 184 HA TYR 24 HA TYR 24 2.484 -7.000 12.733 185 1HB TYR 24 1HB TYR 24 3.994 -8.363 14.531 186 2HB TYR 24 2HB TYR 24 5.222 -7.341 13.792 187 HD1 TYR 24 HD1 TYR 24 1.810 -7.131 15.294 188 HD2 TYR 24 HD2 TYR 24 5.537 -5.196 14.613 189 HE1 TYR 24 HE1 TYR 24 1.091 -5.257 16.715 190 HE2 TYR 24 HE2 TYR 24 4.829 -3.318 16.032 191 HH TYR 24 HH TYR 24 3.224 -2.894 17.861 192 H ASP 25 H ASP 25 2.763 -5.605 11.131 193 HA ASP 25 HA ASP 25 5.218 -5.751 9.526 194 1HB ASP 25 1HB ASP 25 2.575 -4.412 8.909 195 2HB ASP 25 2HB ASP 25 3.968 -4.464 7.833 196 HD2 ASP 25 HD2 ASP 25 3.299 -8.137 7.886 197 H LEU 26 H LEU 26 6.120 -3.676 8.757 198 HA LEU 26 HA LEU 26 5.580 -1.362 10.439 199 1HB LEU 26 1HB LEU 26 8.120 -2.937 10.470 200 2HB LEU 26 2HB LEU 26 8.189 -1.200 10.692 201 HG LEU 26 HG LEU 26 6.325 -1.749 12.522 202 1HD1 LEU 26 1HD1 LEU 26 8.019 -4.105 13.032 203 2HD1 LEU 26 2HD1 LEU 26 6.827 -4.270 11.742 204 3HD1 LEU 26 3HD1 LEU 26 6.309 -3.836 13.371 205 1HD2 LEU 26 1HD2 LEU 26 8.078 -0.607 13.390 206 2HD2 LEU 26 2HD2 LEU 26 9.278 -1.621 12.591 207 3HD2 LEU 26 3HD2 LEU 26 8.473 -2.193 14.052 208 H TYR 27 H TYR 27 5.321 0.244 9.045 209 HA TYR 27 HA TYR 27 6.758 0.202 6.501 210 1HB TYR 27 1HB TYR 27 4.544 2.046 7.426 211 2HB TYR 27 2HB TYR 27 5.195 1.937 5.794 212 HD1 TYR 27 HD1 TYR 27 4.851 -0.196 4.492 213 HD2 TYR 27 HD2 TYR 27 2.833 0.593 8.152 214 HE1 TYR 27 HE1 TYR 27 3.189 -1.923 3.942 215 HE2 TYR 27 HE2 TYR 27 1.166 -1.133 7.613 216 HH TYR 27 HH TYR 27 0.498 -2.238 4.829 217 H ILE 28 H ILE 28 8.399 1.528 6.040 218 HA ILE 28 HA ILE 28 8.837 3.881 7.744 219 HB ILE 28 HB ILE 28 11.319 3.393 7.587 220 1HG1 ILE 28 1HG1 ILE 28 10.707 0.507 7.322 221 2HG1 ILE 28 2HG1 ILE 28 10.612 1.452 5.839 222 1HG2 ILE 28 1HG2 ILE 28 9.531 2.811 9.497 223 2HG2 ILE 28 2HG2 ILE 28 11.256 2.479 9.654 224 3HG2 ILE 28 3HG2 ILE 28 10.151 1.192 9.172 225 1HD1 ILE 28 1HD1 ILE 28 12.911 2.245 6.243 226 2HD1 ILE 28 2HD1 ILE 28 12.801 0.494 6.055 227 3HD1 ILE 28 3HD1 ILE 28 12.992 1.199 7.660 228 HA PRO 29 HA PRO 29 9.358 5.734 3.724 229 1HB PRO 29 1HB PRO 29 9.975 8.228 4.507 230 2HB PRO 29 2HB PRO 29 8.346 7.570 4.701 231 1HG PRO 29 1HG PRO 29 10.532 7.840 6.727 232 2HG PRO 29 2HG PRO 29 8.800 8.176 6.899 233 1HD PRO 29 1HD PRO 29 9.992 5.869 7.764 234 2HD PRO 29 2HD PRO 29 8.287 5.975 7.283 235 H ALA 30 H ALA 30 11.071 7.469 2.831 236 HA ALA 30 HA ALA 30 13.196 7.768 2.069 237 1HB ALA 30 1HB ALA 30 14.472 6.924 4.587 238 2HB ALA 30 2HB ALA 30 13.293 8.229 4.720 239 3HB ALA 30 3HB ALA 30 14.680 8.399 3.645 240 H ILE 31 H ILE 31 15.584 6.547 2.462 241 HA ILE 31 HA ILE 31 15.018 3.745 1.744 242 HB ILE 31 HB ILE 31 15.907 5.076 -0.127 243 1HG1 ILE 31 1HG1 ILE 31 18.177 3.291 0.620 244 2HG1 ILE 31 2HG1 ILE 31 16.572 2.577 0.505 245 1HG2 ILE 31 1HG2 ILE 31 17.698 6.419 -0.011 246 2HG2 ILE 31 2HG2 ILE 31 18.612 5.285 0.984 247 3HG2 ILE 31 3HG2 ILE 31 17.422 6.352 1.730 248 1HD1 ILE 31 1HD1 ILE 31 17.092 4.236 -1.778 249 2HD1 ILE 31 2HD1 ILE 31 16.701 2.517 -1.701 250 3HD1 ILE 31 3HD1 ILE 31 18.377 3.049 -1.563 251 H THR 32 H THR 32 15.933 2.178 2.916 252 HA THR 32 HA THR 32 17.475 2.865 5.238 253 HB THR 32 HB THR 32 17.545 0.291 5.462 254 HG1 THR 32 HG1 THR 32 16.177 -0.828 4.156 255 1HG2 THR 32 1HG2 THR 32 15.211 0.138 6.174 256 2HG2 THR 32 2HG2 THR 32 14.882 1.690 5.403 257 3HG2 THR 32 3HG2 THR 32 15.993 1.602 6.770 258 H TRP 33 H TRP 33 18.153 0.392 2.763 259 HA TRP 33 HA TRP 33 20.082 -0.275 1.762 260 1HB TRP 33 1HB TRP 33 20.127 2.523 1.686 261 2HB TRP 33 2HB TRP 33 21.731 2.060 2.248 262 HD1 TRP 33 HD1 TRP 33 19.366 1.513 -0.749 263 HE1 TRP 33 HE1 TRP 33 20.796 0.910 -2.801 264 HE3 TRP 33 HE3 TRP 33 23.938 1.188 1.514 265 HZ2 TRP 33 HZ2 TRP 33 23.505 0.368 -3.385 266 HZ3 TRP 33 HZ3 TRP 33 25.898 0.623 0.138 267 HH2 TRP 33 HH2 TRP 33 25.685 0.221 -2.260 268 H HIS 34 H HIS 34 21.389 -1.724 2.640 269 HA HIS 34 HA HIS 34 22.152 -1.663 5.361 270 1HB HIS 34 1HB HIS 34 23.223 -3.368 3.102 271 2HB HIS 34 2HB HIS 34 23.487 -3.666 4.817 272 HD1 HIS 34 HD1 HIS 34 22.276 -5.919 4.807 273 HD2 HIS 34 HD2 HIS 34 19.914 -2.756 3.512 274 HE1 HIS 34 HE1 HIS 34 19.930 -6.821 4.730 275 HE2 HIS 34 HE2 HIS 34 18.507 -4.865 4.023 276 H ALA 35 H ALA 35 24.036 -1.228 2.372 277 HA ALA 35 HA ALA 35 26.020 -0.192 1.957 278 1HB ALA 35 1HB ALA 35 26.619 1.544 3.909 279 2HB ALA 35 2HB ALA 35 24.902 1.310 4.242 280 3HB ALA 35 3HB ALA 35 25.424 1.875 2.655 281 H ARG 36 H ARG 36 28.197 0.487 3.281 282 HA ARG 36 HA ARG 36 28.958 -1.978 4.689 283 1HB ARG 36 1HB ARG 36 30.375 -0.129 2.845 284 2HB ARG 36 2HB ARG 36 31.331 -0.859 4.129 285 1HG ARG 36 1HG ARG 36 31.141 -2.964 3.268 286 2HG ARG 36 2HG ARG 36 29.592 -2.626 2.492 287 1HD ARG 36 1HD ARG 36 31.014 -0.997 1.027 288 2HD ARG 36 2HD ARG 36 32.360 -2.001 1.561 289 HE ARG 36 HE ARG 36 30.145 -3.502 0.511 290 1HH1 ARG 36 1HH1 ARG 36 33.078 -1.790 -0.293 291 2HH1 ARG 36 2HH1 ARG 36 33.327 -2.656 -1.770 292 1HH2 ARG 36 1HH2 ARG 36 30.471 -4.643 -1.432 293 2HH2 ARG 36 2HH2 ARG 36 31.847 -4.277 -2.418 294 H PHE 37 H PHE 37 29.421 1.544 4.770 295 HA PHE 37 HA PHE 37 29.254 1.625 7.610 296 1HB PHE 37 1HB PHE 37 31.664 0.788 7.003 297 2HB PHE 37 2HB PHE 37 31.948 2.482 6.617 298 HD1 PHE 37 HD1 PHE 37 32.335 4.061 8.306 299 HD2 PHE 37 HD2 PHE 37 30.922 0.178 9.322 300 HE1 PHE 37 HE1 PHE 37 32.753 4.536 10.684 301 HE2 PHE 37 HE2 PHE 37 31.337 0.645 11.701 302 HZ PHE 37 HZ PHE 37 32.253 2.826 12.385 303 H ALA 38 H ALA 38 31.040 3.486 5.144 304 HA ALA 38 HA ALA 38 29.823 5.941 6.090 305 1HB ALA 38 1HB ALA 38 31.534 7.022 5.089 306 2HB ALA 38 2HB ALA 38 31.485 5.996 3.654 307 3HB ALA 38 3HB ALA 38 32.279 5.425 5.121 308 H TYR 39 H TYR 39 27.887 6.541 5.394 309 HA TYR 39 HA TYR 39 26.760 5.486 2.963 310 1HB TYR 39 1HB TYR 39 24.808 6.968 3.599 311 2HB TYR 39 2HB TYR 39 25.246 5.742 4.783 312 HD1 TYR 39 HD1 TYR 39 26.032 9.308 3.972 313 HD2 TYR 39 HD2 TYR 39 25.370 6.387 6.994 314 HE1 TYR 39 HE1 TYR 39 26.230 11.052 5.694 315 HE2 TYR 39 HE2 TYR 39 25.566 8.123 8.724 316 HH TYR 39 HH TYR 39 25.367 10.513 8.966 317 H ASP 40 H ASP 40 25.776 6.898 1.316 318 HA ASP 40 HA ASP 40 27.642 9.025 0.595 319 1HB ASP 40 1HB ASP 40 25.467 7.659 -1.004 320 2HB ASP 40 2HB ASP 40 26.546 8.902 -1.632 321 HD2 ASP 40 HD2 ASP 40 29.170 6.670 -1.937 322 H LYS 41 H LYS 41 27.080 11.137 0.315 323 HA LYS 41 HA LYS 41 24.362 11.881 1.171 324 1HB LYS 41 1HB LYS 41 26.483 12.574 2.521 325 2HB LYS 41 2HB LYS 41 26.694 13.766 1.246 326 1HG LYS 41 1HG LYS 41 24.944 15.017 1.935 327 2HG LYS 41 2HG LYS 41 24.013 13.618 2.472 328 1HD LYS 41 1HD LYS 41 24.607 14.870 4.414 329 2HD LYS 41 2HD LYS 41 25.605 13.414 4.399 330 1HE LYS 41 1HE LYS 41 27.523 14.586 3.799 331 2HE LYS 41 2HE LYS 41 26.606 15.962 3.187 332 1HZ LYS 41 1HZ LYS 41 27.245 16.830 5.154 333 2HZ LYS 41 2HZ LYS 41 27.402 15.327 5.915 334 3HZ LYS 41 3HZ LYS 41 25.872 16.021 5.723 335 H GLU 42 H GLU 42 23.089 12.721 -0.332 336 HA GLU 42 HA GLU 42 24.207 13.555 -2.877 337 1HB GLU 42 1HB GLU 42 21.322 13.407 -1.981 338 2HB GLU 42 2HB GLU 42 21.879 13.669 -3.628 339 1HG GLU 42 1HG GLU 42 22.928 11.451 -3.612 340 2HG GLU 42 2HG GLU 42 22.319 11.190 -1.978 341 HE2 GLU 42 HE2 GLU 42 19.761 10.970 -5.000 342 H LYS 43 H LYS 43 25.283 15.467 -2.157 343 HA LYS 43 HA LYS 43 23.462 17.757 -1.967 344 1HB LYS 43 1HB LYS 43 25.417 16.883 0.040 345 2HB LYS 43 2HB LYS 43 25.576 18.574 -0.416 346 1HG LYS 43 1HG LYS 43 22.814 17.945 0.006 347 2HG LYS 43 2HG LYS 43 23.767 17.440 1.402 348 1HD LYS 43 1HD LYS 43 24.859 19.815 1.101 349 2HD LYS 43 2HD LYS 43 23.340 20.166 0.273 350 1HE LYS 43 1HE LYS 43 22.066 19.683 2.202 351 2HE LYS 43 2HE LYS 43 23.439 18.926 3.010 352 1HZ LYS 43 1HZ LYS 43 22.783 21.751 2.713 353 2HZ LYS 43 2HZ LYS 43 24.424 21.341 2.645 354 3HZ LYS 43 3HZ LYS 43 23.508 20.937 4.008 355 H THR 44 H THR 44 23.858 18.465 -4.018 356 HA THR 44 HA THR 44 26.524 19.563 -4.497 357 HB THR 44 HB THR 44 25.061 17.959 -6.598 358 HG1 THR 44 HG1 THR 44 26.703 16.405 -6.222 359 1HG2 THR 44 1HG2 THR 44 26.673 18.464 -8.051 360 2HG2 THR 44 2HG2 THR 44 27.943 18.358 -6.831 361 3HG2 THR 44 3HG2 THR 44 26.987 19.833 -6.985 362 H ASP 45 H ASP 45 23.462 19.165 -6.288 363 HA ASP 45 HA ASP 45 22.977 22.019 -6.177 364 1HB ASP 45 1HB ASP 45 23.503 20.602 -8.797 365 2HB ASP 45 2HB ASP 45 22.788 22.206 -8.664 366 HD2 ASP 45 HD2 ASP 45 26.676 21.802 -8.136 367 H ARG 46 H ARG 46 21.594 19.768 -5.148 368 HA ARG 46 HA ARG 46 19.050 20.094 -6.565 369 1HB ARG 46 1HB ARG 46 20.461 17.534 -5.968 370 2HB ARG 46 2HB ARG 46 18.707 17.566 -5.847 371 1HG ARG 46 1HG ARG 46 18.420 17.712 -8.074 372 2HG ARG 46 2HG ARG 46 19.839 18.736 -8.300 373 1HD ARG 46 1HD ARG 46 21.148 16.563 -7.688 374 2HD ARG 46 2HD ARG 46 19.649 15.758 -8.150 375 HE ARG 46 HE ARG 46 21.545 17.035 -9.895 376 1HH1 ARG 46 1HH1 ARG 46 18.228 16.015 -9.527 377 2HH1 ARG 46 2HH1 ARG 46 17.938 15.916 -11.232 378 1HH2 ARG 46 1HH2 ARG 46 21.165 16.907 -12.137 379 2HH2 ARG 46 2HH2 ARG 46 19.606 16.422 -12.714 380 H TYR 47 H TYR 47 17.341 20.411 -5.255 381 HA TYR 47 HA TYR 47 17.773 20.885 -2.490 382 1HB TYR 47 1HB TYR 47 15.155 20.658 -3.989 383 2HB TYR 47 2HB TYR 47 15.379 21.380 -2.399 384 HD1 TYR 47 HD1 TYR 47 15.736 21.851 -5.991 385 HD2 TYR 47 HD2 TYR 47 16.542 23.538 -2.169 386 HE1 TYR 47 HE1 TYR 47 16.167 24.029 -7.050 387 HE2 TYR 47 HE2 TYR 47 16.975 25.720 -3.217 388 HH TYR 47 HH TYR 47 17.751 26.481 -5.632 389 H ASN 48 H ASN 48 17.329 19.672 -0.725 390 HA ASN 48 HA ASN 48 16.411 16.919 -1.212 391 1HB ASN 48 1HB ASN 48 18.432 18.103 0.617 392 2HB ASN 48 2HB ASN 48 17.510 16.733 1.228 393 1HD2 ASN 48 1HD2 ASN 48 18.851 15.069 1.136 394 2HD2 ASN 48 2HD2 ASN 48 19.739 14.568 -0.258 395 H GLU 49 H GLU 49 14.645 16.155 -0.198 396 HA GLU 49 HA GLU 49 13.264 17.983 1.648 397 1HB GLU 49 1HB GLU 49 12.324 16.083 -0.442 398 2HB GLU 49 2HB GLU 49 11.309 16.294 0.978 399 1HG GLU 49 1HG GLU 49 10.417 18.003 -0.128 400 2HG GLU 49 2HG GLU 49 11.889 18.875 0.301 401 HE2 GLU 49 HE2 GLU 49 11.214 18.658 -3.394 402 H ARG 50 H ARG 50 11.939 16.946 3.345 403 HA ARG 50 HA ARG 50 13.193 14.465 4.325 404 1HB ARG 50 1HB ARG 50 13.553 16.831 5.516 405 2HB ARG 50 2HB ARG 50 12.025 16.393 6.267 406 1HG ARG 50 1HG ARG 50 13.346 15.400 7.781 407 2HG ARG 50 2HG ARG 50 13.397 14.096 6.594 408 1HD ARG 50 1HD ARG 50 15.363 16.209 6.121 409 2HD ARG 50 2HD ARG 50 15.577 15.368 7.656 410 HE ARG 50 HE ARG 50 16.018 14.311 5.021 411 1HH1 ARG 50 1HH1 ARG 50 15.302 13.510 8.341 412 2HH1 ARG 50 2HH1 ARG 50 15.929 11.900 8.219 413 1HH2 ARG 50 1HH2 ARG 50 16.843 12.193 4.858 414 2HH2 ARG 50 2HH2 ARG 50 16.804 11.153 6.242 415 HA PRO 51 HA PRO 51 8.592 13.844 3.903 416 1HB PRO 51 1HB PRO 51 8.739 11.461 2.626 417 2HB PRO 51 2HB PRO 51 8.804 13.006 1.771 418 1HG PRO 51 1HG PRO 51 11.045 11.191 2.575 419 2HG PRO 51 2HG PRO 51 10.797 12.050 1.044 420 1HD PRO 51 1HD PRO 51 12.482 12.946 2.971 421 2HD PRO 51 2HD PRO 51 11.601 14.039 1.886 422 H TRP 52 H TRP 52 8.311 13.495 6.098 423 HA TRP 52 HA TRP 52 9.266 10.997 7.263 424 1HB TRP 52 1HB TRP 52 8.162 13.552 8.350 425 2HB TRP 52 2HB TRP 52 8.021 12.092 9.324 426 HD1 TRP 52 HD1 TRP 52 10.534 14.668 8.147 427 HE1 TRP 52 HE1 TRP 52 12.788 14.249 9.318 428 HE3 TRP 52 HE3 TRP 52 9.501 10.149 10.304 429 HZ2 TRP 52 HZ2 TRP 52 13.971 12.267 10.941 430 HZ3 TRP 52 HZ3 TRP 52 11.249 9.058 11.651 431 HH2 TRP 52 HH2 TRP 52 13.437 10.097 11.961 432 H GLY 53 H GLY 53 7.811 9.604 8.465 433 1HA GLY 53 1HA GLY 53 5.183 9.520 8.780 434 2HA GLY 53 2HA GLY 53 5.281 9.287 7.041 435 H GLY 54 H GLY 54 5.845 7.878 10.169 436 1HA GLY 54 1HA GLY 54 6.254 5.272 8.837 437 2HA GLY 54 2HA GLY 54 7.180 5.732 10.258 438 H GLY 55 H GLY 55 5.858 3.414 10.404 439 1HA GLY 55 1HA GLY 55 4.350 3.575 12.704 440 2HA GLY 55 2HA GLY 55 3.188 3.659 11.387 441 H PHE 56 H PHE 56 2.339 1.663 12.273 442 HA PHE 56 HA PHE 56 3.959 -0.684 11.531 443 1HB PHE 56 1HB PHE 56 2.392 -1.913 13.140 444 2HB PHE 56 2HB PHE 56 3.590 -0.839 13.855 445 HD1 PHE 56 HD1 PHE 56 2.916 1.306 14.821 446 HD2 PHE 56 HD2 PHE 56 0.053 -1.449 13.293 447 HE1 PHE 56 HE1 PHE 56 1.130 2.505 16.015 448 HE2 PHE 56 HE2 PHE 56 -1.737 -0.254 14.485 449 HZ PHE 56 HZ PHE 56 -1.200 1.726 15.847 450 H GLY 57 H GLY 57 2.446 -2.653 11.090 451 1HA GLY 57 1HA GLY 57 0.093 -1.795 9.546 452 2HA GLY 57 2HA GLY 57 1.332 -2.763 8.762 453 H LEU 58 H LEU 58 -1.408 -3.482 9.040 454 HA LEU 58 HA LEU 58 -1.051 -6.023 10.424 455 1HB LEU 58 1HB LEU 58 -2.387 -4.000 11.694 456 2HB LEU 58 2HB LEU 58 -3.698 -4.839 10.889 457 HG LEU 58 HG LEU 58 -2.471 -6.954 11.985 458 1HD1 LEU 58 1HD1 LEU 58 -0.773 -6.188 13.259 459 2HD1 LEU 58 2HD1 LEU 58 -2.065 -5.926 14.431 460 3HD1 LEU 58 3HD1 LEU 58 -1.487 -4.586 13.442 461 1HD2 LEU 58 1HD2 LEU 58 -4.218 -5.314 13.768 462 2HD2 LEU 58 2HD2 LEU 58 -4.245 -7.050 13.453 463 3HD2 LEU 58 3HD2 LEU 58 -4.852 -5.923 12.239 464 H SER 59 H SER 59 -3.223 -7.347 10.067 465 HA SER 59 HA SER 59 -4.736 -6.829 7.738 466 1HB SER 59 1HB SER 59 -3.795 -8.533 6.239 467 2HB SER 59 2HB SER 59 -2.599 -7.289 6.605 468 HG SER 59 HG SER 59 -1.438 -8.701 7.691 469 H ARG 60 H ARG 60 -6.262 -8.499 7.272 470 HA ARG 60 HA ARG 60 -6.378 -10.658 9.264 471 1HB ARG 60 1HB ARG 60 -8.491 -8.644 8.573 472 2HB ARG 60 2HB ARG 60 -8.949 -10.243 9.141 473 1HG ARG 60 1HG ARG 60 -8.112 -9.885 11.250 474 2HG ARG 60 2HG ARG 60 -6.973 -8.652 10.704 475 1HD ARG 60 1HD ARG 60 -9.331 -7.481 10.074 476 2HD ARG 60 2HD ARG 60 -9.797 -8.411 11.497 477 HE ARG 60 HE ARG 60 -8.162 -6.070 11.432 478 1HH1 ARG 60 1HH1 ARG 60 -8.765 -9.034 13.173 479 2HH1 ARG 60 2HH1 ARG 60 -8.140 -8.429 14.670 480 1HH2 ARG 60 1HH2 ARG 60 -7.339 -5.272 13.401 481 2HH2 ARG 60 2HH2 ARG 60 -7.331 -6.293 14.800 482 H TRP 61 H TRP 61 -8.378 -12.143 8.585 483 HA TRP 61 HA TRP 61 -7.939 -12.782 5.746 484 1HB TRP 61 1HB TRP 61 -7.656 -14.380 8.012 485 2HB TRP 61 2HB TRP 61 -9.185 -14.897 7.308 486 HD1 TRP 61 HD1 TRP 61 -5.561 -15.479 7.033 487 HE1 TRP 61 HE1 TRP 61 -5.012 -16.819 4.905 488 HE3 TRP 61 HE3 TRP 61 -10.044 -15.038 4.612 489 HZ2 TRP 61 HZ2 TRP 61 -6.305 -17.587 2.518 490 HZ3 TRP 61 HZ3 TRP 61 -10.305 -16.104 2.410 491 HH2 TRP 61 HH2 TRP 61 -8.473 -17.352 1.386 492 H ASP 62 H ASP 62 -9.608 -12.825 4.363 493 HA ASP 62 HA ASP 62 -12.279 -12.273 5.455 494 1HB ASP 62 1HB ASP 62 -10.877 -10.915 3.528 495 2HB ASP 62 2HB ASP 62 -11.905 -11.963 2.557 496 HD2 ASP 62 HD2 ASP 62 -13.504 -8.796 3.997 497 H GLU 63 H GLU 63 -13.746 -13.822 5.403 498 HA GLU 63 HA GLU 63 -13.301 -16.390 4.419 499 1HB GLU 63 1HB GLU 63 -15.128 -15.325 6.064 500 2HB GLU 63 2HB GLU 63 -16.111 -15.455 4.614 501 1HG GLU 63 1HG GLU 63 -14.925 -17.908 4.711 502 2HG GLU 63 2HG GLU 63 -15.138 -17.531 6.419 503 HE2 GLU 63 HE2 GLU 63 -18.623 -17.650 6.127 504 H LYS 64 H LYS 64 -14.278 -13.562 2.738 505 HA LYS 64 HA LYS 64 -15.487 -15.039 0.546 506 1HB LYS 64 1HB LYS 64 -15.879 -12.504 1.560 507 2HB LYS 64 2HB LYS 64 -14.954 -12.199 0.096 508 1HG LYS 64 1HG LYS 64 -17.167 -14.098 -0.222 509 2HG LYS 64 2HG LYS 64 -17.646 -12.452 0.198 510 1HD LYS 64 1HD LYS 64 -15.585 -12.643 -1.887 511 2HD LYS 64 2HD LYS 64 -17.152 -13.324 -2.331 512 1HE LYS 64 1HE LYS 64 -17.568 -11.183 -2.935 513 2HE LYS 64 2HE LYS 64 -17.977 -11.032 -1.227 514 1HZ LYS 64 1HZ LYS 64 -16.261 -9.432 -2.461 515 2HZ LYS 64 2HZ LYS 64 -15.184 -10.615 -1.914 516 3HZ LYS 64 3HZ LYS 64 -16.163 -9.789 -0.810 517 H GLY 65 H GLY 65 -12.597 -15.345 1.241 518 1HA GLY 65 1HA GLY 65 -10.649 -15.679 0.075 519 2HA GLY 65 2HA GLY 65 -11.579 -15.422 -1.394 520 H ASN 66 H ASN 66 -10.998 -13.189 1.297 521 HA ASN 66 HA ASN 66 -9.428 -11.498 -0.525 522 1HB ASN 66 1HB ASN 66 -11.968 -10.863 0.829 523 2HB ASN 66 2HB ASN 66 -10.716 -9.635 0.994 524 1HD2 ASN 66 1HD2 ASN 66 -13.025 -9.075 -0.332 525 2HD2 ASN 66 2HD2 ASN 66 -12.707 -8.901 -2.021 526 H TRP 67 H TRP 67 -8.034 -9.957 0.545 527 HA TRP 67 HA TRP 67 -7.242 -10.873 3.231 528 1HB TRP 67 1HB TRP 67 -5.692 -10.963 1.044 529 2HB TRP 67 2HB TRP 67 -5.338 -9.318 1.561 530 HD1 TRP 67 HD1 TRP 67 -4.394 -9.111 4.189 531 HE1 TRP 67 HE1 TRP 67 -2.802 -10.698 5.442 532 HE3 TRP 67 HE3 TRP 67 -4.949 -13.280 1.282 533 HZ2 TRP 67 HZ2 TRP 67 -1.901 -13.365 5.227 534 HZ3 TRP 67 HZ3 TRP 67 -3.686 -15.307 1.875 535 HH2 TRP 67 HH2 TRP 67 -2.194 -15.347 3.807 536 H HIS 68 H HIS 68 -8.265 -9.501 4.591 537 HA HIS 68 HA HIS 68 -8.685 -6.747 4.069 538 1HB HIS 68 1HB HIS 68 -9.689 -8.531 5.875 539 2HB HIS 68 2HB HIS 68 -8.628 -7.570 6.898 540 HD1 HIS 68 HD1 HIS 68 -11.976 -7.684 6.292 541 HD2 HIS 68 HD2 HIS 68 -9.228 -4.594 5.890 542 HE1 HIS 68 HE1 HIS 68 -13.329 -5.566 6.379 543 HE2 HIS 68 HE2 HIS 68 -11.636 -3.707 6.216 544 H GLY 69 H GLY 69 -7.611 -4.935 4.776 545 1HA GLY 69 1HA GLY 69 -5.012 -5.395 6.104 546 2HA GLY 69 2HA GLY 69 -5.160 -4.324 4.717 547 H LEU 70 H LEU 70 -4.376 -3.942 7.623 548 HA LEU 70 HA LEU 70 -5.778 -1.433 7.955 549 1HB LEU 70 1HB LEU 70 -7.014 -3.426 9.156 550 2HB LEU 70 2HB LEU 70 -5.756 -3.208 10.357 551 HG LEU 70 HG LEU 70 -7.265 -0.792 9.503 552 1HD1 LEU 70 1HD1 LEU 70 -8.459 -3.144 10.836 553 2HD1 LEU 70 2HD1 LEU 70 -9.212 -1.888 9.852 554 3HD1 LEU 70 3HD1 LEU 70 -8.816 -1.566 11.539 555 1HD2 LEU 70 1HD2 LEU 70 -5.764 -1.780 11.862 556 2HD2 LEU 70 2HD2 LEU 70 -7.091 -0.656 12.152 557 3HD2 LEU 70 3HD2 LEU 70 -5.757 -0.192 11.094 558 H TYR 71 H TYR 71 -4.164 -0.051 8.230 559 HA TYR 71 HA TYR 71 -2.067 -0.703 10.176 560 1HB TYR 71 1HB TYR 71 -0.376 0.328 8.656 561 2HB TYR 71 2HB TYR 71 -1.058 -1.172 8.037 562 HD1 TYR 71 HD1 TYR 71 -2.542 -1.160 6.102 563 HD2 TYR 71 HD2 TYR 71 -0.829 2.446 7.574 564 HE1 TYR 71 HE1 TYR 71 -3.151 -0.022 4.009 565 HE2 TYR 71 HE2 TYR 71 -1.434 3.594 5.485 566 HH TYR 71 HH TYR 71 -1.877 2.655 2.932 567 H ALA 72 H ALA 72 -0.846 1.230 10.885 568 HA ALA 72 HA ALA 72 -2.276 3.759 10.532 569 1HB ALA 72 1HB ALA 72 -2.041 2.224 13.059 570 2HB ALA 72 2HB ALA 72 -3.337 3.274 12.485 571 3HB ALA 72 3HB ALA 72 -1.862 3.976 13.148 572 H MET 73 H MET 73 -0.931 5.433 10.304 573 HA MET 73 HA MET 73 1.835 5.152 11.274 574 1HB MET 73 1HB MET 73 0.979 6.353 8.635 575 2HB MET 73 2HB MET 73 2.625 6.302 9.251 576 1HG MET 73 1HG MET 73 2.046 3.696 9.360 577 2HG MET 73 2HG MET 73 0.979 4.172 8.041 578 1HE MET 73 1HE MET 73 2.964 3.079 5.496 579 2HE MET 73 2HE MET 73 2.499 4.759 5.227 580 3HE MET 73 3HE MET 73 1.431 3.682 6.128 581 H ALA 74 H ALA 74 2.956 7.434 11.028 582 HA ALA 74 HA ALA 74 1.117 9.588 11.755 583 1HB ALA 74 1HB ALA 74 1.535 9.106 13.927 584 2HB ALA 74 2HB ALA 74 2.980 10.066 13.614 585 3HB ALA 74 3HB ALA 74 3.065 8.305 13.571 586 H PHE 75 H PHE 75 1.781 11.576 11.109 587 HA PHE 75 HA PHE 75 4.357 11.699 9.698 588 1HB PHE 75 1HB PHE 75 1.844 13.349 9.369 589 2HB PHE 75 2HB PHE 75 3.351 13.665 8.516 590 HD1 PHE 75 HD1 PHE 75 4.287 11.109 7.659 591 HD2 PHE 75 HD2 PHE 75 0.287 12.540 7.894 592 HE1 PHE 75 HE1 PHE 75 3.622 9.526 5.897 593 HE2 PHE 75 HE2 PHE 75 -0.387 10.959 6.133 594 HZ PHE 75 HZ PHE 75 1.282 9.449 5.133 595 H LYS 76 H LYS 76 5.829 13.297 10.124 596 HA LYS 76 HA LYS 76 5.556 14.624 12.683 597 1HB LYS 76 1HB LYS 76 7.773 14.084 10.777 598 2HB LYS 76 2HB LYS 76 7.940 15.483 11.830 599 1HG LYS 76 1HG LYS 76 7.108 12.987 13.149 600 2HG LYS 76 2HG LYS 76 8.742 13.001 12.483 601 1HD LYS 76 1HD LYS 76 8.902 15.314 13.686 602 2HD LYS 76 2HD LYS 76 7.556 14.692 14.643 603 1HE LYS 76 1HE LYS 76 9.485 14.109 15.849 604 2HE LYS 76 2HE LYS 76 8.989 12.628 15.030 605 1HZ LYS 76 1HZ LYS 76 11.026 14.460 13.907 606 2HZ LYS 76 2HZ LYS 76 10.696 12.866 13.452 607 3HZ LYS 76 3HZ LYS 76 11.427 13.184 14.944 608 H ASP 77 H ASP 77 5.587 16.836 13.036 609 HA ASP 77 HA ASP 77 4.499 18.428 10.883 610 1HB ASP 77 1HB ASP 77 4.034 18.418 13.548 611 2HB ASP 77 2HB ASP 77 5.202 19.732 13.446 612 HD2 ASP 77 HD2 ASP 77 1.794 20.969 12.864 613 H SER 78 H SER 78 5.401 20.917 11.211 614 HA SER 78 HA SER 78 7.986 20.821 9.987 615 1HB SER 78 1HB SER 78 5.975 22.510 9.652 616 2HB SER 78 2HB SER 78 6.798 23.394 10.937 617 HG SER 78 HG SER 78 7.416 23.855 8.664 618 H TRP 79 H TRP 79 6.749 21.565 13.171 619 HA TRP 79 HA TRP 79 9.479 22.215 14.064 620 1HB TRP 79 1HB TRP 79 7.205 23.672 14.452 621 2HB TRP 79 2HB TRP 79 7.253 22.717 15.930 622 HD1 TRP 79 HD1 TRP 79 10.171 22.724 16.784 623 HE1 TRP 79 HE1 TRP 79 11.430 24.892 17.367 624 HE3 TRP 79 HE3 TRP 79 7.223 26.075 14.289 625 HZ2 TRP 79 HZ2 TRP 79 11.204 27.656 16.841 626 HZ3 TRP 79 HZ3 TRP 79 7.814 28.462 14.380 627 HH2 TRP 79 HH2 TRP 79 9.763 29.234 15.630 628 H ASN 80 H ASN 80 6.566 20.869 15.620 629 HA ASN 80 HA ASN 80 7.780 18.348 16.152 630 1HB ASN 80 1HB ASN 80 8.712 20.227 17.848 631 2HB ASN 80 2HB ASN 80 7.259 19.741 18.717 632 1HD2 ASN 80 1HD2 ASN 80 8.900 19.061 20.299 633 2HD2 ASN 80 2HD2 ASN 80 9.572 17.477 20.147 634 H LYS 81 H LYS 81 5.869 17.510 15.363 635 HA LYS 81 HA LYS 81 3.774 17.143 17.240 636 1HB LYS 81 1HB LYS 81 3.488 19.288 15.254 637 2HB LYS 81 2HB LYS 81 2.147 18.151 15.276 638 1HG LYS 81 1HG LYS 81 2.184 18.539 17.837 639 2HG LYS 81 2HG LYS 81 3.102 19.990 17.427 640 1HD LYS 81 1HD LYS 81 1.315 21.012 16.467 641 2HD LYS 81 2HD LYS 81 0.629 19.496 15.879 642 1HE LYS 81 1HE LYS 81 -0.793 20.471 17.593 643 2HE LYS 81 2HE LYS 81 -0.100 18.950 18.153 644 1HZ LYS 81 1HZ LYS 81 0.292 20.248 19.957 645 2HZ LYS 81 2HZ LYS 81 0.427 21.678 19.062 646 3HZ LYS 81 3HZ LYS 81 1.713 20.580 19.099 647 H TRP 82 H TRP 82 3.025 15.162 16.894 648 HA TRP 82 HA TRP 82 3.205 14.058 14.168 649 1HB TRP 82 1HB TRP 82 3.477 11.850 15.197 650 2HB TRP 82 2HB TRP 82 4.731 12.959 15.745 651 HD1 TRP 82 HD1 TRP 82 4.345 14.003 18.291 652 HE1 TRP 82 HE1 TRP 82 3.311 12.875 20.360 653 HE3 TRP 82 HE3 TRP 82 1.815 10.213 15.973 654 HZ2 TRP 82 HZ2 TRP 82 1.645 10.670 20.934 655 HZ3 TRP 82 HZ3 TRP 82 0.525 8.638 17.354 656 HH2 TRP 82 HH2 TRP 82 0.444 8.862 19.784 657 H GLU 83 H GLU 83 1.401 13.320 13.233 658 HA GLU 83 HA GLU 83 -1.004 13.041 14.912 659 1HB GLU 83 1HB GLU 83 -0.735 14.154 12.121 660 2HB GLU 83 2HB GLU 83 -2.279 13.719 12.837 661 1HG GLU 83 1HG GLU 83 -1.170 15.328 14.754 662 2HG GLU 83 2HG GLU 83 -0.615 16.070 13.254 663 HE2 GLU 83 HE2 GLU 83 -4.204 16.288 12.410 664 HA PRO 84 HA PRO 84 -0.892 8.891 13.243 665 1HB PRO 84 1HB PRO 84 -3.075 7.936 14.499 666 2HB PRO 84 2HB PRO 84 -1.556 8.232 15.352 667 1HG PRO 84 1HG PRO 84 -4.021 9.927 15.231 668 2HG PRO 84 2HG PRO 84 -3.001 9.535 16.628 669 1HD PRO 84 1HD PRO 84 -2.825 11.887 15.261 670 2HD PRO 84 2HD PRO 84 -1.451 11.146 16.104 671 H ILE 85 H ILE 85 -2.169 7.541 11.861 672 HA ILE 85 HA ILE 85 -4.599 8.709 10.735 673 HB ILE 85 HB ILE 85 -3.762 8.292 8.413 674 1HG1 ILE 85 1HG1 ILE 85 -1.026 8.263 9.694 675 2HG1 ILE 85 2HG1 ILE 85 -1.867 6.800 9.188 676 1HG2 ILE 85 1HG2 ILE 85 -2.730 10.403 8.202 677 2HG2 ILE 85 2HG2 ILE 85 -2.088 10.337 9.843 678 3HG2 ILE 85 3HG2 ILE 85 -3.820 10.535 9.582 679 1HD1 ILE 85 1HD1 ILE 85 -0.251 8.543 7.649 680 2HD1 ILE 85 2HD1 ILE 85 -1.894 8.604 7.010 681 3HD1 ILE 85 3HD1 ILE 85 -1.060 7.057 7.151 682 H ALA 86 H ALA 86 -6.073 7.213 10.149 683 HA ALA 86 HA ALA 86 -5.311 4.400 10.471 684 1HB ALA 86 1HB ALA 86 -7.115 4.634 11.829 685 2HB ALA 86 2HB ALA 86 -7.969 4.264 10.331 686 3HB ALA 86 3HB ALA 86 -7.811 5.937 10.865 687 H GLY 87 H GLY 87 -5.814 2.831 8.936 688 1HA GLY 87 1HA GLY 87 -6.982 3.681 6.400 689 2HA GLY 87 2HA GLY 87 -5.314 3.131 6.350 690 H TYR 88 H TYR 88 -8.071 2.100 5.387 691 HA TYR 88 HA TYR 88 -7.485 -0.688 6.008 692 1HB TYR 88 1HB TYR 88 -9.840 -1.189 6.518 693 2HB TYR 88 2HB TYR 88 -9.155 -0.058 7.680 694 HD1 TYR 88 HD1 TYR 88 -9.723 2.388 7.472 695 HD2 TYR 88 HD2 TYR 88 -11.735 -0.618 5.232 696 HE1 TYR 88 HE1 TYR 88 -11.567 3.955 7.036 697 HE2 TYR 88 HE2 TYR 88 -13.584 0.941 4.789 698 HH TYR 88 HH TYR 88 -13.895 3.938 6.428 699 H GLY 89 H GLY 89 -7.965 -2.092 4.366 700 1HA GLY 89 1HA GLY 89 -9.725 -1.383 2.210 701 2HA GLY 89 2HA GLY 89 -8.031 -1.262 1.762 702 H TRP 90 H TRP 90 -8.716 -2.929 0.182 703 HA TRP 90 HA TRP 90 -8.445 -5.603 1.381 704 1HB TRP 90 1HB TRP 90 -10.406 -4.665 -0.692 705 2HB TRP 90 2HB TRP 90 -9.891 -6.349 -0.649 706 HD1 TRP 90 HD1 TRP 90 -9.888 -6.841 2.468 707 HE1 TRP 90 HE1 TRP 90 -12.112 -6.907 3.760 708 HE3 TRP 90 HE3 TRP 90 -12.817 -4.254 -0.828 709 HZ2 TRP 90 HZ2 TRP 90 -14.759 -5.983 3.428 710 HZ3 TRP 90 HZ3 TRP 90 -15.185 -3.889 -0.265 711 HH2 TRP 90 HH2 TRP 90 -16.134 -4.736 1.819 712 H GLU 91 H GLU 91 -7.187 -7.069 0.266 713 HA GLU 91 HA GLU 91 -5.989 -6.215 -2.264 714 1HB GLU 91 1HB GLU 91 -3.732 -6.787 -1.459 715 2HB GLU 91 2HB GLU 91 -4.433 -5.449 -0.558 716 1HG GLU 91 1HG GLU 91 -5.092 -7.108 1.203 717 2HG GLU 91 2HG GLU 91 -4.134 -8.304 0.331 718 HE2 GLU 91 HE2 GLU 91 -1.446 -7.243 2.167 719 H SER 92 H SER 92 -5.225 -7.899 -3.564 720 HA SER 92 HA SER 92 -6.273 -10.533 -2.825 721 1HB SER 92 1HB SER 92 -5.752 -9.144 -5.420 722 2HB SER 92 2HB SER 92 -5.701 -10.907 -5.383 723 HG SER 92 HG SER 92 -7.789 -10.491 -5.756 724 H THR 93 H THR 93 -5.022 -12.353 -2.770 725 HA THR 93 HA THR 93 -2.145 -11.912 -2.633 726 HB THR 93 HB THR 93 -3.282 -14.597 -2.092 727 HG1 THR 93 HG1 THR 93 -4.709 -13.880 -0.757 728 1HG2 THR 93 1HG2 THR 93 -1.886 -14.296 -0.009 729 2HG2 THR 93 2HG2 THR 93 -1.279 -12.816 -0.751 730 3HG2 THR 93 3HG2 THR 93 -1.015 -14.371 -1.540 731 H TRP 94 H TRP 94 -0.628 -13.117 -3.798 732 HA TRP 94 HA TRP 94 -1.559 -14.914 -5.884 733 1HB TRP 94 1HB TRP 94 -0.934 -12.167 -6.416 734 2HB TRP 94 2HB TRP 94 0.270 -13.189 -7.194 735 HD1 TRP 94 HD1 TRP 94 -2.631 -11.516 -8.212 736 HE1 TRP 94 HE1 TRP 94 -3.951 -12.758 -10.039 737 HE3 TRP 94 HE3 TRP 94 -0.575 -16.166 -7.679 738 HZ2 TRP 94 HZ2 TRP 94 -4.100 -15.365 -11.113 739 HZ3 TRP 94 HZ3 TRP 94 -1.362 -17.979 -9.145 740 HH2 TRP 94 HH2 TRP 94 -3.089 -17.585 -10.826 741 H ARG 95 H ARG 95 -0.286 -16.629 -5.750 742 HA ARG 95 HA ARG 95 2.578 -16.217 -5.194 743 1HB ARG 95 1HB ARG 95 0.970 -18.603 -4.281 744 2HB ARG 95 2HB ARG 95 2.630 -18.206 -3.854 745 1HG ARG 95 1HG ARG 95 2.012 -16.712 -2.278 746 2HG ARG 95 2HG ARG 95 0.585 -16.188 -3.175 747 1HD ARG 95 1HD ARG 95 -0.077 -18.752 -2.566 748 2HD ARG 95 2HD ARG 95 0.887 -18.304 -1.160 749 HE ARG 95 HE ARG 95 -1.095 -16.348 -1.856 750 1HH1 ARG 95 1HH1 ARG 95 -0.502 -19.306 -0.104 751 2HH1 ARG 95 2HH1 ARG 95 -1.815 -19.064 0.999 752 1HH2 ARG 95 1HH2 ARG 95 -2.823 -16.027 -0.407 753 2HH2 ARG 95 2HH2 ARG 95 -3.134 -17.202 0.826 754 HA PRO 96 HA PRO 96 3.321 -18.505 -8.896 755 1HB PRO 96 1HB PRO 96 5.767 -19.549 -8.364 756 2HB PRO 96 2HB PRO 96 5.515 -17.837 -8.721 757 1HG PRO 96 1HG PRO 96 5.847 -19.190 -6.071 758 2HG PRO 96 2HG PRO 96 6.560 -17.673 -6.650 759 1HD PRO 96 1HD PRO 96 4.401 -17.740 -5.016 760 2HD PRO 96 2HD PRO 96 4.644 -16.464 -6.227 761 H LEU 97 H LEU 97 3.629 -20.130 -5.796 762 HA LEU 97 HA LEU 97 2.300 -22.462 -6.804 763 1HB LEU 97 1HB LEU 97 4.886 -22.592 -7.328 764 2HB LEU 97 2HB LEU 97 4.981 -23.063 -5.642 765 HG LEU 97 HG LEU 97 3.087 -24.772 -6.388 766 1HD1 LEU 97 1HD1 LEU 97 3.090 -23.817 -8.709 767 2HD1 LEU 97 2HD1 LEU 97 3.333 -25.560 -8.613 768 3HD1 LEU 97 3HD1 LEU 97 4.706 -24.493 -8.909 769 1HD2 LEU 97 1HD2 LEU 97 4.676 -26.373 -6.159 770 2HD2 LEU 97 2HD2 LEU 97 5.628 -24.996 -5.605 771 3HD2 LEU 97 3HD2 LEU 97 5.798 -25.575 -7.262 772 H ALA 98 H ALA 98 1.796 -20.540 -4.772 773 HA ALA 98 HA ALA 98 1.051 -20.411 -2.627 774 1HB ALA 98 1HB ALA 98 0.976 -23.322 -3.200 775 2HB ALA 98 2HB ALA 98 -0.329 -22.218 -2.766 776 3HB ALA 98 3HB ALA 98 0.777 -22.807 -1.525 777 H ASP 99 H ASP 99 3.284 -19.474 -2.345 778 HA ASP 99 HA ASP 99 4.837 -21.111 -0.446 779 1HB ASP 99 1HB ASP 99 5.852 -20.315 -2.746 780 2HB ASP 99 2HB ASP 99 6.067 -18.795 -1.885 781 HD2 ASP 99 HD2 ASP 99 8.963 -21.005 -1.397 782 H GLU 100 H GLU 100 6.021 -19.841 1.205 783 HA GLU 100 HA GLU 100 4.375 -17.573 2.105 784 1HB GLU 100 1HB GLU 100 4.658 -19.787 3.476 785 2HB GLU 100 2HB GLU 100 6.210 -19.091 3.922 786 1HG GLU 100 1HG GLU 100 5.048 -18.199 5.612 787 2HG GLU 100 2HG GLU 100 4.577 -16.999 4.409 788 HE2 GLU 100 HE2 GLU 100 1.302 -18.065 4.428 789 H ASN 101 H ASN 101 7.610 -18.635 1.381 790 HA ASN 101 HA ASN 101 9.092 -16.618 2.620 791 1HB ASN 101 1HB ASN 101 9.721 -18.795 1.129 792 2HB ASN 101 2HB ASN 101 10.051 -17.511 -0.030 793 1HD2 ASN 101 1HD2 ASN 101 12.025 -16.743 0.004 794 2HD2 ASN 101 2HD2 ASN 101 13.105 -16.754 1.353 795 H PHE 102 H PHE 102 8.170 -16.775 -0.826 796 HA PHE 102 HA PHE 102 8.236 -13.830 -0.871 797 1HB PHE 102 1HB PHE 102 8.524 -14.240 -3.421 798 2HB PHE 102 2HB PHE 102 9.910 -14.466 -2.361 799 HD1 PHE 102 HD1 PHE 102 11.062 -16.484 -2.341 800 HD2 PHE 102 HD2 PHE 102 7.172 -16.310 -4.057 801 HE1 PHE 102 HE1 PHE 102 11.338 -18.777 -3.189 802 HE2 PHE 102 HE2 PHE 102 7.440 -18.604 -4.908 803 HZ PHE 102 HZ PHE 102 9.525 -19.840 -4.474 804 H HIS 103 H HIS 103 6.455 -12.751 -1.469 805 HA HIS 103 HA HIS 103 4.317 -14.144 -2.887 806 1HB HIS 103 1HB HIS 103 2.622 -13.303 -1.273 807 2HB HIS 103 2HB HIS 103 3.718 -14.485 -0.568 808 HD1 HIS 103 HD1 HIS 103 2.755 -10.884 -0.398 809 HD2 HIS 103 HD2 HIS 103 5.421 -13.493 1.431 810 HE1 HIS 103 HE1 HIS 103 3.627 -9.653 1.614 811 HE2 HIS 103 HE2 HIS 103 5.177 -11.283 2.750 812 H LEU 104 H LEU 104 2.621 -12.646 -3.651 813 HA LEU 104 HA LEU 104 3.289 -9.826 -3.687 814 1HB LEU 104 1HB LEU 104 3.452 -9.631 -6.075 815 2HB LEU 104 2HB LEU 104 4.641 -10.793 -5.516 816 HG LEU 104 HG LEU 104 2.607 -12.467 -6.115 817 1HD1 LEU 104 1HD1 LEU 104 1.437 -11.807 -8.043 818 2HD1 LEU 104 2HD1 LEU 104 2.446 -10.379 -8.267 819 3HD1 LEU 104 3HD1 LEU 104 1.302 -10.449 -6.927 820 1HD2 LEU 104 1HD2 LEU 104 3.989 -13.231 -7.745 821 2HD2 LEU 104 2HD2 LEU 104 5.116 -12.133 -6.951 822 3HD2 LEU 104 3HD2 LEU 104 4.273 -11.623 -8.413 823 H GLY 105 H GLY 105 1.554 -8.505 -4.197 824 1HA GLY 105 1HA GLY 105 -0.891 -9.624 -5.256 825 2HA GLY 105 2HA GLY 105 -0.976 -9.214 -3.550 826 H LEU 106 H LEU 106 -2.748 -7.892 -4.805 827 HA LEU 106 HA LEU 106 -1.840 -5.166 -4.760 828 1HB LEU 106 1HB LEU 106 -2.586 -4.587 -7.012 829 2HB LEU 106 2HB LEU 106 -1.264 -5.740 -7.051 830 HG LEU 106 HG LEU 106 -4.033 -6.818 -7.181 831 1HD1 LEU 106 1HD1 LEU 106 -3.615 -4.745 -8.778 832 2HD1 LEU 106 2HD1 LEU 106 -4.494 -6.177 -9.313 833 3HD1 LEU 106 3HD1 LEU 106 -2.796 -5.975 -9.740 834 1HD2 LEU 106 1HD2 LEU 106 -2.458 -8.502 -7.226 835 2HD2 LEU 106 2HD2 LEU 106 -1.307 -7.546 -8.160 836 3HD2 LEU 106 3HD2 LEU 106 -2.734 -8.223 -8.945 837 H GLY 107 H GLY 107 -3.610 -3.631 -4.835 838 1HA GLY 107 1HA GLY 107 -6.305 -4.274 -5.115 839 2HA GLY 107 2HA GLY 107 -5.891 -4.552 -3.430 840 H PHE 108 H PHE 108 -7.533 -2.853 -3.104 841 HA PHE 108 HA PHE 108 -6.435 -0.155 -3.538 842 1HB PHE 108 1HB PHE 108 -9.277 -1.115 -3.199 843 2HB PHE 108 2HB PHE 108 -8.827 0.585 -3.101 844 HD1 PHE 108 HD1 PHE 108 -8.412 -2.352 -5.360 845 HD2 PHE 108 HD2 PHE 108 -8.947 1.854 -5.010 846 HE1 PHE 108 HE1 PHE 108 -8.579 -2.175 -7.808 847 HE2 PHE 108 HE2 PHE 108 -9.117 2.041 -7.458 848 HZ PHE 108 HZ PHE 108 -8.933 0.025 -8.860 849 H THR 109 H THR 109 -6.753 1.416 -1.826 850 HA THR 109 HA THR 109 -7.167 0.280 0.842 851 HB THR 109 HB THR 109 -4.815 2.054 0.171 852 HG1 THR 109 HG1 THR 109 -4.682 -0.108 -0.715 853 1HG2 THR 109 1HG2 THR 109 -5.186 2.350 2.434 854 2HG2 THR 109 2HG2 THR 109 -4.008 1.038 2.388 855 3HG2 THR 109 3HG2 THR 109 -5.713 0.684 2.669 856 H ALA 110 H ALA 110 -8.324 1.562 2.151 857 HA ALA 110 HA ALA 110 -8.950 4.268 1.188 858 1HB ALA 110 1HB ALA 110 -11.011 3.360 1.386 859 2HB ALA 110 2HB ALA 110 -10.816 3.853 3.067 860 3HB ALA 110 3HB ALA 110 -10.497 2.183 2.596 861 H GLY 111 H GLY 111 -7.855 5.840 2.159 862 1HA GLY 111 1HA GLY 111 -6.897 5.438 4.902 863 2HA GLY 111 2HA GLY 111 -6.328 6.665 3.780 864 H VAL 112 H VAL 112 -7.731 6.447 6.606 865 HA VAL 112 HA VAL 112 -9.633 8.646 6.112 866 HB VAL 112 HB VAL 112 -10.669 7.989 8.305 867 1HG1 VAL 112 1HG1 VAL 112 -11.824 5.973 7.359 868 2HG1 VAL 112 2HG1 VAL 112 -10.687 6.035 6.012 869 3HG1 VAL 112 3HG1 VAL 112 -11.792 7.380 6.296 870 1HG2 VAL 112 1HG2 VAL 112 -8.824 6.745 9.257 871 2HG2 VAL 112 2HG2 VAL 112 -8.912 5.561 7.954 872 3HG2 VAL 112 3HG2 VAL 112 -10.235 5.697 9.112 873 H THR 113 H THR 113 -9.144 10.565 6.949 874 HA THR 113 HA THR 113 -7.298 10.686 9.237 875 HB THR 113 HB THR 113 -6.300 12.738 8.198 876 HG1 THR 113 HG1 THR 113 -7.782 11.853 5.951 877 1HG2 THR 113 1HG2 THR 113 -4.664 11.550 7.277 878 2HG2 THR 113 2HG2 THR 113 -5.745 10.807 6.097 879 3HG2 THR 113 3HG2 THR 113 -5.619 10.135 7.723 880 H ALA 114 H ALA 114 -8.003 11.902 10.868 881 HA ALA 114 HA ALA 114 -10.330 13.638 10.390 882 1HB ALA 114 1HB ALA 114 -10.690 11.792 11.965 883 2HB ALA 114 2HB ALA 114 -10.851 13.363 12.749 884 3HB ALA 114 3HB ALA 114 -9.386 12.409 12.979 885 H ARG 115 H ARG 115 -10.263 15.766 10.858 886 HA ARG 115 HA ARG 115 -7.737 16.821 11.944 887 1HB ARG 115 1HB ARG 115 -9.547 17.742 9.773 888 2HB ARG 115 2HB ARG 115 -8.772 18.981 10.751 889 1HG ARG 115 1HG ARG 115 -6.580 17.852 10.242 890 2HG ARG 115 2HG ARG 115 -7.457 16.871 9.065 891 1HD ARG 115 1HD ARG 115 -8.301 19.247 8.263 892 2HD ARG 115 2HD ARG 115 -6.797 19.771 9.020 893 HE ARG 115 HE ARG 115 -7.083 18.284 6.577 894 1HH1 ARG 115 1HH1 ARG 115 -4.948 19.041 9.232 895 2HH1 ARG 115 2HH1 ARG 115 -3.508 18.682 8.341 896 1HH2 ARG 115 1HH2 ARG 115 -5.190 17.813 5.403 897 2HH2 ARG 115 2HH2 ARG 115 -3.645 17.986 6.166 898 H ASP 116 H ASP 116 -8.235 16.911 14.102 899 HA ASP 116 HA ASP 116 -10.682 17.751 15.188 900 1HB ASP 116 1HB ASP 116 -7.886 17.589 16.287 901 2HB ASP 116 2HB ASP 116 -9.207 18.231 17.259 902 HD2 ASP 116 HD2 ASP 116 -10.558 15.093 17.756 903 H ASN 117 H ASN 117 -11.407 19.641 14.244 904 HA ASN 117 HA ASN 117 -9.985 22.066 15.095 905 1HB ASN 117 1HB ASN 117 -11.012 21.417 12.342 906 2HB ASN 117 2HB ASN 117 -10.831 23.085 12.875 907 1HD2 ASN 117 1HD2 ASN 117 -9.435 22.308 10.736 908 2HD2 ASN 117 2HD2 ASN 117 -7.757 22.151 11.113 909 H TRP 118 H TRP 118 -13.026 20.836 13.708 910 HA TRP 118 HA TRP 118 -14.476 22.587 15.574 911 1HB TRP 118 1HB TRP 118 -14.765 22.355 12.619 912 2HB TRP 118 2HB TRP 118 -16.235 22.551 13.567 913 HD1 TRP 118 HD1 TRP 118 -12.965 24.392 12.723 914 HE1 TRP 118 HE1 TRP 118 -13.305 26.900 13.186 915 HE3 TRP 118 HE3 TRP 118 -17.598 24.201 14.875 916 HZ2 TRP 118 HZ2 TRP 118 -15.276 28.576 14.315 917 HZ3 TRP 118 HZ3 TRP 118 -18.641 26.301 15.620 918 HH2 TRP 118 HH2 TRP 118 -17.502 28.443 15.346 919 H ASN 119 H ASN 119 -15.122 19.995 13.204 920 HA ASN 119 HA ASN 119 -16.571 18.553 15.323 921 1HB ASN 119 1HB ASN 119 -17.408 19.106 12.489 922 2HB ASN 119 2HB ASN 119 -18.020 17.695 13.347 923 1HD2 ASN 119 1HD2 ASN 119 -19.883 17.988 14.309 924 2HD2 ASN 119 2HD2 ASN 119 -20.495 19.482 14.924 925 H TYR 120 H TYR 120 -17.087 16.205 14.300 926 HA TYR 120 HA TYR 120 -14.445 15.131 13.618 927 1HB TYR 120 1HB TYR 120 -15.698 14.300 15.656 928 2HB TYR 120 2HB TYR 120 -16.865 13.583 14.550 929 HD1 TYR 120 HD1 TYR 120 -16.065 11.819 12.926 930 HD2 TYR 120 HD2 TYR 120 -13.673 13.206 16.159 931 HE1 TYR 120 HE1 TYR 120 -14.658 9.812 12.739 932 HE2 TYR 120 HE2 TYR 120 -12.259 11.202 15.981 933 HH TYR 120 HH TYR 120 -11.664 9.504 14.379 934 H ILE 121 H ILE 121 -14.343 15.356 11.415 935 HA ILE 121 HA ILE 121 -16.275 13.745 9.883 936 HB ILE 121 HB ILE 121 -15.887 15.370 7.977 937 1HG1 ILE 121 1HG1 ILE 121 -15.296 17.504 9.942 938 2HG1 ILE 121 2HG1 ILE 121 -13.958 16.425 9.561 939 1HG2 ILE 121 1HG2 ILE 121 -17.698 16.721 8.609 940 2HG2 ILE 121 2HG2 ILE 121 -17.268 16.648 10.317 941 3HG2 ILE 121 3HG2 ILE 121 -17.918 15.222 9.510 942 1HD1 ILE 121 1HD1 ILE 121 -13.834 17.129 7.388 943 2HD1 ILE 121 2HD1 ILE 121 -14.348 18.611 8.194 944 3HD1 ILE 121 3HD1 ILE 121 -15.526 17.620 7.335 945 HA PRO 122 HA PRO 122 -12.136 11.855 9.198 946 1HB PRO 122 1HB PRO 122 -13.975 9.904 7.898 947 2HB PRO 122 2HB PRO 122 -12.628 9.616 9.004 948 1HG PRO 122 1HG PRO 122 -15.142 9.422 9.852 949 2HG PRO 122 2HG PRO 122 -13.886 10.132 10.883 950 1HD PRO 122 1HD PRO 122 -16.050 11.477 9.326 951 2HD PRO 122 2HD PRO 122 -15.369 11.899 10.911 952 H LEU 123 H LEU 123 -10.923 11.525 7.308 953 HA LEU 123 HA LEU 123 -12.176 12.555 4.847 954 1HB LEU 123 1HB LEU 123 -9.529 13.063 6.105 955 2HB LEU 123 2HB LEU 123 -9.604 13.027 4.354 956 HG LEU 123 HG LEU 123 -11.450 14.761 4.520 957 1HD1 LEU 123 1HD1 LEU 123 -10.428 15.561 7.166 958 2HD1 LEU 123 2HD1 LEU 123 -11.505 14.164 7.140 959 3HD1 LEU 123 3HD1 LEU 123 -12.046 15.706 6.477 960 1HD2 LEU 123 1HD2 LEU 123 -9.785 16.603 5.064 961 2HD2 LEU 123 2HD2 LEU 123 -9.345 15.491 3.768 962 3HD2 LEU 123 3HD2 LEU 123 -8.621 15.313 5.366 963 HA PRO 124 HA PRO 124 -10.955 8.246 3.836 964 1HB PRO 124 1HB PRO 124 -12.948 7.824 2.056 965 2HB PRO 124 2HB PRO 124 -13.178 7.650 3.800 966 1HG PRO 124 1HG PRO 124 -13.890 9.946 2.015 967 2HG PRO 124 2HG PRO 124 -14.837 9.210 3.323 968 1HD PRO 124 1HD PRO 124 -13.429 11.509 3.640 969 2HD PRO 124 2HD PRO 124 -13.696 10.355 4.962 970 H VAL 125 H VAL 125 -9.782 7.513 2.115 971 HA VAL 125 HA VAL 125 -9.811 8.990 -0.397 972 HB VAL 125 HB VAL 125 -7.345 9.196 -0.435 973 1HG1 VAL 125 1HG1 VAL 125 -7.363 11.252 0.541 974 2HG1 VAL 125 2HG1 VAL 125 -8.149 10.671 2.010 975 3HG1 VAL 125 3HG1 VAL 125 -9.097 10.933 0.546 976 1HG2 VAL 125 1HG2 VAL 125 -6.507 9.183 2.148 977 2HG2 VAL 125 2HG2 VAL 125 -6.281 7.848 1.018 978 3HG2 VAL 125 3HG2 VAL 125 -7.635 7.827 2.148 979 H LEU 126 H LEU 126 -9.895 7.551 -1.984 980 HA LEU 126 HA LEU 126 -8.946 4.828 -1.484 981 1HB LEU 126 1HB LEU 126 -11.184 5.941 -2.846 982 2HB LEU 126 2HB LEU 126 -10.216 5.076 -4.025 983 HG LEU 126 HG LEU 126 -11.395 3.939 -1.489 984 1HD1 LEU 126 1HD1 LEU 126 -12.003 3.526 -4.410 985 2HD1 LEU 126 2HD1 LEU 126 -13.066 4.200 -3.174 986 3HD1 LEU 126 3HD1 LEU 126 -12.616 2.496 -3.116 987 1HD2 LEU 126 1HD2 LEU 126 -9.555 2.624 -1.604 988 2HD2 LEU 126 2HD2 LEU 126 -9.289 2.956 -3.316 989 3HD2 LEU 126 3HD2 LEU 126 -10.520 1.793 -2.824 990 H LEU 127 H LEU 127 -7.089 4.142 -2.299 991 HA LEU 127 HA LEU 127 -6.136 5.180 -4.848 992 1HB LEU 127 1HB LEU 127 -4.286 5.117 -2.476 993 2HB LEU 127 2HB LEU 127 -3.992 5.818 -4.057 994 HG LEU 127 HG LEU 127 -6.049 7.350 -3.361 995 1HD1 LEU 127 1HD1 LEU 127 -6.633 6.499 -1.278 996 2HD1 LEU 127 2HD1 LEU 127 -5.643 7.903 -0.883 997 3HD1 LEU 127 3HD1 LEU 127 -4.954 6.283 -0.786 998 1HD2 LEU 127 1HD2 LEU 127 -4.197 8.552 -3.882 999 2HD2 LEU 127 2HD2 LEU 127 -3.132 7.551 -2.895 1000 3HD2 LEU 127 3HD2 LEU 127 -4.155 8.769 -2.132 1001 HA PRO 128 HA PRO 128 -4.965 0.904 -5.139 1002 1HB PRO 128 1HB PRO 128 -3.791 0.937 -7.538 1003 2HB PRO 128 2HB PRO 128 -5.526 1.230 -7.365 1004 1HG PRO 128 1HG PRO 128 -3.305 3.186 -7.780 1005 2HG PRO 128 2HG PRO 128 -4.927 3.165 -8.493 1006 1HD PRO 128 1HD PRO 128 -4.167 4.716 -6.327 1007 2HD PRO 128 2HD PRO 128 -5.838 4.267 -6.717 1008 H LEU 129 H LEU 129 -3.190 -0.438 -4.866 1009 HA LEU 129 HA LEU 129 -0.502 0.551 -5.133 1010 1HB LEU 129 1HB LEU 129 -0.018 -0.076 -2.673 1011 2HB LEU 129 2HB LEU 129 -0.703 1.496 -3.032 1012 HG LEU 129 HG LEU 129 -1.676 0.284 -1.039 1013 1HD1 LEU 129 1HD1 LEU 129 -3.953 0.700 -2.846 1014 2HD1 LEU 129 2HD1 LEU 129 -2.798 2.030 -2.769 1015 3HD1 LEU 129 3HD1 LEU 129 -3.576 1.451 -1.296 1016 1HD2 LEU 129 1HD2 LEU 129 -1.713 -1.935 -2.309 1017 2HD2 LEU 129 2HD2 LEU 129 -3.189 -1.332 -3.064 1018 3HD2 LEU 129 3HD2 LEU 129 -3.114 -1.538 -1.315 1019 H ALA 130 H ALA 130 1.029 -1.201 -4.009 1020 HA ALA 130 HA ALA 130 -0.064 -3.887 -4.248 1021 1HB ALA 130 1HB ALA 130 2.411 -3.499 -5.807 1022 2HB ALA 130 2HB ALA 130 0.936 -2.832 -6.506 1023 3HB ALA 130 3HB ALA 130 1.027 -4.549 -6.113 1024 H SER 131 H SER 131 1.847 -5.520 -3.918 1025 HA SER 131 HA SER 131 4.027 -4.569 -2.307 1026 1HB SER 131 1HB SER 131 2.090 -4.554 -0.709 1027 2HB SER 131 2HB SER 131 1.943 -6.295 -0.952 1028 HG SER 131 HG SER 131 4.212 -6.379 -0.263 1029 H VAL 132 H VAL 132 5.669 -5.797 -2.920 1030 HA VAL 132 HA VAL 132 5.319 -8.692 -3.095 1031 HB VAL 132 HB VAL 132 4.974 -7.900 -5.387 1032 1HG1 VAL 132 1HG1 VAL 132 7.716 -6.682 -5.095 1033 2HG1 VAL 132 2HG1 VAL 132 6.194 -5.816 -5.304 1034 3HG1 VAL 132 3HG1 VAL 132 6.824 -6.820 -6.610 1035 1HG2 VAL 132 1HG2 VAL 132 7.700 -9.070 -5.513 1036 2HG2 VAL 132 2HG2 VAL 132 6.225 -9.542 -6.356 1037 3HG2 VAL 132 3HG2 VAL 132 6.453 -9.980 -4.662 1038 H GLY 133 H GLY 133 7.025 -9.795 -2.314 1039 1HA GLY 133 1HA GLY 133 9.714 -9.000 -2.466 1040 2HA GLY 133 2HA GLY 133 9.074 -8.475 -0.917 1041 H TYR 134 H TYR 134 10.803 -9.961 -0.150 1042 HA TYR 134 HA TYR 134 9.634 -12.585 0.346 1043 1HB TYR 134 1HB TYR 134 11.802 -13.719 -0.128 1044 2HB TYR 134 2HB TYR 134 11.048 -13.030 -1.562 1045 HD1 TYR 134 HD1 TYR 134 13.955 -13.034 0.569 1046 HD2 TYR 134 HD2 TYR 134 11.943 -10.879 -2.498 1047 HE1 TYR 134 HE1 TYR 134 16.030 -11.811 0.076 1048 HE2 TYR 134 HE2 TYR 134 14.013 -9.650 -3.000 1049 HH TYR 134 HH TYR 134 16.513 -10.054 -2.705 1050 H GLY 135 H GLY 135 10.303 -13.546 2.273 1051 1HA GLY 135 1HA GLY 135 11.027 -13.574 4.449 1052 2HA GLY 135 2HA GLY 135 12.454 -12.733 3.864 1053 HA PRO 136 HA PRO 136 10.412 -9.805 6.752 1054 1HB PRO 136 1HB PRO 136 12.702 -8.726 7.705 1055 2HB PRO 136 2HB PRO 136 12.034 -10.241 8.325 1056 1HG PRO 136 1HG PRO 136 14.241 -9.812 6.345 1057 2HG PRO 136 2HG PRO 136 14.158 -10.954 7.699 1058 1HD PRO 136 1HD PRO 136 13.674 -11.680 5.127 1059 2HD PRO 136 2HD PRO 136 12.887 -12.463 6.513 1060 H VAL 137 H VAL 137 12.329 -9.497 3.971 1061 HA VAL 137 HA VAL 137 12.052 -6.569 3.970 1062 HB VAL 137 HB VAL 137 14.341 -7.391 3.612 1063 1HG1 VAL 137 1HG1 VAL 137 13.597 -9.526 2.483 1064 2HG1 VAL 137 2HG1 VAL 137 14.980 -8.709 1.759 1065 3HG1 VAL 137 3HG1 VAL 137 13.387 -8.570 1.016 1066 1HG2 VAL 137 1HG2 VAL 137 13.681 -6.364 0.929 1067 2HG2 VAL 137 2HG2 VAL 137 14.820 -5.758 2.131 1068 3HG2 VAL 137 3HG2 VAL 137 13.100 -5.401 2.288 1069 H THR 138 H THR 138 10.359 -5.806 2.905 1070 HA THR 138 HA THR 138 9.601 -7.050 0.362 1071 HB THR 138 HB THR 138 7.995 -8.007 1.804 1072 HG1 THR 138 HG1 THR 138 6.105 -7.071 1.090 1073 1HG2 THR 138 1HG2 THR 138 8.104 -5.427 3.225 1074 2HG2 THR 138 2HG2 THR 138 7.926 -7.067 3.849 1075 3HG2 THR 138 3HG2 THR 138 6.537 -6.232 3.154 1076 H PHE 139 H PHE 139 8.686 -5.652 -1.152 1077 HA PHE 139 HA PHE 139 8.995 -2.798 -0.504 1078 1HB PHE 139 1HB PHE 139 9.476 -4.395 -2.982 1079 2HB PHE 139 2HB PHE 139 8.996 -2.710 -3.151 1080 HD1 PHE 139 HD1 PHE 139 10.434 -0.920 -2.291 1081 HD2 PHE 139 HD2 PHE 139 11.642 -4.998 -2.194 1082 HE1 PHE 139 HE1 PHE 139 12.763 -0.217 -1.920 1083 HE2 PHE 139 HE2 PHE 139 13.973 -4.305 -1.821 1084 HZ PHE 139 HZ PHE 139 14.536 -1.910 -1.683 1085 H GLN 140 H GLN 140 7.397 -1.338 -1.023 1086 HA GLN 140 HA GLN 140 4.850 -2.483 -1.967 1087 1HB GLN 140 1HB GLN 140 4.789 -1.970 0.447 1088 2HB GLN 140 2HB GLN 140 5.214 -0.301 0.094 1089 1HG GLN 140 1HG GLN 140 3.118 -0.176 -1.288 1090 2HG GLN 140 2HG GLN 140 2.680 -1.747 -0.619 1091 1HE2 GLN 140 1HE2 GLN 140 0.893 -1.022 0.471 1092 2HE2 GLN 140 2HE2 GLN 140 0.982 0.017 1.848 1093 H MET 141 H MET 141 4.058 -1.576 -3.743 1094 HA MET 141 HA MET 141 5.143 1.023 -4.585 1095 1HB MET 141 1HB MET 141 4.010 -1.297 -6.137 1096 2HB MET 141 2HB MET 141 4.219 0.292 -6.860 1097 1HG MET 141 1HG MET 141 6.465 -1.216 -5.557 1098 2HG MET 141 2HG MET 141 6.062 -1.373 -7.266 1099 1HE MET 141 1HE MET 141 5.353 1.175 -8.423 1100 2HE MET 141 2HE MET 141 6.775 0.400 -9.118 1101 3HE MET 141 3HE MET 141 6.814 2.117 -8.716 1102 H THR 142 H THR 142 3.711 2.541 -5.618 1103 HA THR 142 HA THR 142 0.857 2.169 -5.086 1104 HB THR 142 HB THR 142 1.771 3.332 -3.120 1105 HG1 THR 142 HG1 THR 142 0.055 4.529 -3.082 1106 1HG2 THR 142 1HG2 THR 142 3.639 4.475 -4.425 1107 2HG2 THR 142 2HG2 THR 142 2.822 5.408 -3.171 1108 3HG2 THR 142 3HG2 THR 142 2.423 5.673 -4.867 1109 H TYR 143 H TYR 143 -0.238 2.631 -6.866 1110 HA TYR 143 HA TYR 143 0.991 4.374 -8.877 1111 1HB TYR 143 1HB TYR 143 -1.338 2.458 -9.124 1112 2HB TYR 143 2HB TYR 143 -0.635 3.388 -10.443 1113 HD1 TYR 143 HD1 TYR 143 0.100 0.725 -7.967 1114 HD2 TYR 143 HD2 TYR 143 1.239 2.583 -11.621 1115 HE1 TYR 143 HE1 TYR 143 1.698 -1.096 -8.388 1116 HE2 TYR 143 HE2 TYR 143 2.840 0.766 -12.052 1117 HH TYR 143 HH TYR 143 4.117 -0.919 -10.709 1118 H ILE 144 H ILE 144 -0.310 5.951 -9.989 1119 HA ILE 144 HA ILE 144 -2.267 7.189 -8.195 1120 HB ILE 144 HB ILE 144 -0.366 8.575 -8.927 1121 1HG1 ILE 144 1HG1 ILE 144 -1.882 10.422 -10.043 1122 2HG1 ILE 144 2HG1 ILE 144 -3.178 9.295 -9.653 1123 1HG2 ILE 144 1HG2 ILE 144 -0.231 9.334 -11.258 1124 2HG2 ILE 144 2HG2 ILE 144 -1.527 8.216 -11.685 1125 3HG2 ILE 144 3HG2 ILE 144 0.020 7.595 -11.111 1126 1HD1 ILE 144 1HD1 ILE 144 -2.217 9.319 -7.281 1127 2HD1 ILE 144 2HD1 ILE 144 -3.106 10.738 -7.837 1128 3HD1 ILE 144 3HD1 ILE 144 -1.342 10.760 -7.802 1129 HA PRO 145 HA PRO 145 -5.557 5.925 -10.914 1130 1HB PRO 145 1HB PRO 145 -7.508 7.552 -9.963 1131 2HB PRO 145 2HB PRO 145 -6.952 6.115 -9.097 1132 1HG PRO 145 1HG PRO 145 -6.215 8.986 -8.673 1133 2HG PRO 145 2HG PRO 145 -6.591 7.739 -7.470 1134 1HD PRO 145 1HD PRO 145 -4.053 8.464 -8.069 1135 2HD PRO 145 2HD PRO 145 -4.484 6.811 -7.587 1136 H GLY 146 H GLY 146 -6.145 6.526 -12.915 1137 1HA GLY 146 1HA GLY 146 -6.556 7.837 -14.758 1138 2HA GLY 146 2HA GLY 146 -6.801 9.185 -13.658 1139 H THR 147 H THR 147 -5.147 8.441 -16.261 1140 HA THR 147 HA THR 147 -2.933 10.206 -15.546 1141 HB THR 147 HB THR 147 -1.972 8.010 -15.249 1142 HG1 THR 147 HG1 THR 147 -1.179 9.043 -17.768 1143 1HG2 THR 147 1HG2 THR 147 -3.711 7.075 -17.095 1144 2HG2 THR 147 2HG2 THR 147 -2.272 6.215 -16.546 1145 3HG2 THR 147 3HG2 THR 147 -2.222 7.153 -18.039 1146 H TYR 148 H TYR 148 -4.261 11.669 -16.809 1147 HA TYR 148 HA TYR 148 -4.825 11.183 -19.550 1148 1HB TYR 148 1HB TYR 148 -5.293 13.635 -19.632 1149 2HB TYR 148 2HB TYR 148 -6.145 12.797 -18.338 1150 HD1 TYR 148 HD1 TYR 148 -5.658 13.260 -16.027 1151 HD2 TYR 148 HD2 TYR 148 -3.425 15.143 -19.121 1152 HE1 TYR 148 HE1 TYR 148 -4.736 14.846 -14.389 1153 HE2 TYR 148 HE2 TYR 148 -2.496 16.733 -17.492 1154 HH TYR 148 HH TYR 148 -3.733 17.046 -14.317 1155 H ASN 149 H ASN 149 -3.495 11.233 -21.227 1156 HA ASN 149 HA ASN 149 -1.745 11.722 -22.595 1157 1HB ASN 149 1HB ASN 149 -1.095 13.999 -20.717 1158 2HB ASN 149 2HB ASN 149 -0.620 13.837 -22.406 1159 1HD2 ASN 149 1HD2 ASN 149 -2.926 13.084 -23.606 1160 2HD2 ASN 149 2HD2 ASN 149 -4.112 14.332 -23.459 1161 H ASN 150 H ASN 150 -0.486 12.656 -19.389 1162 HA ASN 150 HA ASN 150 1.052 10.305 -19.047 1163 1HB ASN 150 1HB ASN 150 2.306 12.575 -20.481 1164 2HB ASN 150 2HB ASN 150 3.267 11.845 -19.198 1165 1HD2 ASN 150 1HD2 ASN 150 3.521 9.483 -19.294 1166 2HD2 ASN 150 2HD2 ASN 150 3.660 8.738 -20.846 1167 H GLY 151 H GLY 151 3.019 10.986 -17.410 1168 1HA GLY 151 1HA GLY 151 3.580 12.400 -15.544 1169 2HA GLY 151 2HA GLY 151 1.897 12.901 -15.473 1170 H ASN 152 H ASN 152 2.795 9.557 -15.892 1171 HA ASN 152 HA ASN 152 1.264 8.727 -13.663 1172 1HB ASN 152 1HB ASN 152 2.087 7.453 -15.851 1173 2HB ASN 152 2HB ASN 152 3.377 6.937 -14.768 1174 1HD2 ASN 152 1HD2 ASN 152 -0.071 6.906 -15.336 1175 2HD2 ASN 152 2HD2 ASN 152 -0.422 5.557 -14.315 1176 H VAL 153 H VAL 153 1.865 9.352 -11.673 1177 HA VAL 153 HA VAL 153 4.683 9.241 -10.909 1178 HB VAL 153 HB VAL 153 3.851 10.289 -8.767 1179 1HG1 VAL 153 1HG1 VAL 153 3.118 12.463 -10.152 1180 2HG1 VAL 153 2HG1 VAL 153 3.816 11.507 -11.459 1181 3HG1 VAL 153 3HG1 VAL 153 4.787 11.907 -10.042 1182 1HG2 VAL 153 1HG2 VAL 153 1.362 11.126 -10.103 1183 2HG2 VAL 153 2HG2 VAL 153 1.678 10.782 -8.403 1184 3HG2 VAL 153 3HG2 VAL 153 1.405 9.457 -9.535 1185 H TYR 154 H TYR 154 5.519 7.707 -9.639 1186 HA TYR 154 HA TYR 154 3.686 5.950 -8.154 1187 1HB TYR 154 1HB TYR 154 5.328 4.072 -8.730 1188 2HB TYR 154 2HB TYR 154 4.257 4.620 -10.017 1189 HD1 TYR 154 HD1 TYR 154 5.142 5.300 -12.067 1190 HD2 TYR 154 HD2 TYR 154 7.702 5.065 -8.678 1191 HE1 TYR 154 HE1 TYR 154 7.087 5.717 -13.513 1192 HE2 TYR 154 HE2 TYR 154 9.653 5.482 -10.114 1193 HH TYR 154 HH TYR 154 9.712 5.108 -13.290 1194 H PHE 155 H PHE 155 4.304 5.432 -6.123 1195 HA PHE 155 HA PHE 155 6.946 6.397 -5.243 1196 1HB PHE 155 1HB PHE 155 4.386 7.127 -4.322 1197 2HB PHE 155 2HB PHE 155 5.076 6.107 -3.064 1198 HD1 PHE 155 HD1 PHE 155 5.386 9.255 -4.893 1199 HD2 PHE 155 HD2 PHE 155 7.026 6.804 -1.825 1200 HE1 PHE 155 HE1 PHE 155 6.713 11.163 -4.084 1201 HE2 PHE 155 HE2 PHE 155 8.356 8.707 -1.010 1202 HZ PHE 155 HZ PHE 155 8.200 10.890 -2.139 1203 H ALA 156 H ALA 156 7.867 5.247 -3.376 1204 HA ALA 156 HA ALA 156 6.955 2.469 -3.122 1205 1HB ALA 156 1HB ALA 156 8.877 2.802 -4.810 1206 2HB ALA 156 2HB ALA 156 9.032 1.534 -3.593 1207 3HB ALA 156 3HB ALA 156 9.879 3.067 -3.383 1208 H TRP 157 H TRP 157 7.149 1.611 -1.111 1209 HA TRP 157 HA TRP 157 8.591 3.189 0.912 1210 1HB TRP 157 1HB TRP 157 5.951 1.820 1.435 1211 2HB TRP 157 2HB TRP 157 6.809 2.946 2.482 1212 HD1 TRP 157 HD1 TRP 157 4.555 2.843 -0.600 1213 HE1 TRP 157 HE1 TRP 157 3.686 5.219 -1.069 1214 HE3 TRP 157 HE3 TRP 157 7.393 5.426 2.777 1215 HZ2 TRP 157 HZ2 TRP 157 4.143 7.843 -0.131 1216 HZ3 TRP 157 HZ3 TRP 157 7.117 7.866 2.928 1217 HH2 TRP 157 HH2 TRP 157 5.526 9.048 1.503 1218 H MET 158 H MET 158 9.399 2.012 2.704 1219 HA MET 158 HA MET 158 9.973 -0.774 2.055 1220 1HB MET 158 1HB MET 158 11.213 1.276 3.845 1221 2HB MET 158 2HB MET 158 11.497 -0.428 4.174 1222 1HG MET 158 1HG MET 158 12.001 0.800 1.484 1223 2HG MET 158 2HG MET 158 13.216 0.772 2.761 1224 1HE MET 158 1HE MET 158 15.166 -1.030 1.815 1225 2HE MET 158 2HE MET 158 14.334 -0.163 0.524 1226 3HE MET 158 3HE MET 158 14.605 -1.901 0.386 1227 H ARG 159 H ARG 159 9.282 -2.487 3.217 1228 HA ARG 159 HA ARG 159 7.819 -1.970 5.715 1229 1HB ARG 159 1HB ARG 159 6.225 -2.272 3.833 1230 2HB ARG 159 2HB ARG 159 6.915 -3.862 3.536 1231 1HG ARG 159 1HG ARG 159 6.304 -4.120 6.134 1232 2HG ARG 159 2HG ARG 159 5.068 -2.958 5.647 1233 1HD ARG 159 1HD ARG 159 5.131 -4.895 3.624 1234 2HD ARG 159 2HD ARG 159 5.226 -5.789 5.142 1235 HE ARG 159 HE ARG 159 3.200 -3.828 5.295 1236 1HH1 ARG 159 1HH1 ARG 159 3.897 -6.911 3.816 1237 2HH1 ARG 159 2HH1 ARG 159 2.234 -7.386 3.727 1238 1HH2 ARG 159 1HH2 ARG 159 1.013 -4.450 5.180 1239 2HH2 ARG 159 2HH2 ARG 159 0.596 -5.989 4.501 1240 H PHE 160 H PHE 160 8.051 -3.488 7.308 1241 HA PHE 160 HA PHE 160 9.904 -5.703 6.723 1242 1HB PHE 160 1HB PHE 160 10.070 -3.611 8.661 1243 2HB PHE 160 2HB PHE 160 9.877 -5.139 9.515 1244 HD1 PHE 160 HD1 PHE 160 11.808 -3.776 6.624 1245 HD2 PHE 160 HD2 PHE 160 11.793 -6.248 10.088 1246 HE1 PHE 160 HE1 PHE 160 14.196 -4.261 6.282 1247 HE2 PHE 160 HE2 PHE 160 14.182 -6.737 9.754 1248 HZ PHE 160 HZ PHE 160 15.386 -5.744 7.849 1249 H GLN 161 H GLN 161 9.323 -7.726 7.277 1250 HA GLN 161 HA GLN 161 6.706 -8.053 8.581 1251 1HB GLN 161 1HB GLN 161 7.484 -9.004 6.168 1252 2HB GLN 161 2HB GLN 161 7.934 -10.359 7.195 1253 1HG GLN 161 1HG GLN 161 5.833 -11.034 6.925 1254 2HG GLN 161 2HG GLN 161 5.420 -9.774 8.086 1255 1HE2 GLN 161 1HE2 GLN 161 3.439 -10.410 6.540 1256 2HE2 GLN 161 2HE2 GLN 161 3.178 -9.263 5.275 1257 H PHE 162 H PHE 162 6.716 -8.752 10.604 1258 HA PHE 162 HA PHE 162 8.850 -10.585 11.460 1259 1HB PHE 162 1HB PHE 162 8.721 -7.972 12.281 1260 2HB PHE 162 2HB PHE 162 7.837 -8.797 13.561 1261 HD1 PHE 162 HD1 PHE 162 11.033 -8.923 11.666 1262 HD2 PHE 162 HD2 PHE 162 8.989 -9.818 15.290 1263 HE1 PHE 162 HE1 PHE 162 13.165 -9.588 12.699 1264 HE2 PHE 162 HE2 PHE 162 11.116 -10.485 16.330 1265 HZ PHE 162 HZ PHE 162 13.208 -10.369 15.035 1266 H LEU 163 H LEU 163 8.185 -11.418 13.805 1267 HA LEU 163 HA LEU 163 5.322 -12.086 13.769 1268 1HB LEU 163 1HB LEU 163 7.509 -14.057 14.415 1269 2HB LEU 163 2HB LEU 163 5.791 -14.385 14.286 1270 HG LEU 163 HG LEU 163 7.161 -13.304 11.879 1271 1HD1 LEU 163 1HD1 LEU 163 8.741 -14.981 12.662 1272 2HD1 LEU 163 2HD1 LEU 163 7.897 -15.540 11.217 1273 3HD1 LEU 163 3HD1 LEU 163 7.437 -16.161 12.801 1274 1HD2 LEU 163 1HD2 LEU 163 4.801 -13.683 11.760 1275 2HD2 LEU 163 2HD2 LEU 163 4.980 -15.318 12.396 1276 3HD2 LEU 163 3HD2 LEU 163 5.605 -14.922 10.796 1277 H GLU 164 H GLU 164 4.382 -12.533 15.792 1278 HA GLU 164 HA GLU 164 5.946 -11.516 18.067 1279 1HB GLU 164 1HB GLU 164 3.613 -10.539 17.152 1280 2HB GLU 164 2HB GLU 164 2.997 -11.745 18.274 1281 1HG GLU 164 1HG GLU 164 4.481 -10.711 20.022 1282 2HG GLU 164 2HG GLU 164 4.776 -9.402 18.878 1283 HE2 GLU 164 HE2 GLU 164 1.428 -8.297 19.202 1284 H HIS 165 H HIS 165 6.859 -13.315 18.935 1285 HA HIS 165 HA HIS 165 5.329 -15.741 19.293 1286 1HB HIS 165 1HB HIS 165 8.006 -15.226 18.965 1287 2HB HIS 165 2HB HIS 165 7.902 -15.548 20.693 1288 HD1 HIS 165 HD1 HIS 165 9.410 -17.491 18.886 1289 HD2 HIS 165 HD2 HIS 165 5.385 -17.885 19.842 1290 HE1 HIS 165 HE1 HIS 165 8.876 -19.926 18.557 1291 HE2 HIS 165 HE2 HIS 165 6.457 -20.156 19.223 1292 H HIS 166 H HIS 166 4.678 -16.633 21.242 1293 HA HIS 166 HA HIS 166 5.235 -15.462 23.768 1294 1HB HIS 166 1HB HIS 166 2.867 -14.733 24.241 1295 2HB HIS 166 2HB HIS 166 3.751 -13.706 23.119 1296 HD1 HIS 166 HD1 HIS 166 3.072 -13.903 20.571 1297 HD2 HIS 166 HD2 HIS 166 0.577 -15.891 23.235 1298 HE1 HIS 166 HE1 HIS 166 0.976 -14.412 19.278 1299 HE2 HIS 166 HE2 HIS 166 -0.553 -15.534 20.937 1300 H HIS 167 H HIS 167 2.929 -17.370 21.876 1301 HA HIS 167 HA HIS 167 2.467 -19.127 24.164 1302 1HB HIS 167 1HB HIS 167 1.155 -18.858 21.465 1303 2HB HIS 167 2HB HIS 167 0.834 -20.230 22.521 1304 HD1 HIS 167 HD1 HIS 167 0.911 -18.346 25.157 1305 HD2 HIS 167 HD2 HIS 167 -1.446 -17.873 21.769 1306 HE1 HIS 167 HE1 HIS 167 -1.070 -16.987 25.901 1307 HE2 HIS 167 HE2 HIS 167 -2.439 -16.642 23.815 1308 H HIS 168 H HIS 168 2.618 -21.459 23.900 1309 HA HIS 168 HA HIS 168 5.044 -22.182 22.494 1310 1HB HIS 168 1HB HIS 168 3.233 -23.726 24.357 1311 2HB HIS 168 2HB HIS 168 4.683 -24.404 23.622 1312 HD1 HIS 168 HD1 HIS 168 5.822 -24.718 25.913 1313 HD2 HIS 168 HD2 HIS 168 4.825 -20.778 25.049 1314 HE1 HIS 168 HE1 HIS 168 7.031 -23.328 27.623 1315 HE2 HIS 168 HE2 HIS 168 6.340 -20.955 27.136 1316 H HIS 169 H HIS 169 1.598 -22.803 22.286 1317 HA HIS 169 HA HIS 169 1.829 -24.858 20.304 1318 1HB HIS 169 1HB HIS 169 -0.516 -23.209 21.259 1319 2HB HIS 169 2HB HIS 169 -0.654 -24.486 20.055 1320 HD1 HIS 169 HD1 HIS 169 -2.320 -25.042 22.363 1321 HD2 HIS 169 HD2 HIS 169 1.731 -25.969 22.409 1322 HE1 HIS 169 HE1 HIS 169 -2.052 -26.799 24.142 1323 HE2 HIS 169 HE2 HIS 169 0.419 -27.283 24.210 1324 H HIS 170 H HIS 170 0.972 -24.680 18.114 1325 HA HIS 170 HA HIS 170 1.673 -22.087 16.929 1326 1HB HIS 170 1HB HIS 170 1.626 -24.889 15.817 1327 2HB HIS 170 2HB HIS 170 1.755 -23.473 14.779 1328 HD1 HIS 170 HD1 HIS 170 3.622 -22.251 17.349 1329 HD2 HIS 170 HD2 HIS 170 4.288 -25.429 14.754 1330 HE1 HIS 170 HE1 HIS 170 6.110 -22.623 17.365 1331 HE2 HIS 170 HE2 HIS 170 6.479 -24.606 15.856 Start of MODEL 6 1 1H MET 1 1H MET 1 -3.704 -4.558 45.544 2 2H MET 1 2H MET 1 -4.348 -5.038 44.028 3 H MET 1 H MET 1 -4.395 -4.903 44.973 4 3H MET 1 3H MET 1 -3.040 -3.930 44.094 5 HA MET 1 HA MET 1 -2.119 -5.939 43.499 6 1HB MET 1 1HB MET 1 -0.941 -4.666 45.244 7 2HB MET 1 2HB MET 1 -1.825 -5.544 46.484 8 1HG MET 1 1HG MET 1 -0.802 -7.650 45.502 9 2HG MET 1 2HG MET 1 0.274 -6.576 44.609 10 1HE MET 1 1HE MET 1 2.265 -5.387 45.533 11 2HE MET 1 2HE MET 1 2.544 -5.029 47.237 12 3HE MET 1 3HE MET 1 1.181 -4.292 46.392 13 H ASN 2 H ASN 2 -3.346 -7.657 42.882 14 HA ASN 2 HA ASN 2 -3.894 -9.660 44.917 15 1HB ASN 2 1HB ASN 2 -5.987 -8.167 43.460 16 2HB ASN 2 2HB ASN 2 -6.196 -9.915 43.500 17 1HD2 ASN 2 1HD2 ASN 2 -6.645 -7.034 45.147 18 2HD2 ASN 2 2HD2 ASN 2 -7.068 -7.682 46.692 19 H ALA 3 H ALA 3 -2.405 -11.027 44.027 20 HA ALA 3 HA ALA 3 -1.988 -11.512 41.311 21 1HB ALA 3 1HB ALA 3 -1.211 -13.848 42.344 22 2HB ALA 3 2HB ALA 3 -1.308 -12.905 43.831 23 3HB ALA 3 3HB ALA 3 -0.267 -12.367 42.512 24 H ASP 4 H ASP 4 -4.536 -12.552 43.378 25 HA ASP 4 HA ASP 4 -5.285 -14.859 41.844 26 1HB ASP 4 1HB ASP 4 -6.368 -13.393 44.190 27 2HB ASP 4 2HB ASP 4 -7.518 -14.329 43.240 28 HD2 ASP 4 HD2 ASP 4 -6.500 -17.173 44.819 29 H GLU 5 H GLU 5 -6.787 -11.668 42.354 30 HA GLU 5 HA GLU 5 -8.706 -11.970 40.302 31 1HB GLU 5 1HB GLU 5 -8.342 -10.189 42.322 32 2HB GLU 5 2HB GLU 5 -7.825 -9.224 40.946 33 1HG GLU 5 1HG GLU 5 -9.974 -8.724 40.697 34 2HG GLU 5 2HG GLU 5 -10.151 -10.350 40.041 35 HE2 GLU 5 HE2 GLU 5 -12.327 -9.639 43.015 36 H TRP 6 H TRP 6 -5.376 -11.008 40.314 37 HA TRP 6 HA TRP 6 -5.401 -9.660 37.796 38 1HB TRP 6 1HB TRP 6 -3.403 -10.445 39.794 39 2HB TRP 6 2HB TRP 6 -2.804 -10.505 38.140 40 HD1 TRP 6 HD1 TRP 6 -1.426 -8.363 37.848 41 HE1 TRP 6 HE1 TRP 6 -1.822 -5.853 38.257 42 HE3 TRP 6 HE3 TRP 6 -5.983 -8.625 40.152 43 HZ2 TRP 6 HZ2 TRP 6 -3.804 -4.203 39.403 44 HZ3 TRP 6 HZ3 TRP 6 -7.060 -6.535 40.874 45 HH2 TRP 6 HH2 TRP 6 -5.992 -4.369 40.506 46 H MET 7 H MET 7 -4.510 -12.933 38.839 47 HA MET 7 HA MET 7 -3.662 -13.879 36.337 48 1HB MET 7 1HB MET 7 -4.401 -15.051 38.932 49 2HB MET 7 2HB MET 7 -4.655 -16.119 37.557 50 1HG MET 7 1HG MET 7 -2.065 -14.702 37.696 51 2HG MET 7 2HG MET 7 -2.352 -15.975 38.880 52 1HE MET 7 1HE MET 7 -2.057 -18.732 38.108 53 2HE MET 7 2HE MET 7 -3.075 -19.059 36.705 54 3HE MET 7 3HE MET 7 -3.699 -18.090 38.041 55 H THR 8 H THR 8 -6.839 -14.013 37.916 56 HA THR 8 HA THR 8 -8.174 -15.482 35.945 57 HB THR 8 HB THR 8 -10.247 -14.454 36.885 58 HG1 THR 8 HG1 THR 8 -8.461 -13.041 38.570 59 1HG2 THR 8 1HG2 THR 8 -10.206 -15.840 38.615 60 2HG2 THR 8 2HG2 THR 8 -8.869 -14.978 39.379 61 3HG2 THR 8 3HG2 THR 8 -8.543 -16.202 38.151 62 H THR 9 H THR 9 -7.565 -12.022 36.243 63 HA THR 9 HA THR 9 -9.162 -11.340 33.954 64 HB THR 9 HB THR 9 -7.977 -9.095 34.232 65 HG1 THR 9 HG1 THR 9 -6.373 -9.032 35.554 66 1HG2 THR 9 1HG2 THR 9 -10.106 -9.195 35.188 67 2HG2 THR 9 2HG2 THR 9 -9.050 -8.624 36.481 68 3HG2 THR 9 3HG2 THR 9 -9.580 -10.305 36.454 69 H PHE 10 H PHE 10 -5.809 -12.093 34.576 70 HA PHE 10 HA PHE 10 -4.693 -11.086 32.199 71 1HB PHE 10 1HB PHE 10 -3.827 -12.670 34.432 72 2HB PHE 10 2HB PHE 10 -3.252 -13.409 32.941 73 HD1 PHE 10 HD1 PHE 10 -1.381 -12.564 31.853 74 HD2 PHE 10 HD2 PHE 10 -3.351 -10.187 34.782 75 HE1 PHE 10 HE1 PHE 10 0.448 -10.922 31.743 76 HE2 PHE 10 HE2 PHE 10 -1.526 -8.539 34.677 77 HZ PHE 10 HZ PHE 10 0.376 -8.905 33.156 78 H ARG 11 H ARG 11 -6.295 -14.119 32.955 79 HA ARG 11 HA ARG 11 -5.593 -15.573 30.671 80 1HB ARG 11 1HB ARG 11 -6.875 -16.289 32.827 81 2HB ARG 11 2HB ARG 11 -8.309 -15.821 31.921 82 1HG ARG 11 1HG ARG 11 -7.047 -17.389 30.108 83 2HG ARG 11 2HG ARG 11 -6.561 -18.157 31.621 84 1HD ARG 11 1HD ARG 11 -9.006 -18.122 32.269 85 2HD ARG 11 2HD ARG 11 -9.349 -17.662 30.602 86 HE ARG 11 HE ARG 11 -8.700 -20.265 31.560 87 1HH1 ARG 11 1HH1 ARG 11 -8.365 -18.143 28.809 88 2HH1 ARG 11 2HH1 ARG 11 -8.230 -19.438 27.668 89 1HH2 ARG 11 1HH2 ARG 11 -8.523 -21.970 30.061 90 2HH2 ARG 11 2HH2 ARG 11 -8.321 -21.611 28.378 91 H GLU 12 H GLU 12 -8.017 -13.102 31.182 92 HA GLU 12 HA GLU 12 -9.487 -13.541 28.800 93 1HB GLU 12 1HB GLU 12 -9.505 -11.673 30.988 94 2HB GLU 12 2HB GLU 12 -9.655 -10.802 29.468 95 1HG GLU 12 1HG GLU 12 -11.832 -11.230 29.677 96 2HG GLU 12 2HG GLU 12 -11.411 -12.839 29.093 97 HE2 GLU 12 HE2 GLU 12 -12.954 -12.567 32.608 98 H ASN 13 H ASN 13 -6.573 -11.765 29.542 99 HA ASN 13 HA ASN 13 -6.511 -10.311 27.070 100 1HB ASN 13 1HB ASN 13 -5.388 -9.625 29.253 101 2HB ASN 13 2HB ASN 13 -4.164 -10.840 28.892 102 1HD2 ASN 13 1HD2 ASN 13 -4.082 -7.869 29.082 103 2HD2 ASN 13 2HD2 ASN 13 -3.365 -7.349 27.599 104 H ILE 14 H ILE 14 -4.869 -13.184 28.346 105 HA ILE 14 HA ILE 14 -3.282 -13.653 26.046 106 HB ILE 14 HB ILE 14 -4.194 -15.716 28.051 107 1HG1 ILE 14 1HG1 ILE 14 -3.224 -13.837 29.250 108 2HG1 ILE 14 2HG1 ILE 14 -2.094 -15.187 29.261 109 1HG2 ILE 14 1HG2 ILE 14 -3.127 -16.538 25.965 110 2HG2 ILE 14 2HG2 ILE 14 -2.216 -16.923 27.424 111 3HG2 ILE 14 3HG2 ILE 14 -1.690 -15.604 26.379 112 1HD1 ILE 14 1HD1 ILE 14 -0.856 -13.203 28.868 113 2HD1 ILE 14 2HD1 ILE 14 -1.957 -12.697 27.586 114 3HD1 ILE 14 3HD1 ILE 14 -0.913 -14.099 27.349 115 H ALA 15 H ALA 15 -6.470 -14.781 27.060 116 HA ALA 15 HA ALA 15 -6.805 -16.659 24.955 117 1HB ALA 15 1HB ALA 15 -9.333 -16.152 25.620 118 2HB ALA 15 2HB ALA 15 -8.540 -15.444 27.028 119 3HB ALA 15 3HB ALA 15 -8.270 -17.140 26.623 120 H GLN 16 H GLN 16 -7.389 -13.229 25.271 121 HA GLN 16 HA GLN 16 -9.093 -12.905 23.043 122 1HB GLN 16 1HB GLN 16 -8.767 -11.212 24.836 123 2HB GLN 16 2HB GLN 16 -7.155 -10.900 24.210 124 1HG GLN 16 1HG GLN 16 -8.162 -10.212 22.063 125 2HG GLN 16 2HG GLN 16 -9.759 -10.434 22.776 126 1HE2 GLN 16 1HE2 GLN 16 -6.737 -8.652 23.118 127 2HE2 GLN 16 2HE2 GLN 16 -7.435 -7.248 23.845 128 H THR 17 H THR 17 -5.574 -12.515 23.392 129 HA THR 17 HA THR 17 -5.162 -11.949 20.625 130 HB THR 17 HB THR 17 -2.775 -12.163 21.150 131 HG1 THR 17 HG1 THR 17 -3.608 -12.956 23.739 132 1HG2 THR 17 1HG2 THR 17 -2.925 -10.105 21.935 133 2HG2 THR 17 2HG2 THR 17 -3.162 -10.782 23.547 134 3HG2 THR 17 3HG2 THR 17 -4.556 -10.401 22.536 135 H TRP 18 H TRP 18 -5.190 -14.841 22.583 136 HA TRP 18 HA TRP 18 -3.858 -16.586 20.840 137 1HB TRP 18 1HB TRP 18 -4.557 -17.008 23.256 138 2HB TRP 18 2HB TRP 18 -6.158 -17.378 22.625 139 HD1 TRP 18 HD1 TRP 18 -6.368 -19.595 21.060 140 HE1 TRP 18 HE1 TRP 18 -4.952 -21.744 21.008 141 HE3 TRP 18 HE3 TRP 18 -2.237 -17.910 23.559 142 HZ2 TRP 18 HZ2 TRP 18 -2.420 -22.611 21.907 143 HZ3 TRP 18 HZ3 TRP 18 -0.364 -19.462 23.921 144 HH2 TRP 18 HH2 TRP 18 -0.455 -21.764 23.112 145 H GLN 19 H GLN 19 -7.143 -15.388 20.872 146 HA GLN 19 HA GLN 19 -7.942 -17.213 18.744 147 1HB GLN 19 1HB GLN 19 -9.348 -15.370 20.602 148 2HB GLN 19 2HB GLN 19 -10.095 -15.644 19.034 149 1HG GLN 19 1HG GLN 19 -9.615 -18.174 19.685 150 2HG GLN 19 2HG GLN 19 -9.718 -17.496 21.309 151 1HE2 GLN 19 1HE2 GLN 19 -11.431 -18.202 18.380 152 2HE2 GLN 19 2HE2 GLN 19 -13.020 -17.916 18.996 153 H GLN 20 H GLN 20 -8.056 -13.682 19.266 154 HA GLN 20 HA GLN 20 -8.383 -13.142 16.479 155 1HB GLN 20 1HB GLN 20 -8.489 -11.668 18.941 156 2HB GLN 20 2HB GLN 20 -7.470 -10.809 17.794 157 1HG GLN 20 1HG GLN 20 -9.190 -10.391 16.362 158 2HG GLN 20 2HG GLN 20 -10.083 -11.835 16.836 159 1HE2 GLN 20 1HE2 GLN 20 -11.504 -9.615 16.580 160 2HE2 GLN 20 2HE2 GLN 20 -11.952 -8.965 18.118 161 HA PRO 21 HA PRO 21 -4.269 -13.172 14.912 162 1HB PRO 21 1HB PRO 21 -4.906 -10.494 13.771 163 2HB PRO 21 2HB PRO 21 -4.282 -11.939 12.969 164 1HG PRO 21 1HG PRO 21 -6.826 -11.220 12.674 165 2HG PRO 21 2HG PRO 21 -6.375 -12.929 12.829 166 1HD PRO 21 1HD PRO 21 -7.614 -11.103 14.839 167 2HD PRO 21 2HD PRO 21 -7.885 -12.836 14.568 168 H GLU 22 H GLU 22 -2.290 -11.703 14.742 169 HA GLU 22 HA GLU 22 -2.121 -9.441 16.475 170 1HB GLU 22 1HB GLU 22 -2.077 -11.744 17.874 171 2HB GLU 22 2HB GLU 22 -0.369 -11.610 17.479 172 1HG GLU 22 1HG GLU 22 -0.959 -9.086 18.336 173 2HG GLU 22 2HG GLU 22 -1.990 -10.083 19.361 174 HE2 GLU 22 HE2 GLU 22 1.074 -11.752 20.453 175 H HIS 23 H HIS 23 -1.443 -10.180 13.759 176 HA HIS 23 HA HIS 23 1.335 -10.591 13.460 177 1HB HIS 23 1HB HIS 23 -0.935 -10.027 11.744 178 2HB HIS 23 2HB HIS 23 0.496 -9.146 11.219 179 HD1 HIS 23 HD1 HIS 23 0.683 -10.639 9.106 180 HD2 HIS 23 HD2 HIS 23 1.007 -12.706 12.697 181 HE1 HIS 23 HE1 HIS 23 1.567 -12.913 8.496 182 HE2 HIS 23 HE2 HIS 23 1.674 -14.174 10.673 183 H TYR 24 H TYR 24 3.023 -9.171 13.133 184 HA TYR 24 HA TYR 24 2.555 -6.453 14.118 185 1HB TYR 24 1HB TYR 24 4.422 -8.241 14.885 186 2HB TYR 24 2HB TYR 24 5.320 -7.403 13.624 187 HD1 TYR 24 HD1 TYR 24 6.588 -5.591 14.269 188 HD2 TYR 24 HD2 TYR 24 3.130 -6.574 16.544 189 HE1 TYR 24 HE1 TYR 24 7.117 -3.780 15.846 190 HE2 TYR 24 HE2 TYR 24 3.648 -4.765 18.125 191 HH TYR 24 HH TYR 24 6.584 -3.288 18.333 192 H ASP 25 H ASP 25 2.074 -5.077 12.525 193 HA ASP 25 HA ASP 25 3.543 -5.275 9.989 194 1HB ASP 25 1HB ASP 25 0.877 -5.089 10.346 195 2HB ASP 25 2HB ASP 25 1.280 -3.378 10.244 196 HD2 ASP 25 HD2 ASP 25 1.231 -5.484 6.970 197 H LEU 26 H LEU 26 4.765 -3.610 9.215 198 HA LEU 26 HA LEU 26 4.859 -1.116 10.749 199 1HB LEU 26 1HB LEU 26 6.637 -2.763 11.514 200 2HB LEU 26 2HB LEU 26 7.363 -2.573 9.929 201 HG LEU 26 HG LEU 26 7.262 -0.002 10.580 202 1HD1 LEU 26 1HD1 LEU 26 6.103 -0.504 12.728 203 2HD1 LEU 26 2HD1 LEU 26 7.611 0.394 12.912 204 3HD1 LEU 26 3HD1 LEU 26 7.564 -1.334 13.265 205 1HD2 LEU 26 1HD2 LEU 26 9.442 -1.421 11.974 206 2HD2 LEU 26 2HD2 LEU 26 9.508 -0.148 10.755 207 3HD2 LEU 26 3HD2 LEU 26 9.218 -1.817 10.270 208 H TYR 27 H TYR 27 4.448 0.442 9.338 209 HA TYR 27 HA TYR 27 5.287 0.118 6.550 210 1HB TYR 27 1HB TYR 27 3.086 1.525 7.918 211 2HB TYR 27 2HB TYR 27 3.811 2.412 6.580 212 HD1 TYR 27 HD1 TYR 27 3.255 1.888 4.363 213 HD2 TYR 27 HD2 TYR 27 2.241 -0.837 7.469 214 HE1 TYR 27 HE1 TYR 27 1.927 0.571 2.766 215 HE2 TYR 27 HE2 TYR 27 0.912 -2.162 5.880 216 HH TYR 27 HH TYR 27 0.714 -2.549 3.517 217 H ILE 28 H ILE 28 6.963 1.202 5.757 218 HA ILE 28 HA ILE 28 7.662 3.832 6.704 219 HB ILE 28 HB ILE 28 10.055 3.153 7.183 220 1HG1 ILE 28 1HG1 ILE 28 8.784 0.424 7.494 221 2HG1 ILE 28 2HG1 ILE 28 9.886 0.882 6.199 222 1HG2 ILE 28 1HG2 ILE 28 8.182 3.701 8.860 223 2HG2 ILE 28 2HG2 ILE 28 9.639 2.907 9.458 224 3HG2 ILE 28 3HG2 ILE 28 8.171 1.967 9.186 225 1HD1 ILE 28 1HD1 ILE 28 10.499 -0.142 8.757 226 2HD1 ILE 28 2HD1 ILE 28 11.119 1.508 8.675 227 3HD1 ILE 28 3HD1 ILE 28 11.604 0.322 7.463 228 HA PRO 29 HA PRO 29 8.958 4.393 2.528 229 1HB PRO 29 1HB PRO 29 11.294 5.846 3.670 230 2HB PRO 29 2HB PRO 29 10.120 6.377 2.461 231 1HG PRO 29 1HG PRO 29 10.003 7.294 4.955 232 2HG PRO 29 2HG PRO 29 8.523 6.918 4.054 233 1HD PRO 29 1HD PRO 29 9.863 5.374 6.230 234 2HD PRO 29 2HD PRO 29 8.133 5.583 5.893 235 H ALA 30 H ALA 30 11.266 4.473 1.312 236 HA ALA 30 HA ALA 30 12.967 2.310 2.317 237 1HB ALA 30 1HB ALA 30 11.219 1.381 0.766 238 2HB ALA 30 2HB ALA 30 12.888 1.072 0.290 239 3HB ALA 30 3HB ALA 30 11.960 2.333 -0.521 240 H ILE 31 H ILE 31 14.187 4.389 2.705 241 HA ILE 31 HA ILE 31 15.864 4.942 0.354 242 HB ILE 31 HB ILE 31 15.043 7.076 2.322 243 1HG1 ILE 31 1HG1 ILE 31 13.104 6.302 0.991 244 2HG1 ILE 31 2HG1 ILE 31 13.569 7.954 0.594 245 1HG2 ILE 31 1HG2 ILE 31 16.597 7.093 -0.252 246 2HG2 ILE 31 2HG2 ILE 31 17.131 7.603 1.350 247 3HG2 ILE 31 3HG2 ILE 31 15.930 8.555 0.477 248 1HD1 ILE 31 1HD1 ILE 31 14.794 5.860 -1.063 249 2HD1 ILE 31 2HD1 ILE 31 14.122 7.427 -1.516 250 3HD1 ILE 31 3HD1 ILE 31 13.049 6.055 -1.231 251 H THR 32 H THR 32 18.007 5.752 0.888 252 HA THR 32 HA THR 32 18.868 5.095 3.622 253 HB THR 32 HB THR 32 20.991 4.186 2.559 254 HG1 THR 32 HG1 THR 32 21.120 4.166 0.480 255 1HG2 THR 32 1HG2 THR 32 19.239 2.702 3.476 256 2HG2 THR 32 2HG2 THR 32 20.126 2.001 2.122 257 3HG2 THR 32 3HG2 THR 32 18.502 2.645 1.874 258 H TRP 33 H TRP 33 21.203 5.894 3.974 259 HA TRP 33 HA TRP 33 21.800 8.336 2.494 260 1HB TRP 33 1HB TRP 33 20.284 8.776 4.562 261 2HB TRP 33 2HB TRP 33 21.744 8.466 5.495 262 HD1 TRP 33 HD1 TRP 33 22.655 10.734 6.244 263 HE1 TRP 33 HE1 TRP 33 23.082 13.014 5.127 264 HE3 TRP 33 HE3 TRP 33 20.688 9.756 1.628 265 HZ2 TRP 33 HZ2 TRP 33 22.642 14.235 2.620 266 HZ3 TRP 33 HZ3 TRP 33 20.731 11.535 -0.073 267 HH2 TRP 33 HH2 TRP 33 21.687 13.727 0.415 268 H HIS 34 H HIS 34 23.909 9.317 3.330 269 HA HIS 34 HA HIS 34 26.153 9.105 3.638 270 1HB HIS 34 1HB HIS 34 25.152 6.970 5.517 271 2HB HIS 34 2HB HIS 34 26.865 7.337 5.346 272 HD1 HIS 34 HD1 HIS 34 23.635 8.887 6.516 273 HD2 HIS 34 HD2 HIS 34 27.727 9.586 6.688 274 HE1 HIS 34 HE1 HIS 34 23.926 10.775 8.152 275 HE2 HIS 34 HE2 HIS 34 26.416 11.119 8.307 276 H ALA 35 H ALA 35 26.291 8.474 1.388 277 HA ALA 35 HA ALA 35 26.365 5.715 0.644 278 1HB ALA 35 1HB ALA 35 27.609 6.900 -1.410 279 2HB ALA 35 2HB ALA 35 26.815 8.307 -0.702 280 3HB ALA 35 3HB ALA 35 25.857 6.915 -1.206 281 H ARG 36 H ARG 36 28.279 4.670 -0.314 282 HA ARG 36 HA ARG 36 30.518 4.871 1.477 283 1HB ARG 36 1HB ARG 36 30.100 3.141 -0.969 284 2HB ARG 36 2HB ARG 36 31.426 2.975 0.175 285 1HG ARG 36 1HG ARG 36 29.689 2.593 1.958 286 2HG ARG 36 2HG ARG 36 28.501 2.487 0.657 287 1HD ARG 36 1HD ARG 36 30.966 0.825 0.484 288 2HD ARG 36 2HD ARG 36 29.695 0.336 1.604 289 HE ARG 36 HE ARG 36 29.642 0.157 -1.252 290 1HH1 ARG 36 1HH1 ARG 36 27.656 0.500 1.598 291 2HH1 ARG 36 2HH1 ARG 36 26.248 -0.176 0.850 292 1HH2 ARG 36 1HH2 ARG 36 27.790 -0.733 -2.236 293 2HH2 ARG 36 2HH2 ARG 36 26.324 -0.878 -1.326 294 H PHE 37 H PHE 37 30.328 4.939 -2.088 295 HA PHE 37 HA PHE 37 32.909 6.050 -2.410 296 1HB PHE 37 1HB PHE 37 30.776 5.141 -4.103 297 2HB PHE 37 2HB PHE 37 31.348 6.701 -4.683 298 HD1 PHE 37 HD1 PHE 37 32.987 6.637 -6.273 299 HD2 PHE 37 HD2 PHE 37 32.820 3.528 -3.372 300 HE1 PHE 37 HE1 PHE 37 34.905 5.533 -7.351 301 HE2 PHE 37 HE2 PHE 37 34.738 2.419 -4.443 302 HZ PHE 37 HZ PHE 37 35.783 3.423 -6.435 303 H ALA 38 H ALA 38 33.463 8.154 -3.234 304 HA ALA 38 HA ALA 38 31.769 10.246 -2.078 305 1HB ALA 38 1HB ALA 38 33.656 11.523 -1.769 306 2HB ALA 38 2HB ALA 38 34.515 10.775 -3.115 307 3HB ALA 38 3HB ALA 38 34.316 9.897 -1.598 308 H TYR 39 H TYR 39 30.331 11.018 -3.493 309 HA TYR 39 HA TYR 39 30.575 10.966 -6.284 310 1HB TYR 39 1HB TYR 39 28.739 12.171 -4.321 311 2HB TYR 39 2HB TYR 39 28.821 13.016 -5.864 312 HD1 TYR 39 HD1 TYR 39 26.858 12.502 -6.992 313 HD2 TYR 39 HD2 TYR 39 29.024 9.371 -5.093 314 HE1 TYR 39 HE1 TYR 39 25.327 10.852 -7.980 315 HE2 TYR 39 HE2 TYR 39 27.499 7.712 -6.077 316 HH TYR 39 HH TYR 39 25.630 8.190 -8.583 317 H ASP 40 H ASP 40 30.504 12.966 -7.683 318 HA ASP 40 HA ASP 40 32.635 14.798 -6.815 319 1HB ASP 40 1HB ASP 40 32.834 13.284 -8.928 320 2HB ASP 40 2HB ASP 40 31.771 14.475 -9.672 321 HD2 ASP 40 HD2 ASP 40 34.530 16.365 -10.352 322 H LYS 41 H LYS 41 32.494 17.038 -7.483 323 HA LYS 41 HA LYS 41 31.438 19.049 -7.592 324 1HB LYS 41 1HB LYS 41 29.738 17.301 -9.307 325 2HB LYS 41 2HB LYS 41 29.115 18.886 -8.872 326 1HG LYS 41 1HG LYS 41 31.880 18.716 -9.937 327 2HG LYS 41 2HG LYS 41 30.534 18.502 -11.057 328 1HD LYS 41 1HD LYS 41 29.630 20.647 -10.474 329 2HD LYS 41 2HD LYS 41 30.815 20.845 -9.180 330 1HE LYS 41 1HE LYS 41 32.492 20.479 -11.218 331 2HE LYS 41 2HE LYS 41 31.127 21.140 -12.115 332 1HZ LYS 41 1HZ LYS 41 32.579 22.908 -11.449 333 2HZ LYS 41 2HZ LYS 41 32.528 22.419 -9.830 334 3HZ LYS 41 3HZ LYS 41 31.139 23.040 -10.570 335 H GLU 42 H GLU 42 30.955 19.568 -5.527 336 HA GLU 42 HA GLU 42 28.723 18.336 -4.157 337 1HB GLU 42 1HB GLU 42 30.921 20.204 -3.420 338 2HB GLU 42 2HB GLU 42 29.457 20.245 -2.446 339 1HG GLU 42 1HG GLU 42 29.899 18.281 -1.468 340 2HG GLU 42 2HG GLU 42 30.495 17.557 -2.961 341 HE2 GLU 42 HE2 GLU 42 33.088 18.802 -0.360 342 H LYS 43 H LYS 43 26.727 19.140 -3.962 343 HA LYS 43 HA LYS 43 26.255 21.906 -4.866 344 1HB LYS 43 1HB LYS 43 25.407 19.827 -6.270 345 2HB LYS 43 2HB LYS 43 24.110 19.842 -5.083 346 1HG LYS 43 1HG LYS 43 23.140 21.231 -6.553 347 2HG LYS 43 2HG LYS 43 24.154 22.445 -5.770 348 1HD LYS 43 1HD LYS 43 24.518 22.763 -8.063 349 2HD LYS 43 2HD LYS 43 25.919 21.842 -7.517 350 1HE LYS 43 1HE LYS 43 24.614 19.767 -8.227 351 2HE LYS 43 2HE LYS 43 23.533 20.877 -9.068 352 1HZ LYS 43 1HZ LYS 43 25.664 19.810 -10.206 353 2HZ LYS 43 2HZ LYS 43 26.383 21.202 -9.570 354 3HZ LYS 43 3HZ LYS 43 25.073 21.337 -10.633 355 H THR 44 H THR 44 25.036 19.275 -2.818 356 HA THR 44 HA THR 44 23.237 20.944 -1.364 357 HB THR 44 HB THR 44 23.384 18.912 0.281 358 HG1 THR 44 HG1 THR 44 24.422 17.195 -0.431 359 1HG2 THR 44 1HG2 THR 44 22.244 17.503 -1.741 360 2HG2 THR 44 2HG2 THR 44 22.071 19.163 -2.314 361 3HG2 THR 44 3HG2 THR 44 21.416 18.698 -0.743 362 H ASP 45 H ASP 45 26.579 20.005 -0.995 363 HA ASP 45 HA ASP 45 28.228 20.724 0.392 364 1HB ASP 45 1HB ASP 45 26.246 22.916 0.488 365 2HB ASP 45 2HB ASP 45 27.397 22.875 1.821 366 HD2 ASP 45 HD2 ASP 45 28.658 24.572 -1.288 367 H ARG 46 H ARG 46 25.505 21.740 2.427 368 HA ARG 46 HA ARG 46 26.520 19.993 4.544 369 1HB ARG 46 1HB ARG 46 24.668 22.366 4.527 370 2HB ARG 46 2HB ARG 46 24.798 21.313 5.928 371 1HG ARG 46 1HG ARG 46 26.418 22.700 6.580 372 2HG ARG 46 2HG ARG 46 27.416 21.853 5.397 373 1HD ARG 46 1HD ARG 46 27.746 23.854 4.464 374 2HD ARG 46 2HD ARG 46 26.091 23.722 3.871 375 HE ARG 46 HE ARG 46 25.454 25.327 5.378 376 1HH1 ARG 46 1HH1 ARG 46 28.634 24.165 6.229 377 2HH1 ARG 46 2HH1 ARG 46 28.893 25.381 7.434 378 1HH2 ARG 46 1HH2 ARG 46 25.793 26.927 6.963 379 2HH2 ARG 46 2HH2 ARG 46 27.280 26.949 7.851 380 H TYR 47 H TYR 47 25.231 18.496 5.616 381 HA TYR 47 HA TYR 47 22.646 17.879 4.348 382 1HB TYR 47 1HB TYR 47 23.189 15.452 4.727 383 2HB TYR 47 2HB TYR 47 24.184 16.245 3.510 384 HD1 TYR 47 HD1 TYR 47 24.209 14.228 6.414 385 HD2 TYR 47 HD2 TYR 47 26.475 17.175 4.346 386 HE1 TYR 47 HE1 TYR 47 26.231 13.500 7.606 387 HE2 TYR 47 HE2 TYR 47 28.506 16.454 5.531 388 HH TYR 47 HH TYR 47 28.683 13.570 7.287 389 H ASN 48 H ASN 48 20.989 17.569 5.705 390 HA ASN 48 HA ASN 48 21.601 17.339 8.580 391 1HB ASN 48 1HB ASN 48 20.328 19.425 7.433 392 2HB ASN 48 2HB ASN 48 18.949 18.376 7.752 393 1HD2 ASN 48 1HD2 ASN 48 20.915 20.730 9.002 394 2HD2 ASN 48 2HD2 ASN 48 20.544 20.538 10.678 395 H GLU 49 H GLU 49 19.997 16.192 9.879 396 HA GLU 49 HA GLU 49 18.967 13.875 8.424 397 1HB GLU 49 1HB GLU 49 19.647 14.399 11.300 398 2HB GLU 49 2HB GLU 49 18.616 13.044 10.861 399 1HG GLU 49 1HG GLU 49 21.143 13.298 9.365 400 2HG GLU 49 2HG GLU 49 21.278 12.877 11.070 401 HE2 GLU 49 HE2 GLU 49 20.346 10.068 8.610 402 H ARG 50 H ARG 50 16.843 13.095 8.733 403 HA ARG 50 HA ARG 50 14.924 15.219 9.350 404 1HB ARG 50 1HB ARG 50 14.513 12.569 7.952 405 2HB ARG 50 2HB ARG 50 13.292 13.816 8.157 406 1HG ARG 50 1HG ARG 50 14.181 15.151 6.546 407 2HG ARG 50 2HG ARG 50 15.828 14.583 6.829 408 1HD ARG 50 1HD ARG 50 15.609 12.822 5.415 409 2HD ARG 50 2HD ARG 50 13.900 12.598 5.786 410 HE ARG 50 HE ARG 50 13.932 14.923 4.405 411 1HH1 ARG 50 1HH1 ARG 50 15.225 11.745 3.763 412 2HH1 ARG 50 2HH1 ARG 50 15.070 11.892 2.046 413 1HH2 ARG 50 1HH2 ARG 50 13.727 15.117 2.144 414 2HH2 ARG 50 2HH2 ARG 50 14.219 13.806 1.126 415 HA PRO 51 HA PRO 51 13.487 13.605 13.180 416 1HB PRO 51 1HB PRO 51 10.751 13.706 12.003 417 2HB PRO 51 2HB PRO 51 11.352 14.399 13.514 418 1HG PRO 51 1HG PRO 51 10.902 15.948 11.398 419 2HG PRO 51 2HG PRO 51 12.303 16.229 12.450 420 1HD PRO 51 1HD PRO 51 12.185 14.992 9.737 421 2HD PRO 51 2HD PRO 51 13.438 16.025 10.455 422 H TRP 52 H TRP 52 12.250 11.802 14.139 423 HA TRP 52 HA TRP 52 12.320 9.469 12.363 424 1HB TRP 52 1HB TRP 52 12.528 9.787 15.350 425 2HB TRP 52 2HB TRP 52 12.199 8.221 14.613 426 HD1 TRP 52 HD1 TRP 52 14.986 9.826 16.036 427 HE1 TRP 52 HE1 TRP 52 17.219 9.146 14.952 428 HE3 TRP 52 HE3 TRP 52 13.196 7.786 11.703 429 HZ2 TRP 52 HZ2 TRP 52 18.104 7.908 12.574 430 HZ3 TRP 52 HZ3 TRP 52 14.802 6.877 10.077 431 HH2 TRP 52 HH2 TRP 52 17.206 6.937 10.505 432 H GLY 53 H GLY 53 10.622 7.954 12.330 433 1HA GLY 53 1HA GLY 53 8.205 8.347 13.804 434 2HA GLY 53 2HA GLY 53 8.055 8.930 12.154 435 H GLY 54 H GLY 54 6.639 7.432 11.375 436 1HA GLY 54 1HA GLY 54 6.987 5.331 10.006 437 2HA GLY 54 2HA GLY 54 7.491 4.608 11.525 438 H GLY 55 H GLY 55 5.637 3.184 10.533 439 1HA GLY 55 1HA GLY 55 3.187 3.986 11.960 440 2HA GLY 55 2HA GLY 55 3.087 3.387 10.311 441 H PHE 56 H PHE 56 1.857 2.285 12.687 442 HA PHE 56 HA PHE 56 2.875 -0.435 12.426 443 1HB PHE 56 1HB PHE 56 2.642 -0.714 14.951 444 2HB PHE 56 2HB PHE 56 4.044 0.189 14.387 445 HD1 PHE 56 HD1 PHE 56 1.058 0.262 16.382 446 HD2 PHE 56 HD2 PHE 56 4.008 2.690 14.510 447 HE1 PHE 56 HE1 PHE 56 0.414 2.149 17.824 448 HE2 PHE 56 HE2 PHE 56 3.370 4.581 15.948 449 HZ PHE 56 HZ PHE 56 1.572 4.312 17.609 450 H GLY 57 H GLY 57 1.316 -2.004 12.620 451 1HA GLY 57 1HA GLY 57 -1.243 -1.531 13.789 452 2HA GLY 57 2HA GLY 57 -1.315 -1.403 12.038 453 H LEU 58 H LEU 58 -2.820 -3.227 12.277 454 HA LEU 58 HA LEU 58 -1.347 -5.774 12.360 455 1HB LEU 58 1HB LEU 58 -3.965 -5.044 13.614 456 2HB LEU 58 2HB LEU 58 -3.673 -6.698 13.111 457 HG LEU 58 HG LEU 58 -1.511 -6.497 14.543 458 1HD1 LEU 58 1HD1 LEU 58 -2.128 -4.985 16.569 459 2HD1 LEU 58 2HD1 LEU 58 -3.096 -4.112 15.380 460 3HD1 LEU 58 3HD1 LEU 58 -1.357 -4.281 15.148 461 1HD2 LEU 58 1HD2 LEU 58 -3.687 -7.811 14.959 462 2HD2 LEU 58 2HD2 LEU 58 -4.066 -6.526 16.105 463 3HD2 LEU 58 3HD2 LEU 58 -2.615 -7.503 16.325 464 H SER 59 H SER 59 -2.903 -7.559 11.373 465 HA SER 59 HA SER 59 -4.508 -6.611 9.167 466 1HB SER 59 1HB SER 59 -1.741 -7.637 8.787 467 2HB SER 59 2HB SER 59 -2.968 -8.185 7.644 468 HG SER 59 HG SER 59 -2.604 -5.454 8.280 469 H ARG 60 H ARG 60 -5.303 -8.523 7.830 470 HA ARG 60 HA ARG 60 -5.476 -10.960 9.464 471 1HB ARG 60 1HB ARG 60 -7.795 -9.553 8.126 472 2HB ARG 60 2HB ARG 60 -7.883 -11.126 8.908 473 1HG ARG 60 1HG ARG 60 -7.804 -10.246 11.005 474 2HG ARG 60 2HG ARG 60 -6.849 -8.849 10.503 475 1HD ARG 60 1HD ARG 60 -8.698 -7.678 9.777 476 2HD ARG 60 2HD ARG 60 -9.650 -9.140 9.516 477 HE ARG 60 HE ARG 60 -9.216 -9.024 12.226 478 1HH1 ARG 60 1HH1 ARG 60 -10.689 -6.952 9.833 479 2HH1 ARG 60 2HH1 ARG 60 -11.817 -6.258 10.948 480 1HH2 ARG 60 1HH2 ARG 60 -10.700 -8.112 13.693 481 2HH2 ARG 60 2HH2 ARG 60 -11.823 -6.915 13.139 482 H TRP 61 H TRP 61 -5.987 -12.885 8.291 483 HA TRP 61 HA TRP 61 -5.739 -12.691 5.374 484 1HB TRP 61 1HB TRP 61 -4.176 -14.649 5.423 485 2HB TRP 61 2HB TRP 61 -3.501 -13.174 6.111 486 HD1 TRP 61 HD1 TRP 61 -4.531 -16.712 7.039 487 HE1 TRP 61 HE1 TRP 61 -3.734 -17.216 9.433 488 HE3 TRP 61 HE3 TRP 61 -3.017 -12.021 8.397 489 HZ2 TRP 61 HZ2 TRP 61 -2.611 -15.812 11.610 490 HZ3 TRP 61 HZ3 TRP 61 -2.093 -11.686 10.653 491 HH2 TRP 61 HH2 TRP 61 -1.896 -13.543 12.225 492 H ASP 62 H ASP 62 -7.093 -13.994 4.292 493 HA ASP 62 HA ASP 62 -8.465 -16.113 5.813 494 1HB ASP 62 1HB ASP 62 -9.721 -13.907 4.992 495 2HB ASP 62 2HB ASP 62 -9.835 -14.835 3.500 496 HD2 ASP 62 HD2 ASP 62 -12.183 -15.764 6.472 497 H GLU 63 H GLU 63 -8.777 -18.066 4.836 498 HA GLU 63 HA GLU 63 -6.976 -18.905 2.878 499 1HB GLU 63 1HB GLU 63 -8.200 -20.331 4.578 500 2HB GLU 63 2HB GLU 63 -9.594 -20.266 3.507 501 1HG GLU 63 1HG GLU 63 -7.847 -21.115 1.732 502 2HG GLU 63 2HG GLU 63 -7.007 -21.685 3.175 503 HE2 GLU 63 HE2 GLU 63 -9.023 -24.465 2.649 504 H LYS 64 H LYS 64 -9.981 -17.289 2.525 505 HA LYS 64 HA LYS 64 -10.386 -18.203 -0.204 506 1HB LYS 64 1HB LYS 64 -12.309 -17.846 1.333 507 2HB LYS 64 2HB LYS 64 -11.921 -16.131 1.372 508 1HG LYS 64 1HG LYS 64 -12.622 -15.783 -0.796 509 2HG LYS 64 2HG LYS 64 -12.406 -17.476 -1.247 510 1HD LYS 64 1HD LYS 64 -14.484 -18.019 -0.612 511 2HD LYS 64 2HD LYS 64 -14.361 -17.094 0.885 512 1HE LYS 64 1HE LYS 64 -15.286 -15.237 -0.027 513 2HE LYS 64 2HE LYS 64 -14.575 -15.532 -1.612 514 1HZ LYS 64 1HZ LYS 64 -16.234 -17.197 -2.044 515 2HZ LYS 64 2HZ LYS 64 -17.005 -15.760 -1.596 516 3HZ LYS 64 3HZ LYS 64 -16.878 -17.032 -0.489 517 H GLY 65 H GLY 65 -7.991 -16.595 0.580 518 1HA GLY 65 1HA GLY 65 -6.700 -14.977 -0.409 519 2HA GLY 65 2HA GLY 65 -7.891 -14.929 -1.699 520 H ASN 66 H ASN 66 -8.141 -14.142 1.763 521 HA ASN 66 HA ASN 66 -8.899 -11.404 0.977 522 1HB ASN 66 1HB ASN 66 -10.755 -13.017 1.857 523 2HB ASN 66 2HB ASN 66 -10.029 -12.707 3.431 524 1HD2 ASN 66 1HD2 ASN 66 -12.315 -11.704 1.267 525 2HD2 ASN 66 2HD2 ASN 66 -12.580 -10.104 1.862 526 H TRP 67 H TRP 67 -6.985 -10.405 1.423 527 HA TRP 67 HA TRP 67 -5.845 -10.762 4.105 528 1HB TRP 67 1HB TRP 67 -4.436 -11.014 1.965 529 2HB TRP 67 2HB TRP 67 -4.541 -9.261 1.844 530 HD1 TRP 67 HD1 TRP 67 -4.264 -8.846 5.110 531 HE1 TRP 67 HE1 TRP 67 -1.906 -9.048 6.120 532 HE3 TRP 67 HE3 TRP 67 -1.999 -11.491 1.367 533 HZ2 TRP 67 HZ2 TRP 67 0.585 -10.177 5.423 534 HZ3 TRP 67 HZ3 TRP 67 0.374 -12.092 1.616 535 HH2 TRP 67 HH2 TRP 67 1.638 -11.446 3.602 536 H HIS 68 H HIS 68 -7.174 -9.450 5.324 537 HA HIS 68 HA HIS 68 -7.919 -6.817 4.570 538 1HB HIS 68 1HB HIS 68 -8.907 -8.471 6.382 539 2HB HIS 68 2HB HIS 68 -7.787 -7.626 7.444 540 HD1 HIS 68 HD1 HIS 68 -10.046 -6.233 4.718 541 HD2 HIS 68 HD2 HIS 68 -9.352 -5.884 8.800 542 HE1 HIS 68 HE1 HIS 68 -11.570 -4.392 5.503 543 HE2 HIS 68 HE2 HIS 68 -11.072 -4.143 7.961 544 H GLY 69 H GLY 69 -7.088 -4.837 5.164 545 1HA GLY 69 1HA GLY 69 -4.471 -4.886 6.533 546 2HA GLY 69 2HA GLY 69 -4.733 -3.932 5.081 547 H LEU 70 H LEU 70 -4.508 -3.741 8.337 548 HA LEU 70 HA LEU 70 -5.858 -1.155 8.364 549 1HB LEU 70 1HB LEU 70 -6.615 -3.516 9.990 550 2HB LEU 70 2HB LEU 70 -6.569 -1.972 10.821 551 HG LEU 70 HG LEU 70 -8.063 -2.107 8.253 552 1HD1 LEU 70 1HD1 LEU 70 -9.256 -3.089 10.834 553 2HD1 LEU 70 2HD1 LEU 70 -8.686 -4.157 9.552 554 3HD1 LEU 70 3HD1 LEU 70 -10.012 -3.037 9.242 555 1HD2 LEU 70 1HD2 LEU 70 -7.888 0.014 9.365 556 2HD2 LEU 70 2HD2 LEU 70 -8.442 -0.688 10.885 557 3HD2 LEU 70 3HD2 LEU 70 -9.546 -0.566 9.515 558 H TYR 71 H TYR 71 -4.329 0.232 8.936 559 HA TYR 71 HA TYR 71 -2.783 -0.237 11.343 560 1HB TYR 71 1HB TYR 71 -0.634 0.355 10.143 561 2HB TYR 71 2HB TYR 71 -1.280 -1.246 9.795 562 HD1 TYR 71 HD1 TYR 71 -2.206 -1.765 7.605 563 HD2 TYR 71 HD2 TYR 71 -0.613 2.089 8.447 564 HE1 TYR 71 HE1 TYR 71 -2.158 -1.265 5.197 565 HE2 TYR 71 HE2 TYR 71 -0.561 2.600 6.042 566 HH TYR 71 HH TYR 71 -0.437 1.224 3.870 567 H ALA 72 H ALA 72 -1.477 1.712 11.930 568 HA ALA 72 HA ALA 72 -2.573 4.184 10.781 569 1HB ALA 72 1HB ALA 72 -3.872 3.767 12.765 570 2HB ALA 72 2HB ALA 72 -2.783 5.122 13.063 571 3HB ALA 72 3HB ALA 72 -2.407 3.528 13.719 572 H MET 73 H MET 73 -0.980 5.459 10.132 573 HA MET 73 HA MET 73 1.715 5.045 11.139 574 1HB MET 73 1HB MET 73 0.665 6.836 8.940 575 2HB MET 73 2HB MET 73 2.364 6.631 9.343 576 1HG MET 73 1HG MET 73 2.419 4.987 7.865 577 2HG MET 73 2HG MET 73 1.434 4.046 8.983 578 1HE MET 73 1HE MET 73 0.413 5.327 4.858 579 2HE MET 73 2HE MET 73 1.965 5.184 5.683 580 3HE MET 73 3HE MET 73 1.021 6.666 5.831 581 H ALA 74 H ALA 74 3.064 7.070 11.500 582 HA ALA 74 HA ALA 74 1.618 9.336 12.589 583 1HB ALA 74 1HB ALA 74 1.545 8.348 14.625 584 2HB ALA 74 2HB ALA 74 3.194 8.965 14.722 585 3HB ALA 74 3HB ALA 74 2.908 7.282 14.279 586 H PHE 75 H PHE 75 2.783 11.194 12.510 587 HA PHE 75 HA PHE 75 5.648 10.976 11.867 588 1HB PHE 75 1HB PHE 75 3.483 12.231 10.326 589 2HB PHE 75 2HB PHE 75 4.881 13.273 10.574 590 HD1 PHE 75 HD1 PHE 75 6.612 13.160 9.070 591 HD2 PHE 75 HD2 PHE 75 4.064 9.783 9.544 592 HE1 PHE 75 HE1 PHE 75 7.791 12.017 7.237 593 HE2 PHE 75 HE2 PHE 75 5.240 8.635 7.712 594 HZ PHE 75 HZ PHE 75 7.105 9.752 6.557 595 H LYS 76 H LYS 76 6.978 12.334 12.933 596 HA LYS 76 HA LYS 76 5.851 13.912 15.075 597 1HB LYS 76 1HB LYS 76 8.100 12.442 14.917 598 2HB LYS 76 2HB LYS 76 8.760 14.022 14.517 599 1HG LYS 76 1HG LYS 76 7.023 14.218 16.796 600 2HG LYS 76 2HG LYS 76 8.247 12.975 17.057 601 1HD LYS 76 1HD LYS 76 9.964 14.662 16.319 602 2HD LYS 76 2HD LYS 76 8.682 15.875 16.361 603 1HE LYS 76 1HE LYS 76 9.393 16.168 18.481 604 2HE LYS 76 2HE LYS 76 8.369 14.767 18.797 605 1HZ LYS 76 1HZ LYS 76 10.507 13.452 18.252 606 2HZ LYS 76 2HZ LYS 76 10.351 14.173 19.774 607 3HZ LYS 76 3HZ LYS 76 11.302 14.910 18.585 608 H ASP 77 H ASP 77 6.051 16.126 15.356 609 HA ASP 77 HA ASP 77 6.695 17.629 12.907 610 1HB ASP 77 1HB ASP 77 4.568 17.912 14.959 611 2HB ASP 77 2HB ASP 77 5.243 19.404 14.309 612 HD2 ASP 77 HD2 ASP 77 4.152 18.137 11.033 613 H SER 78 H SER 78 7.004 20.123 13.716 614 HA SER 78 HA SER 78 9.496 20.034 15.178 615 1HB SER 78 1HB SER 78 9.406 22.574 14.674 616 2HB SER 78 2HB SER 78 9.606 21.462 13.320 617 HG SER 78 HG SER 78 7.700 22.004 12.590 618 H TRP 79 H TRP 79 6.199 20.989 15.744 619 HA TRP 79 HA TRP 79 6.901 21.609 18.520 620 1HB TRP 79 1HB TRP 79 6.683 23.763 17.343 621 2HB TRP 79 2HB TRP 79 5.067 23.308 16.814 622 HD1 TRP 79 HD1 TRP 79 6.233 22.644 20.402 623 HE1 TRP 79 HE1 TRP 79 4.838 24.102 22.000 624 HE3 TRP 79 HE3 TRP 79 3.725 25.462 16.950 625 HZ2 TRP 79 HZ2 TRP 79 2.928 26.174 21.821 626 HZ3 TRP 79 HZ3 TRP 79 2.131 27.160 17.747 627 HH2 TRP 79 HH2 TRP 79 1.743 27.506 20.132 628 H ASN 80 H ASN 80 4.268 21.048 16.204 629 HA ASN 80 HA ASN 80 2.268 20.419 18.048 630 1HB ASN 80 1HB ASN 80 2.603 20.341 15.212 631 2HB ASN 80 2HB ASN 80 1.897 18.811 15.724 632 1HD2 ASN 80 1HD2 ASN 80 0.918 21.356 14.332 633 2HD2 ASN 80 2HD2 ASN 80 -0.559 21.715 15.152 634 H LYS 81 H LYS 81 1.310 17.910 17.404 635 HA LYS 81 HA LYS 81 3.311 16.183 18.696 636 1HB LYS 81 1HB LYS 81 0.311 15.819 18.619 637 2HB LYS 81 2HB LYS 81 1.461 14.871 19.554 638 1HG LYS 81 1HG LYS 81 2.027 16.873 20.859 639 2HG LYS 81 2HG LYS 81 0.829 17.790 19.944 640 1HD LYS 81 1HD LYS 81 -0.404 17.211 21.792 641 2HD LYS 81 2HD LYS 81 -0.774 15.858 20.721 642 1HE LYS 81 1HE LYS 81 0.399 14.374 21.970 643 2HE LYS 81 2HE LYS 81 1.612 15.565 22.438 644 1HZ LYS 81 1HZ LYS 81 -1.136 15.367 23.549 645 2HZ LYS 81 2HZ LYS 81 0.025 16.512 23.998 646 3HZ LYS 81 3HZ LYS 81 0.282 14.873 24.328 647 H TRP 82 H TRP 82 2.694 13.737 18.213 648 HA TRP 82 HA TRP 82 3.399 13.251 15.549 649 1HB TRP 82 1HB TRP 82 2.061 11.316 17.449 650 2HB TRP 82 2HB TRP 82 3.029 10.902 16.039 651 HD1 TRP 82 HD1 TRP 82 5.296 13.228 16.883 652 HE1 TRP 82 HE1 TRP 82 6.997 12.547 18.691 653 HE3 TRP 82 HE3 TRP 82 2.744 9.320 18.972 654 HZ2 TRP 82 HZ2 TRP 82 7.226 10.610 20.732 655 HZ3 TRP 82 HZ3 TRP 82 3.774 8.106 20.847 656 HH2 TRP 82 HH2 TRP 82 5.970 8.739 21.708 657 H GLU 83 H GLU 83 2.151 13.804 13.876 658 HA GLU 83 HA GLU 83 -0.650 14.009 13.933 659 1HB GLU 83 1HB GLU 83 -0.482 14.157 11.463 660 2HB GLU 83 2HB GLU 83 0.641 15.224 12.293 661 1HG GLU 83 1HG GLU 83 2.199 13.055 11.976 662 2HG GLU 83 2HG GLU 83 1.156 12.903 10.563 663 HE2 GLU 83 HE2 GLU 83 3.895 15.715 10.612 664 HA PRO 84 HA PRO 84 -1.552 9.646 13.493 665 1HB PRO 84 1HB PRO 84 -4.211 9.794 13.747 666 2HB PRO 84 2HB PRO 84 -3.140 10.081 15.124 667 1HG PRO 84 1HG PRO 84 -4.562 12.055 13.384 668 2HG PRO 84 2HG PRO 84 -4.344 12.067 15.143 669 1HD PRO 84 1HD PRO 84 -2.816 13.526 13.375 670 2HD PRO 84 2HD PRO 84 -2.282 13.039 14.996 671 H ILE 85 H ILE 85 -2.082 8.322 11.821 672 HA ILE 85 HA ILE 85 -3.626 9.398 9.578 673 HB ILE 85 HB ILE 85 -1.001 7.972 9.155 674 1HG1 ILE 85 1HG1 ILE 85 -0.614 10.473 8.160 675 2HG1 ILE 85 2HG1 ILE 85 -1.630 10.831 9.553 676 1HG2 ILE 85 1HG2 ILE 85 -2.310 9.600 7.058 677 2HG2 ILE 85 2HG2 ILE 85 -3.061 8.057 7.468 678 3HG2 ILE 85 3HG2 ILE 85 -1.384 8.105 6.923 679 1HD1 ILE 85 1HD1 ILE 85 0.524 11.000 10.382 680 2HD1 ILE 85 2HD1 ILE 85 1.091 9.598 9.473 681 3HD1 ILE 85 3HD1 ILE 85 0.031 9.377 10.866 682 H ALA 86 H ALA 86 -5.228 8.018 9.222 683 HA ALA 86 HA ALA 86 -4.856 5.187 9.893 684 1HB ALA 86 1HB ALA 86 -7.337 6.841 9.474 685 2HB ALA 86 2HB ALA 86 -6.745 6.143 10.981 686 3HB ALA 86 3HB ALA 86 -7.355 5.092 9.702 687 H GLY 87 H GLY 87 -5.386 3.535 8.441 688 1HA GLY 87 1HA GLY 87 -6.284 4.096 5.776 689 2HA GLY 87 2HA GLY 87 -4.561 3.757 5.840 690 H TYR 88 H TYR 88 -7.118 2.325 4.836 691 HA TYR 88 HA TYR 88 -6.171 -0.319 5.490 692 1HB TYR 88 1HB TYR 88 -8.374 -1.127 6.290 693 2HB TYR 88 2HB TYR 88 -7.648 0.048 7.381 694 HD1 TYR 88 HD1 TYR 88 -8.571 2.323 7.547 695 HD2 TYR 88 HD2 TYR 88 -10.419 -0.648 5.126 696 HE1 TYR 88 HE1 TYR 88 -10.618 3.684 7.450 697 HE2 TYR 88 HE2 TYR 88 -12.470 0.705 5.021 698 HH TYR 88 HH TYR 88 -13.581 2.463 6.255 699 H GLY 89 H GLY 89 -7.014 -1.949 4.102 700 1HA GLY 89 1HA GLY 89 -8.999 -1.418 2.140 701 2HA GLY 89 2HA GLY 89 -7.393 -1.201 1.460 702 H TRP 90 H TRP 90 -8.436 -3.006 0.104 703 HA TRP 90 HA TRP 90 -8.140 -5.627 1.375 704 1HB TRP 90 1HB TRP 90 -10.183 -5.041 -0.010 705 2HB TRP 90 2HB TRP 90 -9.128 -5.053 -1.420 706 HD1 TRP 90 HD1 TRP 90 -10.003 -7.516 1.463 707 HE1 TRP 90 HE1 TRP 90 -10.118 -9.885 0.462 708 HE3 TRP 90 HE3 TRP 90 -8.749 -6.418 -3.370 709 HZ2 TRP 90 HZ2 TRP 90 -9.729 -11.123 -2.045 710 HZ3 TRP 90 HZ3 TRP 90 -8.642 -8.251 -5.007 711 HH2 TRP 90 HH2 TRP 90 -9.121 -10.555 -4.356 712 H GLU 91 H GLU 91 -6.703 -7.174 0.651 713 HA GLU 91 HA GLU 91 -4.815 -6.387 -1.451 714 1HB GLU 91 1HB GLU 91 -4.073 -7.400 1.297 715 2HB GLU 91 2HB GLU 91 -2.947 -7.270 -0.046 716 1HG GLU 91 1HG GLU 91 -4.489 -4.927 1.025 717 2HG GLU 91 2HG GLU 91 -2.901 -5.396 1.630 718 HE2 GLU 91 HE2 GLU 91 -1.340 -4.315 -1.313 719 H SER 92 H SER 92 -4.217 -8.002 -2.789 720 HA SER 92 HA SER 92 -4.840 -10.765 -2.010 721 1HB SER 92 1HB SER 92 -5.838 -11.227 -4.171 722 2HB SER 92 2HB SER 92 -6.675 -9.858 -3.440 723 HG SER 92 HG SER 92 -5.658 -9.906 -5.801 724 H THR 93 H THR 93 -3.264 -12.179 -2.457 725 HA THR 93 HA THR 93 -1.119 -11.318 -4.286 726 HB THR 93 HB THR 93 0.402 -12.727 -2.861 727 HG1 THR 93 HG1 THR 93 -0.674 -13.980 -1.557 728 1HG2 THR 93 1HG2 THR 93 1.000 -10.901 -1.767 729 2HG2 THR 93 2HG2 THR 93 -0.488 -10.906 -0.819 730 3HG2 THR 93 3HG2 THR 93 -0.451 -10.126 -2.401 731 H TRP 94 H TRP 94 -0.173 -12.875 -5.616 732 HA TRP 94 HA TRP 94 -1.625 -15.434 -5.785 733 1HB TRP 94 1HB TRP 94 -0.815 -13.511 -7.941 734 2HB TRP 94 2HB TRP 94 -0.961 -15.226 -8.306 735 HD1 TRP 94 HD1 TRP 94 -3.576 -15.237 -6.065 736 HE1 TRP 94 HE1 TRP 94 -5.849 -14.568 -7.068 737 HE3 TRP 94 HE3 TRP 94 -1.937 -12.896 -10.306 738 HZ2 TRP 94 HZ2 TRP 94 -6.821 -13.226 -9.354 739 HZ3 TRP 94 HZ3 TRP 94 -3.603 -11.947 -11.848 740 HH2 TRP 94 HH2 TRP 94 -5.994 -12.110 -11.380 741 H ARG 95 H ARG 95 -0.408 -17.206 -6.754 742 HA ARG 95 HA ARG 95 2.478 -16.956 -6.215 743 1HB ARG 95 1HB ARG 95 2.470 -19.332 -5.651 744 2HB ARG 95 2HB ARG 95 1.320 -18.454 -4.652 745 1HG ARG 95 1HG ARG 95 0.000 -20.201 -5.195 746 2HG ARG 95 2HG ARG 95 -0.324 -19.203 -6.614 747 1HD ARG 95 1HD ARG 95 1.920 -20.542 -7.383 748 2HD ARG 95 2HD ARG 95 1.115 -21.748 -6.380 749 HE ARG 95 HE ARG 95 0.277 -20.794 -8.957 750 1HH1 ARG 95 1HH1 ARG 95 -0.781 -22.255 -5.968 751 2HH1 ARG 95 2HH1 ARG 95 -2.185 -22.980 -6.674 752 1HH2 ARG 95 1HH2 ARG 95 -1.570 -21.749 -9.887 753 2HH2 ARG 95 2HH2 ARG 95 -2.633 -22.693 -8.900 754 HA PRO 96 HA PRO 96 3.280 -18.022 -10.423 755 1HB PRO 96 1HB PRO 96 5.702 -19.215 -10.202 756 2HB PRO 96 2HB PRO 96 5.475 -17.473 -9.999 757 1HG PRO 96 1HG PRO 96 5.732 -19.606 -7.913 758 2HG PRO 96 2HG PRO 96 6.477 -17.998 -7.965 759 1HD PRO 96 1HD PRO 96 4.276 -18.546 -6.479 760 2HD PRO 96 2HD PRO 96 4.570 -16.953 -7.206 761 H LEU 97 H LEU 97 4.018 -20.624 -8.103 762 HA LEU 97 HA LEU 97 2.290 -22.493 -9.279 763 1HB LEU 97 1HB LEU 97 4.221 -22.240 -11.003 764 2HB LEU 97 2HB LEU 97 5.142 -23.201 -9.862 765 HG LEU 97 HG LEU 97 4.156 -24.552 -11.678 766 1HD1 LEU 97 1HD1 LEU 97 4.538 -25.352 -9.264 767 2HD1 LEU 97 2HD1 LEU 97 3.537 -26.340 -10.327 768 3HD1 LEU 97 3HD1 LEU 97 2.781 -25.296 -9.123 769 1HD2 LEU 97 1HD2 LEU 97 1.920 -24.674 -12.129 770 2HD2 LEU 97 2HD2 LEU 97 2.027 -22.993 -11.606 771 3HD2 LEU 97 3HD2 LEU 97 1.450 -24.229 -10.488 772 H ALA 98 H ALA 98 5.448 -22.228 -7.669 773 HA ALA 98 HA ALA 98 5.305 -24.569 -6.156 774 1HB ALA 98 1HB ALA 98 7.184 -23.831 -5.078 775 2HB ALA 98 2HB ALA 98 6.614 -22.163 -4.991 776 3HB ALA 98 3HB ALA 98 7.229 -22.807 -6.514 777 H ASP 99 H ASP 99 3.758 -21.489 -5.720 778 HA ASP 99 HA ASP 99 2.183 -20.757 -4.253 779 1HB ASP 99 1HB ASP 99 1.438 -23.261 -4.706 780 2HB ASP 99 2HB ASP 99 1.886 -23.457 -3.014 781 HD2 ASP 99 HD2 ASP 99 -0.652 -20.776 -2.488 782 H GLU 100 H GLU 100 5.027 -20.896 -3.520 783 HA GLU 100 HA GLU 100 4.882 -19.941 -0.906 784 1HB GLU 100 1HB GLU 100 5.093 -22.839 -1.112 785 2HB GLU 100 2HB GLU 100 6.438 -22.144 -0.216 786 1HG GLU 100 1HG GLU 100 5.114 -21.426 1.492 787 2HG GLU 100 2HG GLU 100 3.696 -21.237 0.463 788 HE2 GLU 100 HE2 GLU 100 3.618 -24.301 2.619 789 H ASN 101 H ASN 101 6.126 -18.490 -2.324 790 HA ASN 101 HA ASN 101 8.878 -18.604 -1.757 791 1HB ASN 101 1HB ASN 101 8.016 -19.783 -4.321 792 2HB ASN 101 2HB ASN 101 9.328 -18.616 -4.444 793 1HD2 ASN 101 1HD2 ASN 101 9.162 -21.594 -4.746 794 2HD2 ASN 101 2HD2 ASN 101 10.419 -22.202 -3.729 795 H PHE 102 H PHE 102 7.345 -17.504 -4.766 796 HA PHE 102 HA PHE 102 8.100 -14.761 -4.066 797 1HB PHE 102 1HB PHE 102 7.515 -16.167 -6.651 798 2HB PHE 102 2HB PHE 102 7.393 -14.413 -6.558 799 HD1 PHE 102 HD1 PHE 102 9.564 -13.491 -5.044 800 HD2 PHE 102 HD2 PHE 102 9.447 -16.837 -7.669 801 HE1 PHE 102 HE1 PHE 102 11.993 -13.304 -5.383 802 HE2 PHE 102 HE2 PHE 102 11.877 -16.657 -8.012 803 HZ PHE 102 HZ PHE 102 13.153 -14.890 -6.868 804 H HIS 103 H HIS 103 6.646 -13.135 -3.836 805 HA HIS 103 HA HIS 103 3.800 -13.881 -4.002 806 1HB HIS 103 1HB HIS 103 5.352 -12.308 -2.009 807 2HB HIS 103 2HB HIS 103 3.710 -11.776 -2.353 808 HD1 HIS 103 HD1 HIS 103 5.539 -14.910 -1.238 809 HD2 HIS 103 HD2 HIS 103 1.789 -13.138 -0.994 810 HE1 HIS 103 HE1 HIS 103 4.202 -16.376 0.306 811 HE2 HIS 103 HE2 HIS 103 1.911 -15.331 0.372 812 H LEU 104 H LEU 104 2.763 -12.953 -5.628 813 HA LEU 104 HA LEU 104 3.367 -10.161 -6.292 814 1HB LEU 104 1HB LEU 104 4.331 -12.138 -7.850 815 2HB LEU 104 2HB LEU 104 2.743 -11.946 -8.569 816 HG LEU 104 HG LEU 104 4.570 -9.593 -8.160 817 1HD1 LEU 104 1HD1 LEU 104 4.685 -11.722 -10.225 818 2HD1 LEU 104 2HD1 LEU 104 5.978 -10.751 -9.522 819 3HD1 LEU 104 3HD1 LEU 104 4.916 -10.052 -10.743 820 1HD2 LEU 104 1HD2 LEU 104 2.670 -9.835 -10.414 821 2HD2 LEU 104 2HD2 LEU 104 3.101 -8.433 -9.435 822 3HD2 LEU 104 3HD2 LEU 104 1.976 -9.636 -8.804 823 H GLY 105 H GLY 105 1.573 -8.986 -6.243 824 1HA GLY 105 1HA GLY 105 -0.855 -9.798 -7.487 825 2HA GLY 105 2HA GLY 105 -0.969 -9.962 -5.741 826 H LEU 106 H LEU 106 -2.750 -8.345 -6.344 827 HA LEU 106 HA LEU 106 -1.645 -5.648 -5.975 828 1HB LEU 106 1HB LEU 106 -4.100 -6.163 -7.632 829 2HB LEU 106 2HB LEU 106 -3.169 -4.683 -7.505 830 HG LEU 106 HG LEU 106 -1.860 -7.122 -8.629 831 1HD1 LEU 106 1HD1 LEU 106 -2.689 -6.698 -10.817 832 2HD1 LEU 106 2HD1 LEU 106 -3.545 -5.253 -10.279 833 3HD1 LEU 106 3HD1 LEU 106 -4.084 -6.846 -9.748 834 1HD2 LEU 106 1HD2 LEU 106 -1.534 -4.387 -9.716 835 2HD2 LEU 106 2HD2 LEU 106 -0.340 -5.661 -9.470 836 3HD2 LEU 106 3HD2 LEU 106 -0.894 -4.695 -8.102 837 H GLY 107 H GLY 107 -3.452 -4.097 -5.248 838 1HA GLY 107 1HA GLY 107 -5.739 -5.140 -3.937 839 2HA GLY 107 2HA GLY 107 -4.433 -4.927 -2.782 840 H PHE 108 H PHE 108 -7.056 -3.563 -3.064 841 HA PHE 108 HA PHE 108 -6.315 -0.839 -3.770 842 1HB PHE 108 1HB PHE 108 -8.670 -2.230 -3.978 843 2HB PHE 108 2HB PHE 108 -8.946 -1.270 -2.529 844 HD1 PHE 108 HD1 PHE 108 -7.067 -0.458 -5.637 845 HD2 PHE 108 HD2 PHE 108 -10.402 0.413 -3.141 846 HE1 PHE 108 HE1 PHE 108 -7.602 1.493 -7.040 847 HE2 PHE 108 HE2 PHE 108 -10.943 2.365 -4.538 848 HZ PHE 108 HZ PHE 108 -9.542 2.906 -6.490 849 H THR 109 H THR 109 -6.156 0.859 -2.349 850 HA THR 109 HA THR 109 -6.340 0.214 0.517 851 HB THR 109 HB THR 109 -4.291 2.183 -0.334 852 HG1 THR 109 HG1 THR 109 -4.069 -0.598 -0.794 853 1HG2 THR 109 1HG2 THR 109 -3.338 0.132 1.395 854 2HG2 THR 109 2HG2 THR 109 -4.883 0.734 1.998 855 3HG2 THR 109 3HG2 THR 109 -3.549 1.852 1.716 856 H ALA 110 H ALA 110 -7.417 1.648 1.733 857 HA ALA 110 HA ALA 110 -8.164 4.212 0.480 858 1HB ALA 110 1HB ALA 110 -10.312 3.967 1.125 859 2HB ALA 110 2HB ALA 110 -9.880 3.160 2.634 860 3HB ALA 110 3HB ALA 110 -9.895 2.253 1.122 861 H GLY 111 H GLY 111 -7.134 5.857 1.398 862 1HA GLY 111 1HA GLY 111 -6.298 5.644 4.200 863 2HA GLY 111 2HA GLY 111 -5.696 6.808 3.030 864 H VAL 112 H VAL 112 -7.104 6.850 5.806 865 HA VAL 112 HA VAL 112 -8.945 9.039 5.099 866 HB VAL 112 HB VAL 112 -10.245 8.395 7.185 867 1HG1 VAL 112 1HG1 VAL 112 -11.420 7.972 5.263 868 2HG1 VAL 112 2HG1 VAL 112 -11.279 6.340 5.916 869 3HG1 VAL 112 3HG1 VAL 112 -10.198 6.870 4.627 870 1HG2 VAL 112 1HG2 VAL 112 -8.208 6.701 7.679 871 2HG2 VAL 112 2HG2 VAL 112 -9.342 5.606 6.888 872 3HG2 VAL 112 3HG2 VAL 112 -9.835 6.494 8.329 873 H THR 113 H THR 113 -8.473 10.917 6.034 874 HA THR 113 HA THR 113 -6.611 10.905 8.315 875 HB THR 113 HB THR 113 -6.237 13.339 7.588 876 HG1 THR 113 HG1 THR 113 -7.363 12.362 5.180 877 1HG2 THR 113 1HG2 THR 113 -4.900 12.573 5.494 878 2HG2 THR 113 2HG2 THR 113 -5.326 10.956 6.058 879 3HG2 THR 113 3HG2 THR 113 -4.413 12.044 7.104 880 H ALA 114 H ALA 114 -7.508 11.319 10.214 881 HA ALA 114 HA ALA 114 -9.953 12.953 10.304 882 1HB ALA 114 1HB ALA 114 -8.984 10.642 11.881 883 2HB ALA 114 2HB ALA 114 -10.615 11.051 11.351 884 3HB ALA 114 3HB ALA 114 -9.908 11.873 12.743 885 H ARG 115 H ARG 115 -10.111 14.707 11.655 886 HA ARG 115 HA ARG 115 -7.632 15.529 13.021 887 1HB ARG 115 1HB ARG 115 -9.639 17.378 11.726 888 2HB ARG 115 2HB ARG 115 -8.094 17.825 12.436 889 1HG ARG 115 1HG ARG 115 -7.994 15.836 10.262 890 2HG ARG 115 2HG ARG 115 -8.474 17.472 9.808 891 1HD ARG 115 1HD ARG 115 -6.132 17.411 9.571 892 2HD ARG 115 2HD ARG 115 -6.432 18.270 11.081 893 HE ARG 115 HE ARG 115 -6.095 15.570 11.688 894 1HH1 ARG 115 1HH1 ARG 115 -4.218 18.223 10.418 895 2HH1 ARG 115 2HH1 ARG 115 -2.716 17.618 11.031 896 1HH2 ARG 115 1HH2 ARG 115 -4.121 14.771 12.495 897 2HH2 ARG 115 2HH2 ARG 115 -2.660 15.658 12.208 898 H ASP 116 H ASP 116 -8.344 17.598 14.478 899 HA ASP 116 HA ASP 116 -10.796 16.951 15.932 900 1HB ASP 116 1HB ASP 116 -8.490 15.916 16.860 901 2HB ASP 116 2HB ASP 116 -8.426 17.499 17.630 902 HD2 ASP 116 HD2 ASP 116 -11.671 16.536 19.115 903 H ASN 117 H ASN 117 -10.076 19.131 14.195 904 HA ASN 117 HA ASN 117 -9.377 21.430 15.711 905 1HB ASN 117 1HB ASN 117 -9.102 21.271 13.249 906 2HB ASN 117 2HB ASN 117 -10.855 21.286 13.074 907 1HD2 ASN 117 1HD2 ASN 117 -10.552 23.161 11.762 908 2HD2 ASN 117 2HD2 ASN 117 -10.327 24.708 12.496 909 H TRP 118 H TRP 118 -12.495 20.625 14.168 910 HA TRP 118 HA TRP 118 -13.844 21.889 16.460 911 1HB TRP 118 1HB TRP 118 -13.785 23.041 14.024 912 2HB TRP 118 2HB TRP 118 -15.194 22.005 13.823 913 HD1 TRP 118 HD1 TRP 118 -17.301 23.386 14.221 914 HE1 TRP 118 HE1 TRP 118 -18.039 25.196 15.894 915 HE3 TRP 118 HE3 TRP 118 -12.947 23.884 16.855 916 HZ2 TRP 118 HZ2 TRP 118 -16.925 26.645 18.046 917 HZ3 TRP 118 HZ3 TRP 118 -12.867 25.504 18.705 918 HH2 TRP 118 HH2 TRP 118 -14.815 26.855 19.287 919 H ASN 119 H ASN 119 -14.339 19.737 13.666 920 HA ASN 119 HA ASN 119 -15.928 17.983 15.402 921 1HB ASN 119 1HB ASN 119 -17.195 19.579 13.652 922 2HB ASN 119 2HB ASN 119 -16.820 18.233 12.581 923 1HD2 ASN 119 1HD2 ASN 119 -18.843 17.447 12.332 924 2HD2 ASN 119 2HD2 ASN 119 -19.784 16.774 13.616 925 H TYR 120 H TYR 120 -16.034 15.773 14.690 926 HA TYR 120 HA TYR 120 -13.563 14.888 13.538 927 1HB TYR 120 1HB TYR 120 -15.703 13.739 15.095 928 2HB TYR 120 2HB TYR 120 -15.317 12.692 13.733 929 HD1 TYR 120 HD1 TYR 120 -14.062 14.170 16.843 930 HD2 TYR 120 HD2 TYR 120 -13.163 11.591 13.580 931 HE1 TYR 120 HE1 TYR 120 -12.119 13.299 18.074 932 HE2 TYR 120 HE2 TYR 120 -11.219 10.712 14.803 933 HH TYR 120 HH TYR 120 -10.396 10.516 17.059 934 H ILE 121 H ILE 121 -13.344 15.255 11.402 935 HA ILE 121 HA ILE 121 -15.349 14.032 9.628 936 HB ILE 121 HB ILE 121 -13.909 16.604 8.990 937 1HG1 ILE 121 1HG1 ILE 121 -16.826 16.337 9.712 938 2HG1 ILE 121 2HG1 ILE 121 -15.594 16.728 10.909 939 1HG2 ILE 121 1HG2 ILE 121 -14.506 15.421 7.012 940 2HG2 ILE 121 2HG2 ILE 121 -15.674 16.727 7.214 941 3HG2 ILE 121 3HG2 ILE 121 -16.119 15.074 7.635 942 1HD1 ILE 121 1HD1 ILE 121 -15.656 18.383 8.463 943 2HD1 ILE 121 2HD1 ILE 121 -15.318 18.832 10.135 944 3HD1 ILE 121 3HD1 ILE 121 -16.982 18.579 9.610 945 HA PRO 122 HA PRO 122 -11.267 12.212 8.598 946 1HB PRO 122 1HB PRO 122 -12.286 9.886 7.635 947 2HB PRO 122 2HB PRO 122 -12.006 10.173 9.356 948 1HG PRO 122 1HG PRO 122 -14.552 10.367 7.792 949 2HG PRO 122 2HG PRO 122 -14.274 9.657 9.392 950 1HD PRO 122 1HD PRO 122 -15.340 12.121 9.064 951 2HD PRO 122 2HD PRO 122 -14.309 11.706 10.448 952 H LEU 123 H LEU 123 -10.225 12.167 6.660 953 HA LEU 123 HA LEU 123 -11.837 12.827 4.291 954 1HB LEU 123 1HB LEU 123 -9.739 14.188 5.333 955 2HB LEU 123 2HB LEU 123 -8.905 13.155 4.188 956 HG LEU 123 HG LEU 123 -11.281 14.661 3.216 957 1HD1 LEU 123 1HD1 LEU 123 -9.496 16.080 4.641 958 2HD1 LEU 123 2HD1 LEU 123 -10.353 16.715 3.237 959 3HD1 LEU 123 3HD1 LEU 123 -8.711 16.095 3.062 960 1HD2 LEU 123 1HD2 LEU 123 -8.602 13.963 2.016 961 2HD2 LEU 123 2HD2 LEU 123 -9.937 14.751 1.175 962 3HD2 LEU 123 3HD2 LEU 123 -10.116 13.096 1.754 963 HA PRO 124 HA PRO 124 -10.452 8.539 3.382 964 1HB PRO 124 1HB PRO 124 -12.610 7.896 1.876 965 2HB PRO 124 2HB PRO 124 -12.615 7.797 3.640 966 1HG PRO 124 1HG PRO 124 -13.696 9.948 1.862 967 2HG PRO 124 2HG PRO 124 -14.424 9.221 3.306 968 1HD PRO 124 1HD PRO 124 -13.158 11.618 3.353 969 2HD PRO 124 2HD PRO 124 -13.167 10.512 4.742 970 H VAL 125 H VAL 125 -9.668 7.626 1.463 971 HA VAL 125 HA VAL 125 -10.010 9.022 -1.051 972 HB VAL 125 HB VAL 125 -7.496 9.177 -1.377 973 1HG1 VAL 125 1HG1 VAL 125 -8.268 11.065 0.786 974 2HG1 VAL 125 2HG1 VAL 125 -9.245 11.033 -0.681 975 3HG1 VAL 125 3HG1 VAL 125 -7.520 11.381 -0.781 976 1HG2 VAL 125 1HG2 VAL 125 -7.213 7.778 0.836 977 2HG2 VAL 125 2HG2 VAL 125 -7.252 9.375 1.585 978 3HG2 VAL 125 3HG2 VAL 125 -6.027 8.998 0.372 979 H LEU 126 H LEU 126 -9.968 7.620 -2.695 980 HA LEU 126 HA LEU 126 -9.068 4.887 -2.140 981 1HB LEU 126 1HB LEU 126 -10.733 5.908 -4.441 982 2HB LEU 126 2HB LEU 126 -10.414 4.228 -4.053 983 HG LEU 126 HG LEU 126 -11.728 5.880 -1.960 984 1HD1 LEU 126 1HD1 LEU 126 -12.875 5.329 -4.626 985 2HD1 LEU 126 2HD1 LEU 126 -13.235 6.617 -3.477 986 3HD1 LEU 126 3HD1 LEU 126 -13.909 5.005 -3.235 987 1HD2 LEU 126 1HD2 LEU 126 -11.049 3.395 -1.861 988 2HD2 LEU 126 2HD2 LEU 126 -12.457 3.127 -2.889 989 3HD2 LEU 126 3HD2 LEU 126 -12.655 3.855 -1.295 990 H LEU 127 H LEU 127 -7.258 4.117 -3.001 991 HA LEU 127 HA LEU 127 -6.297 5.126 -5.555 992 1HB LEU 127 1HB LEU 127 -4.718 5.304 -2.993 993 2HB LEU 127 2HB LEU 127 -3.980 5.397 -4.581 994 HG LEU 127 HG LEU 127 -5.769 7.335 -4.905 995 1HD1 LEU 127 1HD1 LEU 127 -6.574 8.331 -3.047 996 2HD1 LEU 127 2HD1 LEU 127 -5.159 7.920 -2.078 997 3HD1 LEU 127 3HD1 LEU 127 -6.407 6.709 -2.376 998 1HD2 LEU 127 1HD2 LEU 127 -4.046 8.908 -4.398 999 2HD2 LEU 127 2HD2 LEU 127 -3.276 7.457 -5.039 1000 3HD2 LEU 127 3HD2 LEU 127 -3.254 7.774 -3.304 1001 HA PRO 128 HA PRO 128 -5.231 0.849 -5.968 1002 1HB PRO 128 1HB PRO 128 -3.577 0.980 -8.097 1003 2HB PRO 128 2HB PRO 128 -5.319 1.244 -8.239 1004 1HG PRO 128 1HG PRO 128 -3.104 3.254 -8.095 1005 2HG PRO 128 2HG PRO 128 -4.528 3.232 -9.152 1006 1HD PRO 128 1HD PRO 128 -4.372 4.748 -6.897 1007 2HD PRO 128 2HD PRO 128 -5.901 4.105 -7.528 1008 H LEU 129 H LEU 129 -3.611 -0.605 -5.456 1009 HA LEU 129 HA LEU 129 -0.890 0.308 -5.071 1010 1HB LEU 129 1HB LEU 129 -2.112 0.903 -2.967 1011 2HB LEU 129 2HB LEU 129 -2.442 -0.804 -2.735 1012 HG LEU 129 HG LEU 129 0.403 -0.081 -3.103 1013 1HD1 LEU 129 1HD1 LEU 129 0.290 0.346 -0.479 1014 2HD1 LEU 129 2HD1 LEU 129 -1.281 1.015 -0.926 1015 3HD1 LEU 129 3HD1 LEU 129 0.192 1.655 -1.657 1016 1HD2 LEU 129 1HD2 LEU 129 -0.128 -2.359 -2.685 1017 2HD2 LEU 129 2HD2 LEU 129 -1.163 -1.936 -1.321 1018 3HD2 LEU 129 3HD2 LEU 129 0.584 -1.717 -1.205 1019 H ALA 130 H ALA 130 0.614 -1.389 -4.866 1020 HA ALA 130 HA ALA 130 -0.486 -4.085 -5.323 1021 1HB ALA 130 1HB ALA 130 1.438 -4.512 -6.827 1022 2HB ALA 130 2HB ALA 130 1.879 -2.810 -6.690 1023 3HB ALA 130 3HB ALA 130 0.344 -3.266 -7.427 1024 H SER 131 H SER 131 1.132 -5.830 -4.865 1025 HA SER 131 HA SER 131 3.109 -5.097 -2.836 1026 1HB SER 131 1HB SER 131 0.659 -6.720 -2.399 1027 2HB SER 131 2HB SER 131 2.143 -7.308 -1.651 1028 HG SER 131 HG SER 131 2.307 -5.433 -0.503 1029 H VAL 132 H VAL 132 4.975 -5.975 -3.401 1030 HA VAL 132 HA VAL 132 5.037 -8.724 -4.391 1031 HB VAL 132 HB VAL 132 6.633 -8.121 -6.188 1032 1HG1 VAL 132 1HG1 VAL 132 4.147 -6.551 -6.705 1033 2HG1 VAL 132 2HG1 VAL 132 4.039 -8.284 -6.400 1034 3HG1 VAL 132 3HG1 VAL 132 4.998 -7.685 -7.753 1035 1HG2 VAL 132 1HG2 VAL 132 6.423 -5.620 -6.897 1036 2HG2 VAL 132 2HG2 VAL 132 7.581 -6.087 -5.651 1037 3HG2 VAL 132 3HG2 VAL 132 6.036 -5.369 -5.196 1038 H GLY 133 H GLY 133 6.506 -9.829 -3.280 1039 1HA GLY 133 1HA GLY 133 9.162 -9.068 -2.884 1040 2HA GLY 133 2HA GLY 133 8.270 -8.611 -1.440 1041 H TYR 134 H TYR 134 9.773 -10.151 -0.422 1042 HA TYR 134 HA TYR 134 8.613 -12.846 -0.463 1043 1HB TYR 134 1HB TYR 134 10.673 -12.921 -1.807 1044 2HB TYR 134 2HB TYR 134 11.581 -12.252 -0.456 1045 HD1 TYR 134 HD1 TYR 134 10.517 -15.225 -2.058 1046 HD2 TYR 134 HD2 TYR 134 11.522 -13.625 1.755 1047 HE1 TYR 134 HE1 TYR 134 10.927 -17.499 -1.219 1048 HE2 TYR 134 HE2 TYR 134 11.936 -15.895 2.604 1049 HH TYR 134 HH TYR 134 12.319 -18.551 0.646 1050 H GLY 135 H GLY 135 8.440 -13.820 1.510 1051 1HA GLY 135 1HA GLY 135 8.329 -13.974 3.799 1052 2HA GLY 135 2HA GLY 135 9.925 -13.239 3.801 1053 HA PRO 136 HA PRO 136 7.371 -10.208 6.064 1054 1HB PRO 136 1HB PRO 136 9.479 -9.003 7.296 1055 2HB PRO 136 2HB PRO 136 8.717 -10.478 7.902 1056 1HG PRO 136 1HG PRO 136 11.218 -10.162 6.288 1057 2HG PRO 136 2HG PRO 136 10.910 -11.216 7.680 1058 1HD PRO 136 1HD PRO 136 10.869 -12.132 5.140 1059 2HD PRO 136 2HD PRO 136 9.810 -12.793 6.401 1060 H VAL 137 H VAL 137 10.101 -9.785 3.936 1061 HA VAL 137 HA VAL 137 9.726 -6.926 3.690 1062 HB VAL 137 HB VAL 137 11.452 -8.714 1.976 1063 1HG1 VAL 137 1HG1 VAL 137 12.729 -6.376 2.025 1064 2HG1 VAL 137 2HG1 VAL 137 11.084 -5.789 2.266 1065 3HG1 VAL 137 3HG1 VAL 137 11.478 -6.747 0.839 1066 1HG2 VAL 137 1HG2 VAL 137 12.417 -9.135 4.002 1067 2HG2 VAL 137 2HG2 VAL 137 11.868 -7.613 4.706 1068 3HG2 VAL 137 3HG2 VAL 137 13.240 -7.628 3.597 1069 H THR 138 H THR 138 8.035 -6.191 2.582 1070 HA THR 138 HA THR 138 7.433 -7.428 -0.017 1071 HB THR 138 HB THR 138 5.390 -6.434 1.981 1072 HG1 THR 138 HG1 THR 138 6.119 -8.416 2.636 1073 1HG2 THR 138 1HG2 THR 138 5.182 -6.895 -0.836 1074 2HG2 THR 138 2HG2 THR 138 3.963 -6.319 0.302 1075 3HG2 THR 138 3HG2 THR 138 4.184 -8.051 0.048 1076 H PHE 139 H PHE 139 7.906 -5.981 -1.526 1077 HA PHE 139 HA PHE 139 7.828 -3.144 -0.950 1078 1HB PHE 139 1HB PHE 139 9.572 -4.472 -2.390 1079 2HB PHE 139 2HB PHE 139 8.385 -4.261 -3.674 1080 HD1 PHE 139 HD1 PHE 139 10.336 -2.349 -1.152 1081 HD2 PHE 139 HD2 PHE 139 8.362 -2.312 -4.922 1082 HE1 PHE 139 HE1 PHE 139 11.214 -0.092 -1.584 1083 HE2 PHE 139 HE2 PHE 139 9.237 -0.055 -5.362 1084 HZ PHE 139 HZ PHE 139 10.665 1.058 -3.692 1085 H GLN 140 H GLN 140 6.130 -1.887 -1.310 1086 HA GLN 140 HA GLN 140 4.047 -2.838 -3.162 1087 1HB GLN 140 1HB GLN 140 2.467 -1.483 -1.877 1088 2HB GLN 140 2HB GLN 140 3.294 -2.638 -0.840 1089 1HG GLN 140 1HG GLN 140 4.561 -0.994 0.197 1090 2HG GLN 140 2HG GLN 140 4.294 0.167 -1.103 1091 1HE2 GLN 140 1HE2 GLN 140 3.145 1.801 -0.380 1092 2HE2 GLN 140 2HE2 GLN 140 1.767 1.701 0.657 1093 H MET 141 H MET 141 2.891 -1.207 -4.394 1094 HA MET 141 HA MET 141 4.462 1.232 -4.884 1095 1HB MET 141 1HB MET 141 3.143 -0.385 -7.065 1096 2HB MET 141 2HB MET 141 4.225 0.988 -7.255 1097 1HG MET 141 1HG MET 141 6.031 -0.379 -6.223 1098 2HG MET 141 2HG MET 141 4.931 -1.757 -6.250 1099 1HE MET 141 1HE MET 141 8.061 -1.109 -8.426 1100 2HE MET 141 2HE MET 141 7.459 -2.718 -8.819 1101 3HE MET 141 3HE MET 141 7.435 -2.151 -7.149 1102 H THR 142 H THR 142 3.283 3.008 -4.665 1103 HA THR 142 HA THR 142 0.361 2.785 -4.773 1104 HB THR 142 HB THR 142 1.853 5.196 -3.782 1105 HG1 THR 142 HG1 THR 142 2.742 3.483 -2.644 1106 1HG2 THR 142 1HG2 THR 142 -0.607 5.301 -3.996 1107 2HG2 THR 142 2HG2 THR 142 -0.030 5.508 -2.342 1108 3HG2 THR 142 3HG2 THR 142 -0.727 3.969 -2.847 1109 H TYR 143 H TYR 143 -0.794 3.716 -6.341 1110 HA TYR 143 HA TYR 143 0.636 5.413 -8.268 1111 1HB TYR 143 1HB TYR 143 -0.973 3.156 -8.648 1112 2HB TYR 143 2HB TYR 143 -1.975 4.512 -9.154 1113 HD1 TYR 143 HD1 TYR 143 0.013 6.341 -10.311 1114 HD2 TYR 143 HD2 TYR 143 -0.314 2.110 -10.617 1115 HE1 TYR 143 HE1 TYR 143 1.196 6.411 -12.467 1116 HE2 TYR 143 HE2 TYR 143 0.868 2.169 -12.773 1117 HH TYR 143 HH TYR 143 2.372 3.589 -14.011 1118 H ILE 144 H ILE 144 0.015 7.461 -8.635 1119 HA ILE 144 HA ILE 144 -2.135 8.530 -6.980 1120 HB ILE 144 HB ILE 144 0.049 9.663 -6.942 1121 1HG1 ILE 144 1HG1 ILE 144 -0.925 11.992 -7.744 1122 2HG1 ILE 144 2HG1 ILE 144 -2.416 11.066 -7.880 1123 1HG2 ILE 144 1HG2 ILE 144 0.790 10.958 -8.897 1124 2HG2 ILE 144 2HG2 ILE 144 -0.514 10.245 -9.845 1125 3HG2 ILE 144 3HG2 ILE 144 0.773 9.222 -9.209 1126 1HD1 ILE 144 1HD1 ILE 144 -1.151 12.153 -5.554 1127 2HD1 ILE 144 2HD1 ILE 144 -1.346 10.409 -5.386 1128 3HD1 ILE 144 3HD1 ILE 144 -2.747 11.424 -5.726 1129 HA PRO 145 HA PRO 145 -4.884 8.686 -10.480 1130 1HB PRO 145 1HB PRO 145 -6.805 10.262 -9.410 1131 2HB PRO 145 2HB PRO 145 -6.592 8.572 -8.940 1132 1HG PRO 145 1HG PRO 145 -5.664 11.056 -7.549 1133 2HG PRO 145 2HG PRO 145 -6.412 9.601 -6.862 1134 1HD PRO 145 1HD PRO 145 -3.737 10.052 -6.789 1135 2HD PRO 145 2HD PRO 145 -4.433 8.423 -6.882 1136 H GLY 146 H GLY 146 -5.541 10.119 -12.113 1137 1HA GLY 146 1HA GLY 146 -4.102 12.683 -12.080 1138 2HA GLY 146 2HA GLY 146 -4.632 11.825 -13.520 1139 H THR 147 H THR 147 -5.448 14.135 -11.112 1140 HA THR 147 HA THR 147 -8.236 14.253 -11.455 1141 HB THR 147 HB THR 147 -6.785 16.785 -10.925 1142 HG1 THR 147 HG1 THR 147 -5.549 15.967 -9.465 1143 1HG2 THR 147 1HG2 THR 147 -8.706 17.271 -9.960 1144 2HG2 THR 147 2HG2 THR 147 -8.421 15.996 -8.776 1145 3HG2 THR 147 3HG2 THR 147 -9.301 15.639 -10.262 1146 H TYR 148 H TYR 148 -5.613 16.039 -13.048 1147 HA TYR 148 HA TYR 148 -7.185 16.313 -15.441 1148 1HB TYR 148 1HB TYR 148 -7.622 18.287 -13.634 1149 2HB TYR 148 2HB TYR 148 -6.248 18.958 -14.507 1150 HD1 TYR 148 HD1 TYR 148 -9.717 18.852 -14.400 1151 HD2 TYR 148 HD2 TYR 148 -6.497 18.704 -17.177 1152 HE1 TYR 148 HE1 TYR 148 -11.230 19.606 -16.185 1153 HE2 TYR 148 HE2 TYR 148 -8.002 19.459 -18.971 1154 HH TYR 148 HH TYR 148 -10.897 20.869 -18.470 1155 H ASN 149 H ASN 149 -4.490 18.121 -13.957 1156 HA ASN 149 HA ASN 149 -2.849 17.399 -16.291 1157 1HB ASN 149 1HB ASN 149 -3.235 19.822 -15.963 1158 2HB ASN 149 2HB ASN 149 -2.494 19.710 -14.368 1159 1HD2 ASN 149 1HD2 ASN 149 -1.898 19.285 -17.810 1160 2HD2 ASN 149 2HD2 ASN 149 -0.201 19.600 -17.741 1161 H ASN 150 H ASN 150 -0.785 16.591 -16.021 1162 HA ASN 150 HA ASN 150 0.882 15.392 -15.045 1163 1HB ASN 150 1HB ASN 150 0.701 17.706 -13.600 1164 2HB ASN 150 2HB ASN 150 0.512 16.492 -12.338 1165 1HD2 ASN 150 1HD2 ASN 150 2.615 17.746 -14.820 1166 2HD2 ASN 150 2HD2 ASN 150 4.066 17.016 -14.235 1167 H GLY 151 H GLY 151 1.302 14.204 -12.672 1168 1HA GLY 151 1HA GLY 151 0.232 12.853 -10.993 1169 2HA GLY 151 2HA GLY 151 -1.186 12.764 -12.029 1170 H ASN 152 H ASN 152 2.069 12.327 -13.234 1171 HA ASN 152 HA ASN 152 1.418 9.503 -13.757 1172 1HB ASN 152 1HB ASN 152 1.762 11.040 -15.735 1173 2HB ASN 152 2HB ASN 152 3.443 11.192 -15.233 1174 1HD2 ASN 152 1HD2 ASN 152 1.103 8.542 -15.592 1175 2HD2 ASN 152 2HD2 ASN 152 2.150 7.518 -16.508 1176 H VAL 153 H VAL 153 2.543 10.482 -11.275 1177 HA VAL 153 HA VAL 153 5.251 9.327 -11.395 1178 HB VAL 153 HB VAL 153 5.593 10.446 -9.172 1179 1HG1 VAL 153 1HG1 VAL 153 5.628 12.807 -10.232 1180 2HG1 VAL 153 2HG1 VAL 153 5.099 11.977 -11.696 1181 3HG1 VAL 153 3HG1 VAL 153 6.629 11.539 -10.936 1182 1HG2 VAL 153 1HG2 VAL 153 4.081 12.222 -8.506 1183 2HG2 VAL 153 2HG2 VAL 153 3.212 10.689 -8.593 1184 3HG2 VAL 153 3HG2 VAL 153 3.035 11.877 -9.884 1185 H TYR 154 H TYR 154 5.826 7.675 -10.029 1186 HA TYR 154 HA TYR 154 3.620 6.432 -8.524 1187 1HB TYR 154 1HB TYR 154 4.955 4.300 -8.828 1188 2HB TYR 154 2HB TYR 154 4.249 4.970 -10.294 1189 HD1 TYR 154 HD1 TYR 154 7.338 4.200 -8.524 1190 HD2 TYR 154 HD2 TYR 154 5.680 6.046 -11.981 1191 HE1 TYR 154 HE1 TYR 154 9.556 4.195 -9.584 1192 HE2 TYR 154 HE2 TYR 154 7.893 6.045 -13.051 1193 HH TYR 154 HH TYR 154 10.628 5.836 -11.621 1194 H PHE 155 H PHE 155 3.877 5.997 -6.408 1195 HA PHE 155 HA PHE 155 6.447 6.750 -5.195 1196 1HB PHE 155 1HB PHE 155 3.622 6.761 -4.153 1197 2HB PHE 155 2HB PHE 155 5.003 6.838 -3.063 1198 HD1 PHE 155 HD1 PHE 155 4.075 8.467 -6.295 1199 HD2 PHE 155 HD2 PHE 155 5.404 8.947 -2.281 1200 HE1 PHE 155 HE1 PHE 155 4.197 10.901 -6.630 1201 HE2 PHE 155 HE2 PHE 155 5.528 11.382 -2.608 1202 HZ PHE 155 HZ PHE 155 4.924 12.362 -4.785 1203 H ALA 156 H ALA 156 7.621 5.311 -4.071 1204 HA ALA 156 HA ALA 156 6.566 2.578 -3.870 1205 1HB ALA 156 1HB ALA 156 8.644 1.795 -4.273 1206 2HB ALA 156 2HB ALA 156 9.422 3.065 -3.328 1207 3HB ALA 156 3HB ALA 156 8.881 3.396 -4.973 1208 H TRP 157 H TRP 157 7.102 1.314 -1.958 1209 HA TRP 157 HA TRP 157 7.868 2.731 0.442 1210 1HB TRP 157 1HB TRP 157 5.077 1.617 0.102 1211 2HB TRP 157 2HB TRP 157 5.775 2.067 1.655 1212 HD1 TRP 157 HD1 TRP 157 4.477 3.616 -1.602 1213 HE1 TRP 157 HE1 TRP 157 4.014 6.115 -1.191 1214 HE3 TRP 157 HE3 TRP 157 6.427 4.040 3.105 1215 HZ2 TRP 157 HZ2 TRP 157 4.422 8.014 0.857 1216 HZ3 TRP 157 HZ3 TRP 157 6.351 6.233 4.219 1217 HH2 TRP 157 HH2 TRP 157 5.370 8.177 3.117 1218 H MET 158 H MET 158 8.135 1.300 2.286 1219 HA MET 158 HA MET 158 8.608 -1.481 1.439 1220 1HB MET 158 1HB MET 158 10.595 -0.037 2.107 1221 2HB MET 158 2HB MET 158 9.953 -0.075 3.744 1222 1HG MET 158 1HG MET 158 10.585 -2.206 4.090 1223 2HG MET 158 2HG MET 158 10.263 -2.688 2.426 1224 1HE MET 158 1HE MET 158 12.984 -2.657 4.874 1225 2HE MET 158 2HE MET 158 14.170 -3.200 3.687 1226 3HE MET 158 3HE MET 158 12.587 -3.974 3.770 1227 H ARG 159 H ARG 159 7.643 -3.103 2.507 1228 HA ARG 159 HA ARG 159 6.133 -2.423 4.945 1229 1HB ARG 159 1HB ARG 159 4.727 -2.909 2.936 1230 2HB ARG 159 2HB ARG 159 5.414 -4.527 2.900 1231 1HG ARG 159 1HG ARG 159 4.254 -5.216 4.744 1232 2HG ARG 159 2HG ARG 159 4.142 -3.588 5.417 1233 1HD ARG 159 1HD ARG 159 1.988 -3.834 4.725 1234 2HD ARG 159 2HD ARG 159 2.684 -3.196 3.237 1235 HE ARG 159 HE ARG 159 2.324 -5.225 2.234 1236 1HH1 ARG 159 1HH1 ARG 159 1.978 -5.586 5.688 1237 2HH1 ARG 159 2HH1 ARG 159 1.360 -7.201 5.583 1238 1HH2 ARG 159 1HH2 ARG 159 1.511 -7.349 2.095 1239 2HH2 ARG 159 2HH2 ARG 159 1.096 -8.201 3.543 1240 H PHE 160 H PHE 160 7.016 -3.313 6.681 1241 HA PHE 160 HA PHE 160 8.365 -5.916 6.408 1242 1HB PHE 160 1HB PHE 160 9.522 -3.691 7.301 1243 2HB PHE 160 2HB PHE 160 8.781 -4.205 8.814 1244 HD1 PHE 160 HD1 PHE 160 11.596 -4.506 6.721 1245 HD2 PHE 160 HD2 PHE 160 9.216 -6.680 9.499 1246 HE1 PHE 160 HE1 PHE 160 13.464 -6.062 7.099 1247 HE2 PHE 160 HE2 PHE 160 11.082 -8.238 9.884 1248 HZ PHE 160 HZ PHE 160 13.209 -7.930 8.684 1249 H GLN 161 H GLN 161 7.762 -7.613 7.657 1250 HA GLN 161 HA GLN 161 5.574 -7.155 9.578 1251 1HB GLN 161 1HB GLN 161 5.923 -9.614 7.859 1252 2HB GLN 161 2HB GLN 161 4.569 -9.244 8.918 1253 1HG GLN 161 1HG GLN 161 4.129 -7.238 7.461 1254 2HG GLN 161 2HG GLN 161 5.314 -7.902 6.337 1255 1HE2 GLN 161 1HE2 GLN 161 2.662 -9.258 8.272 1256 2HE2 GLN 161 2HE2 GLN 161 1.891 -10.071 6.958 1257 H PHE 162 H PHE 162 6.076 -7.699 11.586 1258 HA PHE 162 HA PHE 162 8.231 -9.659 12.018 1259 1HB PHE 162 1HB PHE 162 8.629 -7.314 12.830 1260 2HB PHE 162 2HB PHE 162 7.287 -7.533 13.948 1261 HD1 PHE 162 HD1 PHE 162 7.650 -8.462 16.042 1262 HD2 PHE 162 HD2 PHE 162 10.578 -8.970 12.994 1263 HE1 PHE 162 HE1 PHE 162 9.184 -9.460 17.687 1264 HE2 PHE 162 HE2 PHE 162 12.117 -9.969 14.634 1265 HZ PHE 162 HZ PHE 162 11.420 -10.216 16.984 1266 H LEU 163 H LEU 163 8.021 -11.152 13.760 1267 HA LEU 163 HA LEU 163 5.273 -11.540 14.735 1268 1HB LEU 163 1HB LEU 163 7.037 -13.456 13.288 1269 2HB LEU 163 2HB LEU 163 5.997 -14.082 14.554 1270 HG LEU 163 HG LEU 163 4.922 -12.431 12.279 1271 1HD1 LEU 163 1HD1 LEU 163 4.265 -14.588 11.247 1272 2HD1 LEU 163 2HD1 LEU 163 5.288 -15.417 12.421 1273 3HD1 LEU 163 3HD1 LEU 163 6.007 -14.309 11.253 1274 1HD2 LEU 163 1HD2 LEU 163 3.732 -14.246 14.356 1275 2HD2 LEU 163 2HD2 LEU 163 2.858 -13.774 12.898 1276 3HD2 LEU 163 3HD2 LEU 163 3.378 -12.546 14.051 1277 H GLU 164 H GLU 164 5.071 -12.235 16.821 1278 HA GLU 164 HA GLU 164 7.403 -11.985 18.492 1279 1HB GLU 164 1HB GLU 164 5.798 -12.339 20.353 1280 2HB GLU 164 2HB GLU 164 5.327 -11.034 19.273 1281 1HG GLU 164 1HG GLU 164 4.163 -13.470 18.354 1282 2HG GLU 164 2HG GLU 164 3.819 -13.273 20.072 1283 HE2 GLU 164 HE2 GLU 164 2.212 -10.127 19.246 1284 H HIS 165 H HIS 165 8.716 -13.592 19.015 1285 HA HIS 165 HA HIS 165 7.719 -16.201 19.688 1286 1HB HIS 165 1HB HIS 165 8.322 -15.817 17.015 1287 2HB HIS 165 2HB HIS 165 9.797 -16.532 17.655 1288 HD1 HIS 165 HD1 HIS 165 6.074 -17.251 17.504 1289 HD2 HIS 165 HD2 HIS 165 9.696 -19.237 17.952 1290 HE1 HIS 165 HE1 HIS 165 5.507 -19.700 17.456 1291 HE2 HIS 165 HE2 HIS 165 7.703 -20.880 17.826 1292 H HIS 166 H HIS 166 9.139 -14.173 21.070 1293 HA HIS 166 HA HIS 166 11.149 -15.689 22.307 1294 1HB HIS 166 1HB HIS 166 12.294 -15.074 20.115 1295 2HB HIS 166 2HB HIS 166 12.291 -13.411 20.691 1296 HD1 HIS 166 HD1 HIS 166 13.994 -12.780 22.482 1297 HD2 HIS 166 HD2 HIS 166 14.034 -16.820 21.513 1298 HE1 HIS 166 HE1 HIS 166 16.064 -13.711 23.566 1299 HE2 HIS 166 HE2 HIS 166 16.116 -16.137 22.886 1300 H HIS 167 H HIS 167 10.009 -12.436 21.536 1301 HA HIS 167 HA HIS 167 11.008 -11.091 23.768 1302 1HB HIS 167 1HB HIS 167 9.239 -10.523 21.617 1303 2HB HIS 167 2HB HIS 167 8.434 -10.032 23.103 1304 HD1 HIS 167 HD1 HIS 167 9.179 -7.876 24.138 1305 HD2 HIS 167 HD2 HIS 167 11.804 -9.226 21.214 1306 HE1 HIS 167 HE1 HIS 167 10.829 -6.008 23.802 1307 HE2 HIS 167 HE2 HIS 167 12.447 -6.874 22.075 1308 H HIS 168 H HIS 168 10.789 -12.026 25.733 1309 HA HIS 168 HA HIS 168 8.105 -12.841 26.598 1310 1HB HIS 168 1HB HIS 168 10.493 -14.163 26.833 1311 2HB HIS 168 2HB HIS 168 10.356 -13.389 28.408 1312 HD1 HIS 168 HD1 HIS 168 9.394 -14.977 30.026 1313 HD2 HIS 168 HD2 HIS 168 7.688 -15.404 26.261 1314 HE1 HIS 168 HE1 HIS 168 7.663 -16.783 30.273 1315 HE2 HIS 168 HE2 HIS 168 6.703 -17.083 27.962 1316 H HIS 169 H HIS 169 8.170 -12.617 29.253 1317 HA HIS 169 HA HIS 169 9.130 -10.012 30.063 1318 1HB HIS 169 1HB HIS 169 6.285 -10.532 29.390 1319 2HB HIS 169 2HB HIS 169 6.594 -9.615 30.861 1320 HD1 HIS 169 HD1 HIS 169 6.295 -9.242 27.267 1321 HD2 HIS 169 HD2 HIS 169 8.210 -7.210 30.344 1322 HE1 HIS 169 HE1 HIS 169 6.839 -6.970 26.336 1323 HE2 HIS 169 HE2 HIS 169 7.919 -5.729 28.244 1324 H HIS 170 H HIS 170 9.508 -12.782 30.871 1325 HA HIS 170 HA HIS 170 8.222 -12.871 33.499 1326 1HB HIS 170 1HB HIS 170 8.458 -14.870 31.793 1327 2HB HIS 170 2HB HIS 170 10.055 -15.020 32.517 1328 HD1 HIS 170 HD1 HIS 170 9.942 -15.178 35.284 1329 HD2 HIS 170 HD2 HIS 170 6.549 -16.235 33.132 1330 HE1 HIS 170 HE1 HIS 170 8.554 -16.564 36.857 1331 HE2 HIS 170 HE2 HIS 170 6.551 -17.271 35.502 Start of MODEL 7 1 1H MET 1 1H MET 1 -5.010 -17.822 46.540 2 2H MET 1 2H MET 1 -4.747 -19.342 45.787 3 H MET 1 H MET 1 -5.536 -18.712 47.322 4 3H MET 1 3H MET 1 -5.738 -19.234 47.184 5 HA MET 1 HA MET 1 -6.290 -18.046 44.547 6 1HB MET 1 1HB MET 1 -7.529 -20.377 46.029 7 2HB MET 1 2HB MET 1 -8.087 -19.738 44.489 8 1HG MET 1 1HG MET 1 -5.599 -20.225 43.776 9 2HG MET 1 2HG MET 1 -5.689 -21.371 45.111 10 1HE MET 1 1HE MET 1 -5.327 -22.717 41.925 11 2HE MET 1 2HE MET 1 -6.137 -24.077 42.703 12 3HE MET 1 3HE MET 1 -5.019 -23.072 43.624 13 H ASN 2 H ASN 2 -6.999 -16.049 45.151 14 HA ASN 2 HA ASN 2 -9.331 -15.987 46.941 15 1HB ASN 2 1HB ASN 2 -6.978 -15.020 47.779 16 2HB ASN 2 2HB ASN 2 -7.549 -13.607 46.897 17 1HD2 ASN 2 1HD2 ASN 2 -8.971 -12.300 47.842 18 2HD2 ASN 2 2HD2 ASN 2 -9.772 -12.616 49.339 19 H ALA 3 H ALA 3 -10.665 -14.004 46.639 20 HA ALA 3 HA ALA 3 -11.466 -13.714 43.987 21 1HB ALA 3 1HB ALA 3 -12.674 -11.638 44.894 22 2HB ALA 3 2HB ALA 3 -12.004 -12.104 46.457 23 3HB ALA 3 3HB ALA 3 -13.076 -13.206 45.593 24 H ASP 4 H ASP 4 -8.936 -12.136 45.715 25 HA ASP 4 HA ASP 4 -8.780 -9.824 44.022 26 1HB ASP 4 1HB ASP 4 -7.834 -10.339 46.492 27 2HB ASP 4 2HB ASP 4 -6.388 -10.686 45.549 28 HD2 ASP 4 HD2 ASP 4 -6.984 -7.035 46.352 29 H GLU 5 H GLU 5 -6.675 -12.666 44.469 30 HA GLU 5 HA GLU 5 -5.118 -12.122 42.153 31 1HB GLU 5 1HB GLU 5 -5.344 -14.352 44.110 32 2HB GLU 5 2HB GLU 5 -4.603 -14.715 42.557 33 1HG GLU 5 1HG GLU 5 -3.149 -12.632 43.034 34 2HG GLU 5 2HG GLU 5 -3.678 -12.852 44.701 35 HE2 GLU 5 HE2 GLU 5 -1.681 -15.648 45.114 36 H TRP 6 H TRP 6 -8.098 -13.799 42.727 37 HA TRP 6 HA TRP 6 -8.131 -15.455 40.446 38 1HB TRP 6 1HB TRP 6 -10.131 -14.453 42.391 39 2HB TRP 6 2HB TRP 6 -10.760 -14.988 40.837 40 HD1 TRP 6 HD1 TRP 6 -10.477 -16.346 44.069 41 HE1 TRP 6 HE1 TRP 6 -10.124 -18.895 44.078 42 HE3 TRP 6 HE3 TRP 6 -9.017 -16.980 39.210 43 HZ2 TRP 6 HZ2 TRP 6 -9.334 -20.909 42.264 44 HZ3 TRP 6 HZ3 TRP 6 -8.481 -19.250 38.427 45 HH2 TRP 6 HH2 TRP 6 -8.636 -21.173 39.924 46 H MET 7 H MET 7 -9.263 -12.146 40.992 47 HA MET 7 HA MET 7 -10.461 -11.766 38.474 48 1HB MET 7 1HB MET 7 -10.863 -10.285 40.394 49 2HB MET 7 2HB MET 7 -9.200 -9.718 40.307 50 1HG MET 7 1HG MET 7 -10.007 -9.198 37.795 51 2HG MET 7 2HG MET 7 -11.532 -9.017 38.659 52 1HE MET 7 1HE MET 7 -10.093 -5.393 37.948 53 2HE MET 7 2HE MET 7 -11.661 -6.187 38.113 54 3HE MET 7 3HE MET 7 -10.446 -6.851 37.020 55 H THR 8 H THR 8 -7.192 -11.027 39.648 56 HA THR 8 HA THR 8 -6.226 -9.832 37.307 57 HB THR 8 HB THR 8 -3.982 -10.353 38.187 58 HG1 THR 8 HG1 THR 8 -3.779 -11.604 40.029 59 1HG2 THR 8 1HG2 THR 8 -5.217 -8.461 39.168 60 2HG2 THR 8 2HG2 THR 8 -4.097 -9.222 40.299 61 3HG2 THR 8 3HG2 THR 8 -5.827 -9.544 40.419 62 H THR 9 H THR 9 -6.032 -13.212 38.398 63 HA THR 9 HA THR 9 -4.620 -14.208 36.194 64 HB THR 9 HB THR 9 -6.682 -15.815 37.680 65 HG1 THR 9 HG1 THR 9 -5.698 -15.099 39.408 66 1HG2 THR 9 1HG2 THR 9 -3.924 -16.521 36.711 67 2HG2 THR 9 2HG2 THR 9 -5.438 -16.967 35.922 68 3HG2 THR 9 3HG2 THR 9 -5.058 -17.599 37.525 69 H PHE 10 H PHE 10 -8.090 -13.823 36.750 70 HA PHE 10 HA PHE 10 -8.885 -15.103 34.332 71 1HB PHE 10 1HB PHE 10 -10.211 -13.546 36.479 72 2HB PHE 10 2HB PHE 10 -11.017 -13.555 34.913 73 HD1 PHE 10 HD1 PHE 10 -12.785 -15.011 34.931 74 HD2 PHE 10 HD2 PHE 10 -9.165 -16.146 36.860 75 HE1 PHE 10 HE1 PHE 10 -13.752 -17.215 35.441 76 HE2 PHE 10 HE2 PHE 10 -10.126 -18.352 37.373 77 HZ PHE 10 HZ PHE 10 -12.422 -18.889 36.664 78 H ARG 11 H ARG 11 -8.075 -11.816 35.229 79 HA ARG 11 HA ARG 11 -9.126 -10.488 32.989 80 1HB ARG 11 1HB ARG 11 -7.944 -9.661 35.258 81 2HB ARG 11 2HB ARG 11 -6.591 -9.478 34.149 82 1HG ARG 11 1HG ARG 11 -7.662 -7.853 32.900 83 2HG ARG 11 2HG ARG 11 -9.265 -8.343 33.452 84 1HD ARG 11 1HD ARG 11 -9.146 -6.665 34.913 85 2HD ARG 11 2HD ARG 11 -7.946 -7.624 35.779 86 HE ARG 11 HE ARG 11 -7.476 -5.274 34.181 87 1HH1 ARG 11 1HH1 ARG 11 -6.052 -8.155 35.545 88 2HH1 ARG 11 2HH1 ARG 11 -4.440 -7.525 35.510 89 1HH2 ARG 11 1HH2 ARG 11 -5.356 -4.445 34.135 90 2HH2 ARG 11 2HH2 ARG 11 -4.044 -5.419 34.711 91 H GLU 12 H GLU 12 -6.098 -12.189 33.504 92 HA GLU 12 HA GLU 12 -4.769 -11.302 31.178 93 1HB GLU 12 1HB GLU 12 -3.670 -12.427 33.113 94 2HB GLU 12 2HB GLU 12 -4.418 -13.938 32.615 95 1HG GLU 12 1HG GLU 12 -3.225 -13.771 30.459 96 2HG GLU 12 2HG GLU 12 -2.414 -12.324 31.056 97 HE2 GLU 12 HE2 GLU 12 -1.428 -15.681 32.943 98 H ASN 13 H ASN 13 -7.115 -13.824 31.761 99 HA ASN 13 HA ASN 13 -6.738 -15.127 29.234 100 1HB ASN 13 1HB ASN 13 -7.719 -16.119 31.412 101 2HB ASN 13 2HB ASN 13 -9.222 -15.348 30.917 102 1HD2 ASN 13 1HD2 ASN 13 -6.732 -17.609 29.868 103 2HD2 ASN 13 2HD2 ASN 13 -7.764 -18.555 28.856 104 H ILE 14 H ILE 14 -9.318 -13.070 30.582 105 HA ILE 14 HA ILE 14 -10.844 -12.877 28.244 106 HB ILE 14 HB ILE 14 -11.688 -12.211 30.454 107 1HG1 ILE 14 1HG1 ILE 14 -11.911 -9.669 28.950 108 2HG1 ILE 14 2HG1 ILE 14 -12.341 -11.128 28.063 109 1HG2 ILE 14 1HG2 ILE 14 -9.531 -11.082 31.126 110 2HG2 ILE 14 2HG2 ILE 14 -11.017 -10.241 31.569 111 3HG2 ILE 14 3HG2 ILE 14 -10.071 -9.691 30.185 112 1HD1 ILE 14 1HD1 ILE 14 -13.836 -9.686 30.034 113 2HD1 ILE 14 2HD1 ILE 14 -13.601 -11.357 30.544 114 3HD1 ILE 14 3HD1 ILE 14 -14.345 -11.008 28.984 115 H ALA 15 H ALA 15 -8.066 -11.037 29.356 116 HA ALA 15 HA ALA 15 -8.254 -8.998 27.369 117 1HB ALA 15 1HB ALA 15 -6.269 -8.153 28.235 118 2HB ALA 15 2HB ALA 15 -5.702 -9.743 28.749 119 3HB ALA 15 3HB ALA 15 -7.009 -8.946 29.626 120 H GLN 16 H GLN 16 -6.607 -12.096 27.597 121 HA GLN 16 HA GLN 16 -4.993 -11.764 25.283 122 1HB GLN 16 1HB GLN 16 -4.637 -13.432 27.161 123 2HB GLN 16 2HB GLN 16 -5.929 -14.386 26.445 124 1HG GLN 16 1HG GLN 16 -4.684 -14.891 24.555 125 2HG GLN 16 2HG GLN 16 -3.570 -13.548 24.812 126 1HE2 GLN 16 1HE2 GLN 16 -4.281 -16.829 25.484 127 2HE2 GLN 16 2HE2 GLN 16 -2.878 -17.176 26.430 128 H THR 17 H THR 17 -8.208 -13.074 25.858 129 HA THR 17 HA THR 17 -8.540 -14.107 23.214 130 HB THR 17 HB THR 17 -10.913 -14.362 23.860 131 HG1 THR 17 HG1 THR 17 -10.149 -13.174 26.316 132 1HG2 THR 17 1HG2 THR 17 -10.657 -15.881 25.717 133 2HG2 THR 17 2HG2 THR 17 -9.065 -15.211 26.076 134 3HG2 THR 17 3HG2 THR 17 -9.332 -16.091 24.572 135 H TRP 18 H TRP 18 -9.386 -11.107 24.854 136 HA TRP 18 HA TRP 18 -11.046 -10.009 22.884 137 1HB TRP 18 1HB TRP 18 -9.617 -9.053 25.249 138 2HB TRP 18 2HB TRP 18 -9.761 -7.826 23.994 139 HD1 TRP 18 HD1 TRP 18 -12.205 -10.380 25.629 140 HE1 TRP 18 HE1 TRP 18 -14.432 -9.163 26.059 141 HE3 TRP 18 HE3 TRP 18 -10.996 -5.782 23.747 142 HZ2 TRP 18 HZ2 TRP 18 -15.531 -6.595 25.654 143 HZ3 TRP 18 HZ3 TRP 18 -12.692 -4.001 23.805 144 HH2 TRP 18 HH2 TRP 18 -14.913 -4.400 24.739 145 H GLN 19 H GLN 19 -7.563 -9.484 23.436 146 HA GLN 19 HA GLN 19 -7.233 -7.993 21.022 147 1HB GLN 19 1HB GLN 19 -5.164 -9.298 22.800 148 2HB GLN 19 2HB GLN 19 -4.824 -8.137 21.525 149 1HG GLN 19 1HG GLN 19 -6.329 -6.533 22.787 150 2HG GLN 19 2HG GLN 19 -6.248 -7.679 24.124 151 1HE2 GLN 19 1HE2 GLN 19 -4.657 -5.187 22.420 152 2HE2 GLN 19 2HE2 GLN 19 -3.211 -5.147 23.364 153 H GLN 20 H GLN 20 -5.712 -11.078 21.974 154 HA GLN 20 HA GLN 20 -5.112 -12.912 20.772 155 1HB GLN 20 1HB GLN 20 -7.723 -12.517 20.208 156 2HB GLN 20 2HB GLN 20 -7.046 -12.383 18.591 157 1HG GLN 20 1HG GLN 20 -6.462 -14.702 20.405 158 2HG GLN 20 2HG GLN 20 -7.838 -14.670 19.302 159 1HE2 GLN 20 1HE2 GLN 20 -7.530 -15.403 17.322 160 2HE2 GLN 20 2HE2 GLN 20 -5.998 -15.651 16.561 161 HA PRO 21 HA PRO 21 -2.564 -10.396 17.882 162 1HB PRO 21 1HB PRO 21 -0.232 -11.654 18.467 163 2HB PRO 21 2HB PRO 21 -0.871 -10.321 19.436 164 1HG PRO 21 1HG PRO 21 -1.026 -13.270 19.933 165 2HG PRO 21 2HG PRO 21 -0.673 -11.960 21.075 166 1HD PRO 21 1HD PRO 21 -3.114 -13.118 20.897 167 2HD PRO 21 2HD PRO 21 -2.898 -11.409 21.325 168 H GLU 22 H GLU 22 -1.702 -10.942 15.882 169 HA GLU 22 HA GLU 22 -1.627 -13.777 15.152 170 1HB GLU 22 1HB GLU 22 -3.416 -11.687 14.018 171 2HB GLU 22 2HB GLU 22 -2.713 -12.846 12.899 172 1HG GLU 22 1HG GLU 22 -3.679 -14.682 14.143 173 2HG GLU 22 2HG GLU 22 -4.318 -13.560 15.344 174 HE2 GLU 22 HE2 GLU 22 -6.259 -14.032 11.948 175 H HIS 23 H HIS 23 -1.417 -10.712 13.352 176 HA HIS 23 HA HIS 23 1.384 -11.357 12.724 177 1HB HIS 23 1HB HIS 23 -0.612 -10.251 10.739 178 2HB HIS 23 2HB HIS 23 1.065 -10.681 10.419 179 HD1 HIS 23 HD1 HIS 23 1.623 -13.297 10.557 180 HD2 HIS 23 HD2 HIS 23 -2.408 -12.294 10.450 181 HE1 HIS 23 HE1 HIS 23 0.420 -15.418 9.943 182 HE2 HIS 23 HE2 HIS 23 -2.010 -14.766 9.799 183 H TYR 24 H TYR 24 2.783 -9.635 12.581 184 HA TYR 24 HA TYR 24 1.672 -7.032 13.393 185 1HB TYR 24 1HB TYR 24 3.700 -8.574 14.560 186 2HB TYR 24 2HB TYR 24 4.541 -7.262 13.742 187 HD1 TYR 24 HD1 TYR 24 2.381 -8.177 16.512 188 HD2 TYR 24 HD2 TYR 24 4.069 -4.912 14.370 189 HE1 TYR 24 HE1 TYR 24 1.838 -6.677 18.384 190 HE2 TYR 24 HE2 TYR 24 3.533 -3.403 16.236 191 HH TYR 24 HH TYR 24 3.129 -3.981 19.014 192 H ASP 25 H ASP 25 1.551 -5.643 11.766 193 HA ASP 25 HA ASP 25 3.539 -5.794 9.609 194 1HB ASP 25 1HB ASP 25 0.693 -4.949 9.750 195 2HB ASP 25 2HB ASP 25 1.727 -4.080 8.620 196 HD2 ASP 25 HD2 ASP 25 1.878 -7.900 7.757 197 H LEU 26 H LEU 26 5.007 -4.238 9.346 198 HA LEU 26 HA LEU 26 4.759 -1.821 11.003 199 1HB LEU 26 1HB LEU 26 6.853 -3.645 10.718 200 2HB LEU 26 2HB LEU 26 7.370 -2.236 9.813 201 HG LEU 26 HG LEU 26 6.573 -1.002 12.048 202 1HD1 LEU 26 1HD1 LEU 26 6.780 -2.221 13.986 203 2HD1 LEU 26 2HD1 LEU 26 7.747 -3.481 13.220 204 3HD1 LEU 26 3HD1 LEU 26 6.012 -3.396 12.919 205 1HD2 LEU 26 1HD2 LEU 26 8.706 -0.484 11.491 206 2HD2 LEU 26 2HD2 LEU 26 9.140 -2.159 11.148 207 3HD2 LEU 26 3HD2 LEU 26 9.068 -1.591 12.817 208 H TYR 27 H TYR 27 4.391 0.055 10.030 209 HA TYR 27 HA TYR 27 4.702 0.212 7.120 210 1HB TYR 27 1HB TYR 27 2.592 0.919 8.709 211 2HB TYR 27 2HB TYR 27 3.408 2.465 8.505 212 HD1 TYR 27 HD1 TYR 27 2.107 3.684 7.014 213 HD2 TYR 27 HD2 TYR 27 3.007 -0.378 6.123 214 HE1 TYR 27 HE1 TYR 27 1.063 3.944 4.802 215 HE2 TYR 27 HE2 TYR 27 1.966 -0.129 3.909 216 HH TYR 27 HH TYR 27 1.508 1.848 2.301 217 H ILE 28 H ILE 28 6.543 1.058 6.422 218 HA ILE 28 HA ILE 28 7.557 3.486 7.715 219 HB ILE 28 HB ILE 28 9.375 1.232 6.869 220 1HG1 ILE 28 1HG1 ILE 28 8.709 2.047 9.700 221 2HG1 ILE 28 2HG1 ILE 28 7.901 0.719 8.872 222 1HG2 ILE 28 1HG2 ILE 28 10.236 3.590 6.809 223 2HG2 ILE 28 2HG2 ILE 28 11.127 2.492 7.863 224 3HG2 ILE 28 3HG2 ILE 28 9.990 3.648 8.555 225 1HD1 ILE 28 1HD1 ILE 28 9.534 -0.647 9.454 226 2HD1 ILE 28 2HD1 ILE 28 10.327 0.678 10.306 227 3HD1 ILE 28 3HD1 ILE 28 10.707 0.366 8.613 228 HA PRO 29 HA PRO 29 7.713 4.784 3.464 229 1HB PRO 29 1HB PRO 29 9.131 7.069 3.784 230 2HB PRO 29 2HB PRO 29 7.437 6.922 4.268 231 1HG PRO 29 1HG PRO 29 9.909 6.745 5.947 232 2HG PRO 29 2HG PRO 29 8.382 7.581 6.287 233 1HD PRO 29 1HD PRO 29 8.995 5.158 7.339 234 2HD PRO 29 2HD PRO 29 7.332 5.650 6.970 235 H ALA 30 H ALA 30 9.489 5.731 1.937 236 HA ALA 30 HA ALA 30 11.585 3.794 1.815 237 1HB ALA 30 1HB ALA 30 11.375 6.274 0.126 238 2HB ALA 30 2HB ALA 30 10.387 4.839 -0.154 239 3HB ALA 30 3HB ALA 30 12.143 4.738 -0.276 240 H ILE 31 H ILE 31 13.792 4.072 2.044 241 HA ILE 31 HA ILE 31 14.788 6.653 2.978 242 HB ILE 31 HB ILE 31 16.026 5.490 4.849 243 1HG1 ILE 31 1HG1 ILE 31 13.893 3.401 4.810 244 2HG1 ILE 31 2HG1 ILE 31 15.291 3.184 3.759 245 1HG2 ILE 31 1HG2 ILE 31 14.362 5.971 6.371 246 2HG2 ILE 31 2HG2 ILE 31 13.087 5.317 5.343 247 3HG2 ILE 31 3HG2 ILE 31 13.823 6.871 4.954 248 1HD1 ILE 31 1HD1 ILE 31 16.703 2.812 5.491 249 2HD1 ILE 31 2HD1 ILE 31 15.205 2.247 6.233 250 3HD1 ILE 31 3HD1 ILE 31 15.812 3.864 6.591 251 H THR 32 H THR 32 16.988 6.969 2.650 252 HA THR 32 HA THR 32 18.599 4.789 1.602 253 HB THR 32 HB THR 32 19.266 6.231 -0.382 254 HG1 THR 32 HG1 THR 32 16.902 7.586 0.391 255 1HG2 THR 32 1HG2 THR 32 16.486 5.114 -0.217 256 2HG2 THR 32 2HG2 THR 32 17.931 4.354 -0.886 257 3HG2 THR 32 3HG2 THR 32 17.196 5.730 -1.710 258 H TRP 33 H TRP 33 18.645 6.478 3.973 259 HA TRP 33 HA TRP 33 21.135 7.984 3.526 260 1HB TRP 33 1HB TRP 33 18.902 8.289 5.510 261 2HB TRP 33 2HB TRP 33 20.502 8.927 5.873 262 HD1 TRP 33 HD1 TRP 33 17.634 9.372 3.335 263 HE1 TRP 33 HE1 TRP 33 17.812 11.732 2.325 264 HE3 TRP 33 HE3 TRP 33 22.046 10.835 5.464 265 HZ2 TRP 33 HZ2 TRP 33 19.587 13.926 2.419 266 HZ3 TRP 33 HZ3 TRP 33 22.915 13.079 4.952 267 HH2 TRP 33 HH2 TRP 33 21.711 14.592 3.460 268 H HIS 34 H HIS 34 19.563 5.629 5.640 269 HA HIS 34 HA HIS 34 22.189 4.578 6.353 270 1HB HIS 34 1HB HIS 34 20.257 5.814 8.253 271 2HB HIS 34 2HB HIS 34 21.103 4.363 8.780 272 HD1 HIS 34 HD1 HIS 34 23.890 4.653 8.152 273 HD2 HIS 34 HD2 HIS 34 21.603 8.007 9.040 274 HE1 HIS 34 HE1 HIS 34 25.534 6.423 8.849 275 HE2 HIS 34 HE2 HIS 34 24.134 8.468 9.301 276 H ALA 35 H ALA 35 20.021 3.660 4.658 277 HA ALA 35 HA ALA 35 18.533 1.636 5.993 278 1HB ALA 35 1HB ALA 35 17.777 0.976 3.846 279 2HB ALA 35 2HB ALA 35 19.166 1.719 3.052 280 3HB ALA 35 3HB ALA 35 17.933 2.732 3.803 281 H ARG 36 H ARG 36 20.059 0.440 7.188 282 HA ARG 36 HA ARG 36 21.463 -1.303 7.588 283 1HB ARG 36 1HB ARG 36 20.333 -1.934 4.907 284 2HB ARG 36 2HB ARG 36 21.719 -2.872 5.446 285 1HG ARG 36 1HG ARG 36 20.561 -3.836 7.190 286 2HG ARG 36 2HG ARG 36 19.365 -2.539 7.250 287 1HD ARG 36 1HD ARG 36 18.935 -3.481 4.760 288 2HD ARG 36 2HD ARG 36 19.464 -4.957 5.564 289 HE ARG 36 HE ARG 36 17.581 -3.819 7.225 290 1HH1 ARG 36 1HH1 ARG 36 17.676 -5.025 3.951 291 2HH1 ARG 36 2HH1 ARG 36 16.011 -5.501 3.946 292 1HH2 ARG 36 1HH2 ARG 36 15.391 -4.446 7.220 293 2HH2 ARG 36 2HH2 ARG 36 14.714 -5.172 5.801 294 H PHE 37 H PHE 37 23.179 0.293 7.736 295 HA PHE 37 HA PHE 37 25.334 -0.332 5.901 296 1HB PHE 37 1HB PHE 37 24.160 2.427 6.164 297 2HB PHE 37 2HB PHE 37 25.841 2.189 5.699 298 HD1 PHE 37 HD1 PHE 37 22.778 2.891 4.406 299 HD2 PHE 37 HD2 PHE 37 25.995 0.167 3.823 300 HE1 PHE 37 HE1 PHE 37 22.082 2.575 2.067 301 HE2 PHE 37 HE2 PHE 37 25.306 -0.154 1.483 302 HZ PHE 37 HZ PHE 37 23.346 1.051 0.602 303 H ALA 38 H ALA 38 26.346 -1.272 7.676 304 HA ALA 38 HA ALA 38 26.741 0.126 10.136 305 1HB ALA 38 1HB ALA 38 28.590 -1.804 10.273 306 2HB ALA 38 2HB ALA 38 27.575 -2.470 8.993 307 3HB ALA 38 3HB ALA 38 26.875 -2.094 10.567 308 H TYR 39 H TYR 39 28.674 0.986 10.968 309 HA TYR 39 HA TYR 39 30.769 1.567 8.985 310 1HB TYR 39 1HB TYR 39 29.078 3.484 9.539 311 2HB TYR 39 2HB TYR 39 29.992 3.613 11.038 312 HD1 TYR 39 HD1 TYR 39 31.923 4.911 11.103 313 HD2 TYR 39 HD2 TYR 39 30.442 3.597 7.337 314 HE1 TYR 39 HE1 TYR 39 33.600 6.304 9.964 315 HE2 TYR 39 HE2 TYR 39 32.114 4.985 6.188 316 HH TYR 39 HH TYR 39 33.895 7.389 7.747 317 H ASP 40 H ASP 40 32.729 1.011 9.657 318 HA ASP 40 HA ASP 40 33.226 -0.155 12.153 319 1HB ASP 40 1HB ASP 40 34.898 0.738 9.861 320 2HB ASP 40 2HB ASP 40 35.718 0.453 11.393 321 HD2 ASP 40 HD2 ASP 40 34.086 -2.672 9.561 322 H LYS 41 H LYS 41 33.560 0.698 14.091 323 HA LYS 41 HA LYS 41 34.019 2.167 15.762 324 1HB LYS 41 1HB LYS 41 35.841 3.107 13.588 325 2HB LYS 41 2HB LYS 41 35.654 4.103 15.024 326 1HG LYS 41 1HG LYS 41 37.543 2.745 15.392 327 2HG LYS 41 2HG LYS 41 36.247 2.064 16.377 328 1HD LYS 41 1HD LYS 41 36.154 0.155 15.167 329 2HD LYS 41 2HD LYS 41 36.487 0.982 13.644 330 1HE LYS 41 1HE LYS 41 38.492 -0.018 13.796 331 2HE LYS 41 2HE LYS 41 38.857 1.278 14.937 332 1HZ LYS 41 1HZ LYS 41 37.877 -1.441 15.624 333 2HZ LYS 41 2HZ LYS 41 38.139 -0.198 16.739 334 3HZ LYS 41 3HZ LYS 41 39.441 -0.845 15.876 335 H GLU 42 H GLU 42 32.864 3.780 16.638 336 HA GLU 42 HA GLU 42 31.381 5.491 16.836 337 1HB GLU 42 1HB GLU 42 32.814 6.418 14.344 338 2HB GLU 42 2HB GLU 42 31.636 7.391 15.212 339 1HG GLU 42 1HG GLU 42 33.289 8.159 16.460 340 2HG GLU 42 2HG GLU 42 33.453 6.545 17.151 341 HE2 GLU 42 HE2 GLU 42 36.514 6.157 15.685 342 H LYS 43 H LYS 43 29.698 3.904 16.416 343 HA LYS 43 HA LYS 43 28.443 4.191 13.772 344 1HB LYS 43 1HB LYS 43 29.075 1.895 15.087 345 2HB LYS 43 2HB LYS 43 27.411 2.126 15.606 346 1HG LYS 43 1HG LYS 43 27.092 2.538 12.988 347 2HG LYS 43 2HG LYS 43 28.495 1.469 12.938 348 1HD LYS 43 1HD LYS 43 26.955 -0.171 13.008 349 2HD LYS 43 2HD LYS 43 26.923 0.180 14.737 350 1HE LYS 43 1HE LYS 43 25.168 2.018 13.856 351 2HE LYS 43 2HE LYS 43 24.929 0.764 12.640 352 1HZ LYS 43 1HZ LYS 43 24.718 0.400 15.580 353 2HZ LYS 43 2HZ LYS 43 24.519 -0.822 14.428 354 3HZ LYS 43 3HZ LYS 43 23.424 0.466 14.492 355 H THR 44 H THR 44 28.018 4.697 17.181 356 HA THR 44 HA THR 44 25.258 4.918 17.379 357 HB THR 44 HB THR 44 25.638 6.276 19.345 358 HG1 THR 44 HG1 THR 44 28.310 6.541 18.435 359 1HG2 THR 44 1HG2 THR 44 26.487 3.801 19.226 360 2HG2 THR 44 2HG2 THR 44 26.820 4.814 20.630 361 3HG2 THR 44 3HG2 THR 44 28.065 4.568 19.406 362 H ASP 45 H ASP 45 27.567 7.079 15.935 363 HA ASP 45 HA ASP 45 27.338 8.993 14.731 364 1HB ASP 45 1HB ASP 45 25.250 7.449 13.960 365 2HB ASP 45 2HB ASP 45 24.388 8.856 14.574 366 HD2 ASP 45 HD2 ASP 45 26.395 10.731 12.095 367 H ARG 46 H ARG 46 25.545 11.017 14.642 368 HA ARG 46 HA ARG 46 25.450 11.911 17.445 369 1HB ARG 46 1HB ARG 46 26.904 13.119 15.679 370 2HB ARG 46 2HB ARG 46 25.381 13.748 15.066 371 1HG ARG 46 1HG ARG 46 26.144 15.414 16.493 372 2HG ARG 46 2HG ARG 46 24.960 14.538 17.466 373 1HD ARG 46 1HD ARG 46 26.713 13.332 18.596 374 2HD ARG 46 2HD ARG 46 27.934 14.045 17.543 375 HE ARG 46 HE ARG 46 26.599 16.138 18.787 376 1HH1 ARG 46 1HH1 ARG 46 28.623 13.448 19.703 377 2HH1 ARG 46 2HH1 ARG 46 29.274 14.249 21.093 378 1HH2 ARG 46 1HH2 ARG 46 27.454 17.195 20.615 379 2HH2 ARG 46 2HH2 ARG 46 28.611 16.376 21.611 380 H TYR 47 H TYR 47 23.781 12.751 14.403 381 HA TYR 47 HA TYR 47 21.279 12.934 15.935 382 1HB TYR 47 1HB TYR 47 22.334 14.344 13.532 383 2HB TYR 47 2HB TYR 47 20.595 14.091 13.634 384 HD1 TYR 47 HD1 TYR 47 19.352 15.003 15.630 385 HD2 TYR 47 HD2 TYR 47 23.393 16.036 14.790 386 HE1 TYR 47 HE1 TYR 47 19.149 16.966 17.097 387 HE2 TYR 47 HE2 TYR 47 23.201 18.002 16.256 388 HH TYR 47 HH TYR 47 21.309 19.491 17.101 389 H ASN 48 H ASN 48 19.286 12.277 14.778 390 HA ASN 48 HA ASN 48 19.782 9.836 13.209 391 1HB ASN 48 1HB ASN 48 17.543 9.100 14.013 392 2HB ASN 48 2HB ASN 48 18.697 9.356 15.319 393 1HD2 ASN 48 1HD2 ASN 48 16.019 10.840 13.577 394 2HD2 ASN 48 2HD2 ASN 48 15.462 11.809 14.895 395 H GLU 49 H GLU 49 17.981 9.259 11.682 396 HA GLU 49 HA GLU 49 17.212 11.663 10.188 397 1HB GLU 49 1HB GLU 49 18.548 9.621 9.218 398 2HB GLU 49 2HB GLU 49 16.954 8.891 9.091 399 1HG GLU 49 1HG GLU 49 17.378 9.861 7.001 400 2HG GLU 49 2HG GLU 49 16.252 10.950 7.810 401 HE2 GLU 49 HE2 GLU 49 19.344 12.958 8.416 402 H ARG 50 H ARG 50 15.106 11.968 9.429 403 HA ARG 50 HA ARG 50 13.042 10.155 10.445 404 1HB ARG 50 1HB ARG 50 13.619 12.723 11.536 405 2HB ARG 50 2HB ARG 50 12.070 12.825 10.710 406 1HG ARG 50 1HG ARG 50 11.048 11.739 12.347 407 2HG ARG 50 2HG ARG 50 12.215 10.418 12.278 408 1HD ARG 50 1HD ARG 50 12.077 11.594 14.487 409 2HD ARG 50 2HD ARG 50 13.689 11.536 13.775 410 HE ARG 50 HE ARG 50 12.697 13.915 12.925 411 1HH1 ARG 50 1HH1 ARG 50 13.046 12.429 16.064 412 2HH1 ARG 50 2HH1 ARG 50 13.241 13.936 16.894 413 1HH2 ARG 50 1HH2 ARG 50 12.954 15.898 14.015 414 2HH2 ARG 50 2HH2 ARG 50 13.188 15.905 15.732 415 HA PRO 51 HA PRO 51 12.406 11.125 5.956 416 1HB PRO 51 1HB PRO 51 10.863 8.606 6.289 417 2HB PRO 51 2HB PRO 51 12.010 9.065 5.027 418 1HG PRO 51 1HG PRO 51 12.692 7.318 6.920 419 2HG PRO 51 2HG PRO 51 13.854 8.513 6.315 420 1HD PRO 51 1HD PRO 51 12.313 8.489 8.875 421 2HD PRO 51 2HD PRO 51 13.976 9.028 8.563 422 H TRP 52 H TRP 52 9.838 9.429 7.764 423 HA TRP 52 HA TRP 52 8.128 11.747 7.723 424 1HB TRP 52 1HB TRP 52 7.448 9.325 6.044 425 2HB TRP 52 2HB TRP 52 6.305 10.600 6.454 426 HD1 TRP 52 HD1 TRP 52 6.536 12.917 5.173 427 HE1 TRP 52 HE1 TRP 52 7.815 13.609 3.050 428 HE3 TRP 52 HE3 TRP 52 9.632 8.872 4.737 429 HZ2 TRP 52 HZ2 TRP 52 9.865 12.577 1.407 430 HZ3 TRP 52 HZ3 TRP 52 11.223 8.802 2.860 431 HH2 TRP 52 HH2 TRP 52 11.336 10.616 1.231 432 H GLY 53 H GLY 53 9.284 9.905 9.677 433 1HA GLY 53 1HA GLY 53 8.546 9.136 11.731 434 2HA GLY 53 2HA GLY 53 6.895 9.441 11.213 435 H GLY 54 H GLY 54 5.798 7.606 11.501 436 1HA GLY 54 1HA GLY 54 6.095 5.382 9.875 437 2HA GLY 54 2HA GLY 54 6.974 5.022 11.354 438 H GLY 55 H GLY 55 5.174 3.278 11.128 439 1HA GLY 55 1HA GLY 55 3.256 3.845 13.175 440 2HA GLY 55 2HA GLY 55 2.503 3.729 11.593 441 H PHE 56 H PHE 56 1.461 1.955 13.037 442 HA PHE 56 HA PHE 56 2.629 -0.556 12.174 443 1HB PHE 56 1HB PHE 56 1.901 -0.230 15.084 444 2HB PHE 56 2HB PHE 56 2.723 -1.586 14.318 445 HD1 PHE 56 HD1 PHE 56 3.114 1.513 16.033 446 HD2 PHE 56 HD2 PHE 56 5.043 -1.172 13.352 447 HE1 PHE 56 HE1 PHE 56 5.287 2.523 16.590 448 HE2 PHE 56 HE2 PHE 56 7.220 -0.167 13.906 449 HZ PHE 56 HZ PHE 56 7.344 1.682 15.528 450 H GLY 57 H GLY 57 1.104 -2.424 12.909 451 1HA GLY 57 1HA GLY 57 -1.560 -2.007 13.581 452 2HA GLY 57 2HA GLY 57 -1.460 -1.863 11.832 453 H LEU 58 H LEU 58 -3.043 -3.774 12.457 454 HA LEU 58 HA LEU 58 -1.457 -6.256 12.349 455 1HB LEU 58 1HB LEU 58 -3.386 -7.400 13.361 456 2HB LEU 58 2HB LEU 58 -2.707 -6.170 14.408 457 HG LEU 58 HG LEU 58 -4.621 -4.697 13.264 458 1HD1 LEU 58 1HD1 LEU 58 -6.198 -7.169 13.531 459 2HD1 LEU 58 2HD1 LEU 58 -5.194 -7.050 12.087 460 3HD1 LEU 58 3HD1 LEU 58 -6.395 -5.804 12.430 461 1HD2 LEU 58 1HD2 LEU 58 -4.567 -6.445 15.661 462 2HD2 LEU 58 2HD2 LEU 58 -6.105 -5.701 15.220 463 3HD2 LEU 58 3HD2 LEU 58 -4.695 -4.690 15.540 464 H SER 59 H SER 59 -2.326 -7.983 11.055 465 HA SER 59 HA SER 59 -4.205 -7.090 8.972 466 1HB SER 59 1HB SER 59 -1.637 -8.644 8.572 467 2HB SER 59 2HB SER 59 -2.850 -8.382 7.319 468 HG SER 59 HG SER 59 -2.233 -6.361 7.124 469 H ARG 60 H ARG 60 -5.611 -8.632 8.165 470 HA ARG 60 HA ARG 60 -5.702 -11.147 9.692 471 1HB ARG 60 1HB ARG 60 -7.616 -9.309 9.693 472 2HB ARG 60 2HB ARG 60 -8.082 -10.129 8.210 473 1HG ARG 60 1HG ARG 60 -7.767 -12.249 9.836 474 2HG ARG 60 2HG ARG 60 -8.258 -11.024 11.007 475 1HD ARG 60 1HD ARG 60 -9.838 -11.041 8.540 476 2HD ARG 60 2HD ARG 60 -9.961 -12.523 9.488 477 HE ARG 60 HE ARG 60 -10.268 -10.268 11.161 478 1HH1 ARG 60 1HH1 ARG 60 -11.958 -12.101 8.718 479 2HH1 ARG 60 2HH1 ARG 60 -13.529 -11.683 9.314 480 1HH2 ARG 60 1HH2 ARG 60 -12.334 -9.719 11.947 481 2HH2 ARG 60 2HH2 ARG 60 -13.743 -10.330 11.147 482 H TRP 61 H TRP 61 -6.432 -13.062 8.593 483 HA TRP 61 HA TRP 61 -5.765 -13.030 5.723 484 1HB TRP 61 1HB TRP 61 -4.430 -14.410 7.579 485 2HB TRP 61 2HB TRP 61 -5.711 -15.576 7.264 486 HD1 TRP 61 HD1 TRP 61 -3.072 -13.578 5.234 487 HE1 TRP 61 HE1 TRP 61 -2.309 -15.053 3.267 488 HE3 TRP 61 HE3 TRP 61 -6.161 -17.583 5.977 489 HZ2 TRP 61 HZ2 TRP 61 -2.934 -17.580 2.175 490 HZ3 TRP 61 HZ3 TRP 61 -6.016 -19.489 4.426 491 HH2 TRP 61 HH2 TRP 61 -4.436 -19.485 2.565 492 H ASP 62 H ASP 62 -7.369 -13.444 4.359 493 HA ASP 62 HA ASP 62 -9.848 -14.598 5.404 494 1HB ASP 62 1HB ASP 62 -9.479 -12.412 3.842 495 2HB ASP 62 2HB ASP 62 -9.761 -13.637 2.609 496 HD2 ASP 62 HD2 ASP 62 -12.994 -14.221 4.174 497 H GLU 63 H GLU 63 -10.215 -16.681 5.125 498 HA GLU 63 HA GLU 63 -8.622 -18.434 3.677 499 1HB GLU 63 1HB GLU 63 -10.461 -20.067 3.966 500 2HB GLU 63 2HB GLU 63 -10.062 -19.217 5.452 501 1HG GLU 63 1HG GLU 63 -12.167 -17.929 3.894 502 2HG GLU 63 2HG GLU 63 -12.571 -19.557 4.436 503 HE2 GLU 63 HE2 GLU 63 -12.992 -18.505 7.674 504 H LYS 64 H LYS 64 -11.188 -16.397 2.589 505 HA LYS 64 HA LYS 64 -11.870 -17.858 0.245 506 1HB LYS 64 1HB LYS 64 -12.389 -15.106 1.272 507 2HB LYS 64 2HB LYS 64 -12.652 -15.416 -0.438 508 1HG LYS 64 1HG LYS 64 -14.135 -17.321 0.225 509 2HG LYS 64 2HG LYS 64 -13.988 -16.766 1.893 510 1HD LYS 64 1HD LYS 64 -15.854 -15.602 1.358 511 2HD LYS 64 2HD LYS 64 -14.677 -14.456 0.712 512 1HE LYS 64 1HE LYS 64 -14.980 -16.119 -1.402 513 2HE LYS 64 2HE LYS 64 -16.588 -16.208 -0.684 514 1HZ LYS 64 1HZ LYS 64 -16.174 -13.585 -0.633 515 2HZ LYS 64 2HZ LYS 64 -16.911 -14.380 -1.930 516 3HZ LYS 64 3HZ LYS 64 -15.269 -13.985 -2.005 517 H GLY 65 H GLY 65 -9.310 -15.672 1.063 518 1HA GLY 65 1HA GLY 65 -7.333 -15.904 -0.422 519 2HA GLY 65 2HA GLY 65 -8.446 -15.690 -1.764 520 H ASN 66 H ASN 66 -8.295 -13.913 1.298 521 HA ASN 66 HA ASN 66 -7.491 -11.516 -0.202 522 1HB ASN 66 1HB ASN 66 -9.752 -11.732 1.792 523 2HB ASN 66 2HB ASN 66 -9.082 -10.200 1.240 524 1HD2 ASN 66 1HD2 ASN 66 -10.799 -13.089 0.264 525 2HD2 ASN 66 2HD2 ASN 66 -11.497 -12.420 -1.168 526 H TRP 67 H TRP 67 -6.498 -9.851 1.088 527 HA TRP 67 HA TRP 67 -5.429 -10.821 3.656 528 1HB TRP 67 1HB TRP 67 -3.912 -10.663 1.417 529 2HB TRP 67 2HB TRP 67 -3.695 -9.036 2.054 530 HD1 TRP 67 HD1 TRP 67 -2.989 -12.707 2.924 531 HE1 TRP 67 HE1 TRP 67 -1.166 -12.779 4.739 532 HE3 TRP 67 HE3 TRP 67 -2.644 -7.706 3.929 533 HZ2 TRP 67 HZ2 TRP 67 0.234 -10.957 6.380 534 HZ3 TRP 67 HZ3 TRP 67 -1.039 -6.954 5.636 535 HH2 TRP 67 HH2 TRP 67 0.370 -8.547 6.835 536 H HIS 68 H HIS 68 -6.693 -9.587 4.976 537 HA HIS 68 HA HIS 68 -7.319 -6.863 4.496 538 1HB HIS 68 1HB HIS 68 -8.525 -8.557 6.024 539 2HB HIS 68 2HB HIS 68 -7.308 -8.137 7.224 540 HD1 HIS 68 HD1 HIS 68 -7.139 -5.247 7.317 541 HD2 HIS 68 HD2 HIS 68 -10.753 -7.120 6.482 542 HE1 HIS 68 HE1 HIS 68 -8.916 -3.556 7.869 543 HE2 HIS 68 HE2 HIS 68 -11.091 -4.683 7.282 544 H GLY 69 H GLY 69 -6.302 -5.019 5.058 545 1HA GLY 69 1HA GLY 69 -3.903 -5.241 6.762 546 2HA GLY 69 2HA GLY 69 -3.838 -4.383 5.230 547 H LEU 70 H LEU 70 -4.312 -4.074 8.519 548 HA LEU 70 HA LEU 70 -5.395 -1.364 8.150 549 1HB LEU 70 1HB LEU 70 -6.886 -3.298 9.241 550 2HB LEU 70 2HB LEU 70 -6.008 -2.799 10.675 551 HG LEU 70 HG LEU 70 -7.434 -0.777 8.977 552 1HD1 LEU 70 1HD1 LEU 70 -8.601 -2.678 10.970 553 2HD1 LEU 70 2HD1 LEU 70 -9.230 -2.177 9.399 554 3HD1 LEU 70 3HD1 LEU 70 -9.277 -1.062 10.765 555 1HD2 LEU 70 1HD2 LEU 70 -5.742 -0.443 11.028 556 2HD2 LEU 70 2HD2 LEU 70 -7.253 -0.610 11.920 557 3HD2 LEU 70 3HD2 LEU 70 -7.086 0.649 10.696 558 H TYR 71 H TYR 71 -4.020 0.124 8.842 559 HA TYR 71 HA TYR 71 -2.578 -0.208 11.319 560 1HB TYR 71 1HB TYR 71 -0.364 0.346 10.169 561 2HB TYR 71 2HB TYR 71 -0.962 -1.300 9.987 562 HD1 TYR 71 HD1 TYR 71 -0.814 -2.223 7.884 563 HD2 TYR 71 HD2 TYR 71 -1.264 1.993 8.234 564 HE1 TYR 71 HE1 TYR 71 -0.665 -2.011 5.438 565 HE2 TYR 71 HE2 TYR 71 -1.117 2.217 5.790 566 HH TYR 71 HH TYR 71 -1.656 0.489 3.746 567 H ALA 72 H ALA 72 -1.446 1.764 11.965 568 HA ALA 72 HA ALA 72 -2.528 4.156 10.621 569 1HB ALA 72 1HB ALA 72 -3.675 3.818 12.721 570 2HB ALA 72 2HB ALA 72 -2.624 5.230 12.841 571 3HB ALA 72 3HB ALA 72 -2.137 3.702 13.577 572 H MET 73 H MET 73 -1.072 5.585 9.941 573 HA MET 73 HA MET 73 1.648 5.449 11.071 574 1HB MET 73 1HB MET 73 1.235 4.704 8.619 575 2HB MET 73 2HB MET 73 1.069 6.423 8.290 576 1HG MET 73 1HG MET 73 3.380 6.422 9.670 577 2HG MET 73 2HG MET 73 3.462 4.832 8.913 578 1HE MET 73 1HE MET 73 4.021 4.269 6.996 579 2HE MET 73 2HE MET 73 5.025 5.280 5.957 580 3HE MET 73 3HE MET 73 3.333 4.996 5.544 581 H ALA 74 H ALA 74 2.725 7.361 11.485 582 HA ALA 74 HA ALA 74 1.101 9.814 11.276 583 1HB ALA 74 1HB ALA 74 3.152 9.627 13.403 584 2HB ALA 74 2HB ALA 74 1.691 8.663 13.608 585 3HB ALA 74 3HB ALA 74 1.574 10.412 13.414 586 H PHE 75 H PHE 75 2.062 11.625 10.492 587 HA PHE 75 HA PHE 75 4.805 11.314 9.494 588 1HB PHE 75 1HB PHE 75 4.254 13.097 7.904 589 2HB PHE 75 2HB PHE 75 3.100 11.772 7.791 590 HD1 PHE 75 HD1 PHE 75 3.600 15.250 8.801 591 HD2 PHE 75 HD2 PHE 75 0.804 12.058 8.469 592 HE1 PHE 75 HE1 PHE 75 1.751 16.841 9.125 593 HE2 PHE 75 HE2 PHE 75 -1.050 13.643 8.793 594 HZ PHE 75 HZ PHE 75 -0.578 16.038 9.120 595 H LYS 76 H LYS 76 6.392 12.788 9.947 596 HA LYS 76 HA LYS 76 5.978 14.419 12.296 597 1HB LYS 76 1HB LYS 76 8.074 12.970 11.568 598 2HB LYS 76 2HB LYS 76 8.537 14.460 10.759 599 1HG LYS 76 1HG LYS 76 7.684 14.791 13.546 600 2HG LYS 76 2HG LYS 76 9.150 13.835 13.321 601 1HD LYS 76 1HD LYS 76 8.746 16.518 12.020 602 2HD LYS 76 2HD LYS 76 9.464 16.336 13.622 603 1HE LYS 76 1HE LYS 76 11.391 16.235 12.455 604 2HE LYS 76 2HE LYS 76 10.928 14.547 12.240 605 1HZ LYS 76 1HZ LYS 76 11.559 16.072 10.212 606 2HZ LYS 76 2HZ LYS 76 9.925 16.495 10.302 607 3HZ LYS 76 3HZ LYS 76 10.368 14.878 10.078 608 H ASP 77 H ASP 77 5.338 16.458 12.224 609 HA ASP 77 HA ASP 77 5.007 17.919 9.848 610 1HB ASP 77 1HB ASP 77 4.079 18.182 12.386 611 2HB ASP 77 2HB ASP 77 5.267 19.483 12.341 612 HD2 ASP 77 HD2 ASP 77 3.342 21.358 10.166 613 H SER 78 H SER 78 5.930 20.468 10.324 614 HA SER 78 HA SER 78 8.718 20.170 9.599 615 1HB SER 78 1HB SER 78 8.376 22.815 9.475 616 2HB SER 78 2HB SER 78 7.809 21.742 8.197 617 HG SER 78 HG SER 78 6.270 22.757 10.355 618 H TRP 79 H TRP 79 6.866 21.104 12.368 619 HA TRP 79 HA TRP 79 9.330 21.498 13.865 620 1HB TRP 79 1HB TRP 79 8.355 23.748 12.974 621 2HB TRP 79 2HB TRP 79 7.147 23.523 14.235 622 HD1 TRP 79 HD1 TRP 79 9.449 22.216 16.281 623 HE1 TRP 79 HE1 TRP 79 10.959 23.895 17.516 624 HE3 TRP 79 HE3 TRP 79 8.787 26.286 13.257 625 HZ2 TRP 79 HZ2 TRP 79 11.764 26.587 17.245 626 HZ3 TRP 79 HZ3 TRP 79 9.962 28.374 13.815 627 HH2 TRP 79 HH2 TRP 79 11.420 28.520 15.769 628 H ASN 80 H ASN 80 5.778 21.607 14.062 629 HA ASN 80 HA ASN 80 5.634 20.867 16.782 630 1HB ASN 80 1HB ASN 80 3.239 20.289 16.214 631 2HB ASN 80 2HB ASN 80 3.733 21.929 15.803 632 1HD2 ASN 80 1HD2 ASN 80 2.155 19.252 14.719 633 2HD2 ASN 80 2HD2 ASN 80 2.212 19.555 13.019 634 H LYS 81 H LYS 81 4.071 18.786 17.172 635 HA LYS 81 HA LYS 81 5.792 16.554 16.740 636 1HB LYS 81 1HB LYS 81 3.224 17.040 18.156 637 2HB LYS 81 2HB LYS 81 3.594 15.380 17.715 638 1HG LYS 81 1HG LYS 81 5.905 15.936 18.827 639 2HG LYS 81 2HG LYS 81 4.960 17.181 19.646 640 1HD LYS 81 1HD LYS 81 3.716 14.519 19.591 641 2HD LYS 81 2HD LYS 81 5.220 14.615 20.509 642 1HE LYS 81 1HE LYS 81 3.617 15.132 22.101 643 2HE LYS 81 2HE LYS 81 4.161 16.722 21.569 644 1HZ LYS 81 1HZ LYS 81 1.638 16.192 21.750 645 2HZ LYS 81 2HZ LYS 81 1.860 15.478 20.234 646 3HZ LYS 81 3HZ LYS 81 2.216 17.116 20.456 647 H TRP 82 H TRP 82 4.611 14.386 16.089 648 HA TRP 82 HA TRP 82 3.764 14.781 13.342 649 1HB TRP 82 1HB TRP 82 3.888 12.256 13.271 650 2HB TRP 82 2HB TRP 82 5.400 13.073 13.653 651 HD1 TRP 82 HD1 TRP 82 2.748 10.803 15.196 652 HE1 TRP 82 HE1 TRP 82 3.662 9.844 17.404 653 HE3 TRP 82 HE3 TRP 82 7.026 13.577 15.578 654 HZ2 TRP 82 HZ2 TRP 82 5.900 10.215 19.084 655 HZ3 TRP 82 HZ3 TRP 82 8.498 13.214 17.515 656 HH2 TRP 82 HH2 TRP 82 7.945 11.568 19.232 657 H GLU 83 H GLU 83 1.820 14.088 12.465 658 HA GLU 83 HA GLU 83 -0.344 13.762 14.413 659 1HB GLU 83 1HB GLU 83 -0.498 15.642 12.806 660 2HB GLU 83 2HB GLU 83 -0.504 14.484 11.483 661 1HG GLU 83 1HG GLU 83 -2.662 13.981 11.764 662 2HG GLU 83 2HG GLU 83 -2.540 13.985 13.523 663 HE2 GLU 83 HE2 GLU 83 -4.426 16.864 13.291 664 HA PRO 84 HA PRO 84 -0.536 9.456 13.201 665 1HB PRO 84 1HB PRO 84 -3.134 9.441 14.580 666 2HB PRO 84 2HB PRO 84 -1.668 8.526 14.940 667 1HG PRO 84 1HG PRO 84 -2.513 10.537 16.514 668 2HG PRO 84 2HG PRO 84 -0.791 10.195 16.265 669 1HD PRO 84 1HD PRO 84 -2.502 12.319 15.028 670 2HD PRO 84 2HD PRO 84 -0.831 12.420 15.625 671 H ILE 85 H ILE 85 -1.914 8.063 11.940 672 HA ILE 85 HA ILE 85 -4.210 9.291 10.632 673 HB ILE 85 HB ILE 85 -1.954 8.150 8.985 674 1HG1 ILE 85 1HG1 ILE 85 -2.697 11.051 9.430 675 2HG1 ILE 85 2HG1 ILE 85 -1.261 10.257 10.067 676 1HG2 ILE 85 1HG2 ILE 85 -3.304 9.483 7.207 677 2HG2 ILE 85 2HG2 ILE 85 -4.619 9.357 8.376 678 3HG2 ILE 85 3HG2 ILE 85 -3.872 7.897 7.726 679 1HD1 ILE 85 1HD1 ILE 85 -1.141 11.706 7.903 680 2HD1 ILE 85 2HD1 ILE 85 -1.740 10.237 7.131 681 3HD1 ILE 85 3HD1 ILE 85 -0.223 10.206 8.029 682 H ALA 86 H ALA 86 -5.580 7.795 9.568 683 HA ALA 86 HA ALA 86 -5.187 5.029 10.481 684 1HB ALA 86 1HB ALA 86 -7.557 6.757 10.132 685 2HB ALA 86 2HB ALA 86 -7.218 5.521 11.344 686 3HB ALA 86 3HB ALA 86 -7.760 5.051 9.734 687 H GLY 87 H GLY 87 -5.499 3.285 9.084 688 1HA GLY 87 1HA GLY 87 -6.015 3.820 6.265 689 2HA GLY 87 2HA GLY 87 -4.421 3.192 6.657 690 H TYR 88 H TYR 88 -6.935 2.141 5.221 691 HA TYR 88 HA TYR 88 -6.674 -0.558 6.241 692 1HB TYR 88 1HB TYR 88 -9.135 -0.880 6.413 693 2HB TYR 88 2HB TYR 88 -8.498 0.236 7.616 694 HD1 TYR 88 HD1 TYR 88 -8.530 2.789 6.819 695 HD2 TYR 88 HD2 TYR 88 -11.072 -0.276 5.320 696 HE1 TYR 88 HE1 TYR 88 -10.152 4.492 6.102 697 HE2 TYR 88 HE2 TYR 88 -12.700 1.419 4.597 698 HH TYR 88 HH TYR 88 -12.713 3.825 4.004 699 H GLY 89 H GLY 89 -6.820 -2.043 4.652 700 1HA GLY 89 1HA GLY 89 -8.353 -1.602 2.263 701 2HA GLY 89 2HA GLY 89 -6.625 -1.427 1.997 702 H TRP 90 H TRP 90 -7.329 -3.274 0.491 703 HA TRP 90 HA TRP 90 -6.747 -5.788 1.888 704 1HB TRP 90 1HB TRP 90 -8.927 -5.366 -0.165 705 2HB TRP 90 2HB TRP 90 -8.367 -6.950 0.364 706 HD1 TRP 90 HD1 TRP 90 -9.053 -7.740 2.827 707 HE1 TRP 90 HE1 TRP 90 -10.895 -6.941 4.437 708 HE3 TRP 90 HE3 TRP 90 -10.199 -3.283 0.601 709 HZ2 TRP 90 HZ2 TRP 90 -12.608 -4.716 4.725 710 HZ3 TRP 90 HZ3 TRP 90 -11.951 -1.879 1.606 711 HH2 TRP 90 HH2 TRP 90 -13.130 -2.582 3.625 712 H GLU 91 H GLU 91 -5.612 -7.328 0.677 713 HA GLU 91 HA GLU 91 -4.763 -6.579 -2.017 714 1HB GLU 91 1HB GLU 91 -2.786 -7.291 0.155 715 2HB GLU 91 2HB GLU 91 -2.412 -6.870 -1.511 716 1HG GLU 91 1HG GLU 91 -3.784 -4.983 0.379 717 2HG GLU 91 2HG GLU 91 -2.032 -5.072 0.209 718 HE2 GLU 91 HE2 GLU 91 -3.847 -2.793 -2.240 719 H SER 92 H SER 92 -3.896 -8.323 -3.246 720 HA SER 92 HA SER 92 -4.420 -10.985 -2.095 721 1HB SER 92 1HB SER 92 -6.131 -10.130 -3.804 722 2HB SER 92 2HB SER 92 -4.852 -10.315 -5.004 723 HG SER 92 HG SER 92 -4.729 -12.525 -4.403 724 H THR 93 H THR 93 -2.476 -11.873 -1.797 725 HA THR 93 HA THR 93 -0.283 -11.319 -3.609 726 HB THR 93 HB THR 93 -0.394 -13.137 -1.194 727 HG1 THR 93 HG1 THR 93 -0.734 -11.042 -0.540 728 1HG2 THR 93 1HG2 THR 93 1.503 -13.779 -2.420 729 2HG2 THR 93 2HG2 THR 93 2.085 -12.688 -1.162 730 3HG2 THR 93 3HG2 THR 93 1.908 -12.109 -2.818 731 H TRP 94 H TRP 94 0.663 -12.744 -5.010 732 HA TRP 94 HA TRP 94 -0.748 -15.301 -5.415 733 1HB TRP 94 1HB TRP 94 0.317 -13.294 -7.375 734 2HB TRP 94 2HB TRP 94 0.180 -14.987 -7.836 735 HD1 TRP 94 HD1 TRP 94 -1.768 -11.871 -7.792 736 HE1 TRP 94 HE1 TRP 94 -4.258 -12.341 -8.243 737 HE3 TRP 94 HE3 TRP 94 -1.764 -16.944 -7.157 738 HZ2 TRP 94 HZ2 TRP 94 -5.991 -14.568 -8.318 739 HZ3 TRP 94 HZ3 TRP 94 -3.879 -18.170 -7.436 740 HH2 TRP 94 HH2 TRP 94 -5.949 -17.004 -8.004 741 H ARG 95 H ARG 95 0.451 -17.135 -5.810 742 HA ARG 95 HA ARG 95 3.376 -16.862 -5.643 743 1HB ARG 95 1HB ARG 95 3.418 -18.910 -4.245 744 2HB ARG 95 2HB ARG 95 2.603 -17.562 -3.464 745 1HG ARG 95 1HG ARG 95 0.919 -18.944 -3.064 746 2HG ARG 95 2HG ARG 95 0.575 -18.905 -4.795 747 1HD ARG 95 1HD ARG 95 2.376 -20.767 -4.935 748 2HD ARG 95 2HD ARG 95 2.079 -20.949 -3.207 749 HE ARG 95 HE ARG 95 -0.406 -21.026 -4.293 750 1HH1 ARG 95 1HH1 ARG 95 2.546 -22.788 -4.897 751 2HH1 ARG 95 2HH1 ARG 95 1.729 -24.228 -5.405 752 1HH2 ARG 95 1HH2 ARG 95 -1.481 -22.921 -4.960 753 2HH2 ARG 95 2HH2 ARG 95 -0.556 -24.304 -5.440 754 HA PRO 96 HA PRO 96 2.619 -19.298 -9.414 755 1HB PRO 96 1HB PRO 96 5.112 -18.930 -10.440 756 2HB PRO 96 2HB PRO 96 3.814 -17.741 -10.605 757 1HG PRO 96 1HG PRO 96 6.092 -17.804 -8.663 758 2HG PRO 96 2HG PRO 96 5.433 -16.431 -9.574 759 1HD PRO 96 1HD PRO 96 4.836 -16.863 -6.974 760 2HD PRO 96 2HD PRO 96 3.676 -16.139 -8.107 761 H LEU 97 H LEU 97 4.069 -21.044 -10.486 762 HA LEU 97 HA LEU 97 4.894 -22.854 -8.357 763 1HB LEU 97 1HB LEU 97 4.608 -23.372 -11.318 764 2HB LEU 97 2HB LEU 97 4.857 -24.583 -10.074 765 HG LEU 97 HG LEU 97 2.624 -23.664 -9.089 766 1HD1 LEU 97 1HD1 LEU 97 2.211 -21.767 -10.390 767 2HD1 LEU 97 2HD1 LEU 97 1.119 -22.988 -11.043 768 3HD1 LEU 97 3HD1 LEU 97 2.614 -22.598 -11.893 769 1HD2 LEU 97 1HD2 LEU 97 1.432 -25.349 -10.233 770 2HD2 LEU 97 2HD2 LEU 97 3.102 -25.909 -10.159 771 3HD2 LEU 97 3HD2 LEU 97 2.467 -25.224 -11.655 772 H ALA 98 H ALA 98 6.898 -22.001 -7.764 773 HA ALA 98 HA ALA 98 9.130 -23.001 -9.149 774 1HB ALA 98 1HB ALA 98 8.980 -21.353 -10.778 775 2HB ALA 98 2HB ALA 98 10.143 -20.678 -9.637 776 3HB ALA 98 3HB ALA 98 8.470 -20.119 -9.626 777 H ASP 99 H ASP 99 8.460 -20.020 -7.300 778 HA ASP 99 HA ASP 99 10.197 -21.067 -5.165 779 1HB ASP 99 1HB ASP 99 10.965 -19.031 -6.756 780 2HB ASP 99 2HB ASP 99 10.078 -18.127 -5.531 781 HD2 ASP 99 HD2 ASP 99 13.591 -18.697 -4.544 782 H GLU 100 H GLU 100 9.834 -19.926 -3.053 783 HA GLU 100 HA GLU 100 6.954 -19.426 -2.702 784 1HB GLU 100 1HB GLU 100 8.907 -20.288 -0.568 785 2HB GLU 100 2HB GLU 100 7.152 -20.267 -0.467 786 1HG GLU 100 1HG GLU 100 8.469 -21.945 -2.544 787 2HG GLU 100 2HG GLU 100 8.443 -22.498 -0.870 788 HE2 GLU 100 HE2 GLU 100 5.231 -22.932 -3.001 789 H ASN 101 H ASN 101 10.175 -18.243 -2.020 790 HA ASN 101 HA ASN 101 9.499 -16.216 -0.189 791 1HB ASN 101 1HB ASN 101 11.839 -17.171 -1.336 792 2HB ASN 101 2HB ASN 101 11.725 -15.522 -1.944 793 1HD2 ASN 101 1HD2 ASN 101 10.433 -14.352 0.244 794 2HD2 ASN 101 2HD2 ASN 101 11.533 -14.327 1.576 795 H PHE 102 H PHE 102 10.115 -15.997 -3.697 796 HA PHE 102 HA PHE 102 9.363 -13.292 -3.934 797 1HB PHE 102 1HB PHE 102 9.925 -15.530 -5.780 798 2HB PHE 102 2HB PHE 102 8.885 -14.265 -6.426 799 HD1 PHE 102 HD1 PHE 102 12.108 -14.691 -4.604 800 HD2 PHE 102 HD2 PHE 102 9.851 -12.425 -7.411 801 HE1 PHE 102 HE1 PHE 102 14.089 -13.311 -5.077 802 HE2 PHE 102 HE2 PHE 102 11.829 -11.041 -7.890 803 HZ PHE 102 HZ PHE 102 13.951 -11.483 -6.722 804 H HIS 103 H HIS 103 7.439 -12.325 -4.054 805 HA HIS 103 HA HIS 103 5.078 -13.867 -4.811 806 1HB HIS 103 1HB HIS 103 5.486 -12.515 -2.157 807 2HB HIS 103 2HB HIS 103 3.871 -12.725 -2.824 808 HD1 HIS 103 HD1 HIS 103 4.522 -15.622 -4.028 809 HD2 HIS 103 HD2 HIS 103 5.118 -14.358 -0.114 810 HE1 HIS 103 HE1 HIS 103 4.525 -17.717 -2.637 811 HE2 HIS 103 HE2 HIS 103 4.804 -16.921 -0.264 812 H LEU 104 H LEU 104 3.352 -12.613 -5.585 813 HA LEU 104 HA LEU 104 3.791 -9.727 -5.804 814 1HB LEU 104 1HB LEU 104 3.314 -11.591 -8.127 815 2HB LEU 104 2HB LEU 104 3.147 -9.848 -8.226 816 HG LEU 104 HG LEU 104 5.637 -9.920 -7.301 817 1HD1 LEU 104 1HD1 LEU 104 6.620 -11.907 -8.783 818 2HD1 LEU 104 2HD1 LEU 104 5.094 -12.648 -8.303 819 3HD1 LEU 104 3HD1 LEU 104 6.230 -12.093 -7.074 820 1HD2 LEU 104 1HD2 LEU 104 4.502 -10.041 -10.034 821 2HD2 LEU 104 2HD2 LEU 104 6.249 -10.215 -9.872 822 3HD2 LEU 104 3HD2 LEU 104 5.445 -8.773 -9.252 823 H GLY 105 H GLY 105 2.007 -8.698 -5.203 824 1HA GLY 105 1HA GLY 105 -0.602 -9.864 -5.897 825 2HA GLY 105 2HA GLY 105 -0.278 -9.425 -4.227 826 H LEU 106 H LEU 106 -2.392 -8.363 -5.737 827 HA LEU 106 HA LEU 106 -1.656 -5.533 -5.664 828 1HB LEU 106 1HB LEU 106 -2.553 -7.044 -8.031 829 2HB LEU 106 2HB LEU 106 -3.392 -5.529 -7.757 830 HG LEU 106 HG LEU 106 -0.902 -4.622 -7.511 831 1HD1 LEU 106 1HD1 LEU 106 0.023 -6.924 -7.837 832 2HD1 LEU 106 2HD1 LEU 106 0.644 -5.712 -8.957 833 3HD1 LEU 106 3HD1 LEU 106 -0.579 -6.864 -9.493 834 1HD2 LEU 106 1HD2 LEU 106 -1.300 -3.566 -9.464 835 2HD2 LEU 106 2HD2 LEU 106 -2.889 -4.315 -9.297 836 3HD2 LEU 106 3HD2 LEU 106 -1.665 -5.063 -10.324 837 H GLY 107 H GLY 107 -3.437 -4.106 -5.316 838 1HA GLY 107 1HA GLY 107 -6.110 -4.985 -5.037 839 2HA GLY 107 2HA GLY 107 -5.320 -5.011 -3.468 840 H PHE 108 H PHE 108 -6.913 -3.407 -2.854 841 HA PHE 108 HA PHE 108 -6.160 -0.707 -3.767 842 1HB PHE 108 1HB PHE 108 -8.874 -1.811 -3.059 843 2HB PHE 108 2HB PHE 108 -8.546 -0.083 -3.093 844 HD1 PHE 108 HD1 PHE 108 -8.383 1.100 -5.139 845 HD2 PHE 108 HD2 PHE 108 -8.708 -3.142 -5.135 846 HE1 PHE 108 HE1 PHE 108 -8.811 1.134 -7.562 847 HE2 PHE 108 HE2 PHE 108 -9.137 -3.116 -7.558 848 HZ PHE 108 HZ PHE 108 -9.188 -0.976 -8.775 849 H THR 109 H THR 109 -6.159 0.956 -2.201 850 HA THR 109 HA THR 109 -6.277 0.061 0.597 851 HB THR 109 HB THR 109 -4.303 1.818 0.835 852 HG1 THR 109 HG1 THR 109 -4.191 2.342 -1.356 853 1HG2 THR 109 1HG2 THR 109 -3.648 -0.900 -0.254 854 2HG2 THR 109 2HG2 THR 109 -4.233 -0.633 1.388 855 3HG2 THR 109 3HG2 THR 109 -2.708 0.085 0.867 856 H ALA 110 H ALA 110 -7.140 1.493 2.030 857 HA ALA 110 HA ALA 110 -7.955 4.118 0.963 858 1HB ALA 110 1HB ALA 110 -9.645 2.917 3.059 859 2HB ALA 110 2HB ALA 110 -9.700 2.134 1.480 860 3HB ALA 110 3HB ALA 110 -10.095 3.847 1.629 861 H GLY 111 H GLY 111 -8.093 5.845 2.470 862 1HA GLY 111 1HA GLY 111 -6.940 5.361 5.123 863 2HA GLY 111 2HA GLY 111 -6.120 6.493 4.059 864 H VAL 112 H VAL 112 -7.135 7.184 6.585 865 HA VAL 112 HA VAL 112 -8.973 9.299 5.790 866 HB VAL 112 HB VAL 112 -10.383 8.875 7.845 867 1HG1 VAL 112 1HG1 VAL 112 -11.758 7.142 6.735 868 2HG1 VAL 112 2HG1 VAL 112 -10.435 6.860 5.603 869 3HG1 VAL 112 3HG1 VAL 112 -11.247 8.427 5.639 870 1HG2 VAL 112 1HG2 VAL 112 -9.195 7.390 9.169 871 2HG2 VAL 112 2HG2 VAL 112 -8.758 6.364 7.804 872 3HG2 VAL 112 3HG2 VAL 112 -10.408 6.347 8.427 873 H THR 113 H THR 113 -8.070 11.115 6.479 874 HA THR 113 HA THR 113 -6.258 11.067 8.760 875 HB THR 113 HB THR 113 -6.835 13.584 7.278 876 HG1 THR 113 HG1 THR 113 -5.531 11.334 6.173 877 1HG2 THR 113 1HG2 THR 113 -5.133 13.754 8.905 878 2HG2 THR 113 2HG2 THR 113 -4.336 13.725 7.332 879 3HG2 THR 113 3HG2 THR 113 -4.352 12.277 8.341 880 H ALA 114 H ALA 114 -7.077 11.370 10.717 881 HA ALA 114 HA ALA 114 -9.591 12.764 11.083 882 1HB ALA 114 1HB ALA 114 -9.455 10.859 12.414 883 2HB ALA 114 2HB ALA 114 -9.104 12.171 13.539 884 3HB ALA 114 3HB ALA 114 -7.790 11.191 12.888 885 H ARG 115 H ARG 115 -9.841 14.467 12.690 886 HA ARG 115 HA ARG 115 -7.911 16.538 12.320 887 1HB ARG 115 1HB ARG 115 -9.411 17.806 13.910 888 2HB ARG 115 2HB ARG 115 -10.187 17.206 12.450 889 1HG ARG 115 1HG ARG 115 -10.426 15.218 14.465 890 2HG ARG 115 2HG ARG 115 -10.918 16.769 15.149 891 1HD ARG 115 1HD ARG 115 -12.887 15.931 14.233 892 2HD ARG 115 2HD ARG 115 -12.299 17.039 12.996 893 HE ARG 115 HE ARG 115 -12.010 15.260 11.586 894 1HH1 ARG 115 1HH1 ARG 115 -12.405 14.066 14.842 895 2HH1 ARG 115 2HH1 ARG 115 -12.505 12.408 14.356 896 1HH2 ARG 115 1HH2 ARG 115 -12.142 13.079 10.945 897 2HH2 ARG 115 2HH2 ARG 115 -12.355 11.847 12.142 898 H ASP 116 H ASP 116 -7.515 17.899 14.520 899 HA ASP 116 HA ASP 116 -6.237 16.014 16.392 900 1HB ASP 116 1HB ASP 116 -4.550 17.819 16.789 901 2HB ASP 116 2HB ASP 116 -4.530 17.175 15.150 902 HD2 ASP 116 HD2 ASP 116 -5.166 20.976 15.642 903 H ASN 117 H ASN 117 -7.747 19.207 16.077 904 HA ASN 117 HA ASN 117 -8.605 18.978 18.882 905 1HB ASN 117 1HB ASN 117 -8.340 21.439 19.101 906 2HB ASN 117 2HB ASN 117 -6.811 20.608 18.827 907 1HD2 ASN 117 1HD2 ASN 117 -6.832 23.217 18.377 908 2HD2 ASN 117 2HD2 ASN 117 -6.815 23.569 16.686 909 H TRP 118 H TRP 118 -9.978 18.309 16.392 910 HA TRP 118 HA TRP 118 -12.031 18.528 15.436 911 1HB TRP 118 1HB TRP 118 -12.510 19.964 18.045 912 2HB TRP 118 2HB TRP 118 -13.787 19.700 16.862 913 HD1 TRP 118 HD1 TRP 118 -12.921 16.683 16.077 914 HE1 TRP 118 HE1 TRP 118 -13.417 14.794 17.753 915 HE3 TRP 118 HE3 TRP 118 -13.381 19.474 20.335 916 HZ2 TRP 118 HZ2 TRP 118 -13.936 14.523 20.514 917 HZ3 TRP 118 HZ3 TRP 118 -13.879 18.323 22.452 918 HH2 TRP 118 HH2 TRP 118 -14.150 15.898 22.538 919 H ASN 119 H ASN 119 -11.194 19.772 13.705 920 HA ASN 119 HA ASN 119 -12.251 22.492 13.661 921 1HB ASN 119 1HB ASN 119 -9.747 22.459 14.292 922 2HB ASN 119 2HB ASN 119 -9.473 21.990 12.616 923 1HD2 ASN 119 1HD2 ASN 119 -8.407 23.848 12.061 924 2HD2 ASN 119 2HD2 ASN 119 -9.187 25.385 11.946 925 H TYR 120 H TYR 120 -10.611 19.936 11.817 926 HA TYR 120 HA TYR 120 -12.275 20.671 9.497 927 1HB TYR 120 1HB TYR 120 -9.796 21.040 9.227 928 2HB TYR 120 2HB TYR 120 -9.586 19.299 9.387 929 HD1 TYR 120 HD1 TYR 120 -11.533 21.773 7.375 930 HD2 TYR 120 HD2 TYR 120 -9.537 18.017 7.464 931 HE1 TYR 120 HE1 TYR 120 -11.933 21.511 4.962 932 HE2 TYR 120 HE2 TYR 120 -9.930 17.745 5.052 933 HH TYR 120 HH TYR 120 -10.681 20.127 3.028 934 H ILE 121 H ILE 121 -13.215 19.019 8.293 935 HA ILE 121 HA ILE 121 -13.918 16.678 9.763 936 HB ILE 121 HB ILE 121 -15.068 16.010 7.612 937 1HG1 ILE 121 1HG1 ILE 121 -14.744 18.767 6.586 938 2HG1 ILE 121 2HG1 ILE 121 -13.344 17.715 6.406 939 1HG2 ILE 121 1HG2 ILE 121 -16.543 16.980 9.051 940 2HG2 ILE 121 2HG2 ILE 121 -16.590 18.171 7.751 941 3HG2 ILE 121 3HG2 ILE 121 -15.605 18.469 9.184 942 1HD1 ILE 121 1HD1 ILE 121 -14.310 17.058 4.514 943 2HD1 ILE 121 2HD1 ILE 121 -15.876 17.723 4.978 944 3HD1 ILE 121 3HD1 ILE 121 -15.393 16.123 5.543 945 HA PRO 122 HA PRO 122 -10.941 13.658 8.594 946 1HB PRO 122 1HB PRO 122 -12.594 11.616 7.669 947 2HB PRO 122 2HB PRO 122 -12.144 11.886 9.354 948 1HG PRO 122 1HG PRO 122 -14.629 12.680 7.904 949 2HG PRO 122 2HG PRO 122 -14.435 12.097 9.568 950 1HD PRO 122 1HD PRO 122 -14.842 14.690 9.043 951 2HD PRO 122 2HD PRO 122 -13.749 14.176 10.347 952 H LEU 123 H LEU 123 -9.730 13.196 6.835 953 HA LEU 123 HA LEU 123 -10.884 13.851 4.212 954 1HB LEU 123 1HB LEU 123 -8.881 15.128 5.095 955 2HB LEU 123 2HB LEU 123 -7.961 13.647 4.908 956 HG LEU 123 HG LEU 123 -8.814 13.751 2.437 957 1HD1 LEU 123 1HD1 LEU 123 -9.520 15.752 1.600 958 2HD1 LEU 123 2HD1 LEU 123 -8.732 16.690 2.869 959 3HD1 LEU 123 3HD1 LEU 123 -10.235 15.831 3.210 960 1HD2 LEU 123 1HD2 LEU 123 -6.557 13.886 2.535 961 2HD2 LEU 123 2HD2 LEU 123 -6.576 15.122 3.794 962 3HD2 LEU 123 3HD2 LEU 123 -6.879 15.569 2.115 963 HA PRO 124 HA PRO 124 -10.411 9.292 3.926 964 1HB PRO 124 1HB PRO 124 -12.468 8.932 2.201 965 2HB PRO 124 2HB PRO 124 -12.703 9.071 3.948 966 1HG PRO 124 1HG PRO 124 -13.046 11.148 1.820 967 2HG PRO 124 2HG PRO 124 -14.086 10.790 3.212 968 1HD PRO 124 1HD PRO 124 -12.317 12.847 3.193 969 2HD PRO 124 2HD PRO 124 -12.749 11.967 4.672 970 H VAL 125 H VAL 125 -9.714 7.972 2.187 971 HA VAL 125 HA VAL 125 -9.359 9.168 -0.432 972 HB VAL 125 HB VAL 125 -6.892 8.557 -0.415 973 1HG1 VAL 125 1HG1 VAL 125 -7.835 10.835 1.323 974 2HG1 VAL 125 2HG1 VAL 125 -7.651 10.862 -0.431 975 3HG1 VAL 125 3HG1 VAL 125 -6.231 10.697 0.602 976 1HG2 VAL 125 1HG2 VAL 125 -7.333 8.647 2.569 977 2HG2 VAL 125 2HG2 VAL 125 -5.770 8.561 1.757 978 3HG2 VAL 125 3HG2 VAL 125 -6.905 7.217 1.628 979 H LEU 126 H LEU 126 -9.056 7.672 -2.063 980 HA LEU 126 HA LEU 126 -8.727 4.863 -1.335 981 1HB LEU 126 1HB LEU 126 -11.049 5.937 -2.936 982 2HB LEU 126 2HB LEU 126 -10.635 4.238 -2.817 983 HG LEU 126 HG LEU 126 -11.050 5.668 -0.257 984 1HD1 LEU 126 1HD1 LEU 126 -13.439 4.800 -1.846 985 2HD1 LEU 126 2HD1 LEU 126 -12.843 6.459 -1.900 986 3HD1 LEU 126 3HD1 LEU 126 -13.380 5.764 -0.370 987 1HD2 LEU 126 1HD2 LEU 126 -11.798 3.591 0.484 988 2HD2 LEU 126 2HD2 LEU 126 -10.515 3.185 -0.656 989 3HD2 LEU 126 3HD2 LEU 126 -12.205 3.050 -1.145 990 H LEU 127 H LEU 127 -7.090 4.167 -2.528 991 HA LEU 127 HA LEU 127 -7.085 4.668 -5.394 992 1HB LEU 127 1HB LEU 127 -4.615 5.232 -5.277 993 2HB LEU 127 2HB LEU 127 -5.734 6.483 -4.767 994 HG LEU 127 HG LEU 127 -5.264 5.417 -2.376 995 1HD1 LEU 127 1HD1 LEU 127 -2.681 5.016 -2.436 996 2HD1 LEU 127 2HD1 LEU 127 -3.001 4.535 -4.103 997 3HD1 LEU 127 3HD1 LEU 127 -3.799 3.696 -2.773 998 1HD2 LEU 127 1HD2 LEU 127 -4.113 7.321 -1.945 999 2HD2 LEU 127 2HD2 LEU 127 -4.696 7.746 -3.554 1000 3HD2 LEU 127 3HD2 LEU 127 -3.057 7.132 -3.344 1001 HA PRO 128 HA PRO 128 -5.626 0.512 -5.548 1002 1HB PRO 128 1HB PRO 128 -4.163 0.509 -7.828 1003 2HB PRO 128 2HB PRO 128 -5.928 0.610 -7.826 1004 1HG PRO 128 1HG PRO 128 -3.906 2.797 -8.126 1005 2HG PRO 128 2HG PRO 128 -5.411 2.533 -9.027 1006 1HD PRO 128 1HD PRO 128 -5.213 4.323 -7.000 1007 2HD PRO 128 2HD PRO 128 -6.715 3.450 -7.364 1008 H LEU 129 H LEU 129 -3.904 -0.770 -4.975 1009 HA LEU 129 HA LEU 129 -1.233 0.411 -4.873 1010 1HB LEU 129 1HB LEU 129 -2.239 0.914 -2.702 1011 2HB LEU 129 2HB LEU 129 -2.634 -0.780 -2.478 1012 HG LEU 129 HG LEU 129 0.225 -0.089 -2.919 1013 1HD1 LEU 129 1HD1 LEU 129 0.621 0.664 -0.747 1014 2HD1 LEU 129 2HD1 LEU 129 -0.981 0.182 -0.188 1015 3HD1 LEU 129 3HD1 LEU 129 -0.803 1.570 -1.260 1016 1HD2 LEU 129 1HD2 LEU 129 0.090 -2.325 -2.595 1017 2HD2 LEU 129 2HD2 LEU 129 -1.397 -2.212 -1.654 1018 3HD2 LEU 129 3HD2 LEU 129 0.154 -1.841 -0.901 1019 H ALA 130 H ALA 130 0.452 -1.094 -4.852 1020 HA ALA 130 HA ALA 130 -0.355 -3.906 -5.205 1021 1HB ALA 130 1HB ALA 130 0.998 -4.179 -7.067 1022 2HB ALA 130 2HB ALA 130 1.958 -2.745 -6.707 1023 3HB ALA 130 3HB ALA 130 0.314 -2.574 -7.321 1024 H SER 131 H SER 131 0.984 -5.461 -4.346 1025 HA SER 131 HA SER 131 3.322 -4.505 -2.836 1026 1HB SER 131 1HB SER 131 2.744 -5.802 -0.946 1027 2HB SER 131 2HB SER 131 1.239 -5.023 -1.431 1028 HG SER 131 HG SER 131 0.871 -7.050 -2.659 1029 H VAL 132 H VAL 132 5.083 -5.385 -3.683 1030 HA VAL 132 HA VAL 132 5.078 -8.251 -4.295 1031 HB VAL 132 HB VAL 132 6.423 -7.831 -6.348 1032 1HG1 VAL 132 1HG1 VAL 132 3.575 -7.237 -6.002 1033 2HG1 VAL 132 2HG1 VAL 132 4.378 -8.339 -7.119 1034 3HG1 VAL 132 3HG1 VAL 132 4.272 -6.620 -7.498 1035 1HG2 VAL 132 1HG2 VAL 132 7.327 -5.756 -6.370 1036 2HG2 VAL 132 2HG2 VAL 132 5.968 -5.035 -5.508 1037 3HG2 VAL 132 3HG2 VAL 132 5.839 -5.369 -7.235 1038 H GLY 133 H GLY 133 6.839 -9.277 -3.553 1039 1HA GLY 133 1HA GLY 133 9.449 -8.609 -3.560 1040 2HA GLY 133 2HA GLY 133 8.851 -7.721 -2.167 1041 H TYR 134 H TYR 134 10.218 -8.958 -0.812 1042 HA TYR 134 HA TYR 134 9.895 -11.813 -0.653 1043 1HB TYR 134 1HB TYR 134 11.394 -9.831 1.064 1044 2HB TYR 134 2HB TYR 134 11.386 -11.565 1.368 1045 HD1 TYR 134 HD1 TYR 134 12.051 -13.038 -0.741 1046 HD2 TYR 134 HD2 TYR 134 13.121 -8.956 -0.192 1047 HE1 TYR 134 HE1 TYR 134 13.924 -13.325 -2.308 1048 HE2 TYR 134 HE2 TYR 134 14.997 -9.232 -1.758 1049 HH TYR 134 HH TYR 134 15.284 -11.674 -3.875 1050 H GLY 135 H GLY 135 8.957 -12.989 1.027 1051 1HA GLY 135 1HA GLY 135 6.512 -12.208 1.985 1052 2HA GLY 135 2HA GLY 135 7.503 -13.438 2.754 1053 HA PRO 136 HA PRO 136 8.305 -10.961 6.308 1054 1HB PRO 136 1HB PRO 136 11.013 -10.502 6.383 1055 2HB PRO 136 2HB PRO 136 10.250 -12.021 6.864 1056 1HG PRO 136 1HG PRO 136 11.577 -11.300 4.283 1057 2HG PRO 136 2HG PRO 136 11.672 -12.810 5.209 1058 1HD PRO 136 1HD PRO 136 10.121 -12.588 3.027 1059 2HD PRO 136 2HD PRO 136 9.629 -13.569 4.424 1060 H VAL 137 H VAL 137 9.828 -9.745 3.382 1061 HA VAL 137 HA VAL 137 9.113 -7.023 4.206 1062 HB VAL 137 HB VAL 137 11.507 -7.268 4.674 1063 1HG1 VAL 137 1HG1 VAL 137 11.992 -7.670 1.741 1064 2HG1 VAL 137 2HG1 VAL 137 11.793 -9.035 2.841 1065 3HG1 VAL 137 3HG1 VAL 137 13.108 -7.886 3.089 1066 1HG2 VAL 137 1HG2 VAL 137 10.849 -5.082 4.069 1067 2HG2 VAL 137 2HG2 VAL 137 10.747 -5.503 2.360 1068 3HG2 VAL 137 3HG2 VAL 137 12.319 -5.413 3.154 1069 H THR 138 H THR 138 7.653 -6.408 2.752 1070 HA THR 138 HA THR 138 8.137 -7.068 -0.081 1071 HB THR 138 HB THR 138 5.745 -7.041 -0.435 1072 HG1 THR 138 HG1 THR 138 4.347 -6.717 1.357 1073 1HG2 THR 138 1HG2 THR 138 4.970 -8.828 1.127 1074 2HG2 THR 138 2HG2 THR 138 6.520 -8.683 1.957 1075 3HG2 THR 138 3HG2 THR 138 6.467 -9.184 0.266 1076 H PHE 139 H PHE 139 7.760 -5.480 -1.640 1077 HA PHE 139 HA PHE 139 8.046 -2.759 -0.647 1078 1HB PHE 139 1HB PHE 139 8.758 -4.202 -3.091 1079 2HB PHE 139 2HB PHE 139 8.072 -2.612 -3.408 1080 HD1 PHE 139 HD1 PHE 139 10.862 -4.444 -1.917 1081 HD2 PHE 139 HD2 PHE 139 9.223 -0.604 -2.734 1082 HE1 PHE 139 HE1 PHE 139 13.036 -3.413 -1.408 1083 HE2 PHE 139 HE2 PHE 139 11.395 0.436 -2.226 1084 HZ PHE 139 HZ PHE 139 13.305 -0.970 -1.563 1085 H GLN 140 H GLN 140 6.530 -1.207 -0.780 1086 HA GLN 140 HA GLN 140 3.939 -1.964 -1.938 1087 1HB GLN 140 1HB GLN 140 4.606 -0.894 0.556 1088 2HB GLN 140 2HB GLN 140 3.901 0.450 -0.330 1089 1HG GLN 140 1HG GLN 140 1.948 -0.350 0.370 1090 2HG GLN 140 2HG GLN 140 2.155 -1.570 -0.885 1091 1HE2 GLN 140 1HE2 GLN 140 0.742 -1.732 1.660 1092 2HE2 GLN 140 2HE2 GLN 140 1.457 -3.047 2.522 1093 H MET 141 H MET 141 3.123 -0.896 -3.630 1094 HA MET 141 HA MET 141 4.394 1.642 -4.417 1095 1HB MET 141 1HB MET 141 3.687 -0.741 -6.112 1096 2HB MET 141 2HB MET 141 3.849 0.864 -6.812 1097 1HG MET 141 1HG MET 141 6.079 -0.003 -5.104 1098 2HG MET 141 2HG MET 141 5.860 -0.913 -6.598 1099 1HE MET 141 1HE MET 141 4.930 0.772 -8.738 1100 2HE MET 141 2HE MET 141 6.510 0.035 -9.010 1101 3HE MET 141 3HE MET 141 6.263 1.745 -9.360 1102 H THR 142 H THR 142 2.988 3.254 -4.375 1103 HA THR 142 HA THR 142 0.130 2.665 -4.646 1104 HB THR 142 HB THR 142 0.031 5.179 -3.894 1105 HG1 THR 142 HG1 THR 142 1.853 6.010 -3.313 1106 1HG2 THR 142 1HG2 THR 142 -0.741 3.358 -2.482 1107 2HG2 THR 142 2HG2 THR 142 0.141 4.565 -1.546 1108 3HG2 THR 142 3HG2 THR 142 0.918 3.040 -1.973 1109 H TYR 143 H TYR 143 -1.031 3.309 -6.353 1110 HA TYR 143 HA TYR 143 0.131 5.292 -8.183 1111 1HB TYR 143 1HB TYR 143 0.545 3.034 -9.090 1112 2HB TYR 143 2HB TYR 143 -1.183 2.700 -9.027 1113 HD1 TYR 143 HD1 TYR 143 1.487 4.397 -10.830 1114 HD2 TYR 143 HD2 TYR 143 -2.723 3.832 -10.578 1115 HE1 TYR 143 HE1 TYR 143 1.232 5.333 -13.090 1116 HE2 TYR 143 HE2 TYR 143 -2.989 4.766 -12.837 1117 HH TYR 143 HH TYR 143 -1.800 6.217 -14.382 1118 H ILE 144 H ILE 144 -1.446 6.306 -9.612 1119 HA ILE 144 HA ILE 144 -4.228 6.096 -8.721 1120 HB ILE 144 HB ILE 144 -4.470 8.530 -8.621 1121 1HG1 ILE 144 1HG1 ILE 144 -2.554 9.034 -10.160 1122 2HG1 ILE 144 2HG1 ILE 144 -2.585 10.022 -8.703 1123 1HG2 ILE 144 1HG2 ILE 144 -2.431 7.262 -6.818 1124 2HG2 ILE 144 2HG2 ILE 144 -4.153 7.511 -6.528 1125 3HG2 ILE 144 3HG2 ILE 144 -3.052 8.889 -6.542 1126 1HD1 ILE 144 1HD1 ILE 144 -0.463 9.465 -8.411 1127 2HD1 ILE 144 2HD1 ILE 144 -0.543 8.247 -9.684 1128 3HD1 ILE 144 3HD1 ILE 144 -1.013 7.832 -8.036 1129 HA PRO 145 HA PRO 145 -5.049 6.361 -13.058 1130 1HB PRO 145 1HB PRO 145 -7.623 7.198 -13.020 1131 2HB PRO 145 2HB PRO 145 -7.148 5.558 -12.562 1132 1HG PRO 145 1HG PRO 145 -7.771 7.909 -10.816 1133 2HG PRO 145 2HG PRO 145 -8.262 6.214 -10.629 1134 1HD PRO 145 1HD PRO 145 -6.203 7.309 -9.240 1135 2HD PRO 145 2HD PRO 145 -6.241 5.599 -9.713 1136 H GLY 146 H GLY 146 -5.864 7.896 -14.745 1137 1HA GLY 146 1HA GLY 146 -5.796 10.713 -13.974 1138 2HA GLY 146 2HA GLY 146 -4.530 10.155 -15.057 1139 H THR 147 H THR 147 -5.485 11.837 -16.463 1140 HA THR 147 HA THR 147 -8.000 11.040 -17.733 1141 HB THR 147 HB THR 147 -7.388 13.314 -19.007 1142 HG1 THR 147 HG1 THR 147 -5.384 13.411 -17.742 1143 1HG2 THR 147 1HG2 THR 147 -9.078 14.216 -17.877 1144 2HG2 THR 147 2HG2 THR 147 -8.295 13.962 -16.317 1145 3HG2 THR 147 3HG2 THR 147 -9.194 12.649 -17.078 1146 H TYR 148 H TYR 148 -4.576 11.416 -18.377 1147 HA TYR 148 HA TYR 148 -4.625 9.607 -20.545 1148 1HB TYR 148 1HB TYR 148 -5.535 12.000 -21.384 1149 2HB TYR 148 2HB TYR 148 -3.807 12.258 -21.593 1150 HD1 TYR 148 HD1 TYR 148 -6.755 10.887 -23.025 1151 HD2 TYR 148 HD2 TYR 148 -2.522 10.469 -22.948 1152 HE1 TYR 148 HE1 TYR 148 -6.841 9.674 -25.162 1153 HE2 TYR 148 HE2 TYR 148 -2.596 9.256 -25.085 1154 HH TYR 148 HH TYR 148 -4.394 9.260 -27.143 1155 H ASN 149 H ASN 149 -2.854 12.527 -19.511 1156 HA ASN 149 HA ASN 149 -0.342 11.042 -19.775 1157 1HB ASN 149 1HB ASN 149 0.716 13.295 -19.476 1158 2HB ASN 149 2HB ASN 149 -0.328 13.175 -20.889 1159 1HD2 ASN 149 1HD2 ASN 149 0.561 15.257 -18.680 1160 2HD2 ASN 149 2HD2 ASN 149 -0.902 16.139 -18.424 1161 H ASN 150 H ASN 150 0.381 10.042 -18.025 1162 HA ASN 150 HA ASN 150 -0.330 11.088 -15.379 1163 1HB ASN 150 1HB ASN 150 0.376 8.390 -16.437 1164 2HB ASN 150 2HB ASN 150 0.779 8.750 -14.761 1165 1HD2 ASN 150 1HD2 ASN 150 -1.963 9.458 -16.903 1166 2HD2 ASN 150 2HD2 ASN 150 -3.176 8.877 -15.819 1167 H GLY 151 H GLY 151 2.410 10.256 -17.415 1168 1HA GLY 151 1HA GLY 151 4.555 11.148 -17.321 1169 2HA GLY 151 2HA GLY 151 4.124 11.953 -15.821 1170 H ASN 152 H ASN 152 3.550 8.549 -16.159 1171 HA ASN 152 HA ASN 152 4.390 6.742 -15.065 1172 1HB ASN 152 1HB ASN 152 6.385 7.566 -16.548 1173 2HB ASN 152 2HB ASN 152 7.097 8.032 -15.006 1174 1HD2 ASN 152 1HD2 ASN 152 8.305 6.565 -14.065 1175 2HD2 ASN 152 2HD2 ASN 152 8.214 4.856 -14.309 1176 H VAL 153 H VAL 153 3.270 8.754 -13.448 1177 HA VAL 153 HA VAL 153 4.943 9.318 -11.205 1178 HB VAL 153 HB VAL 153 3.023 10.744 -11.773 1179 1HG1 VAL 153 1HG1 VAL 153 0.811 10.080 -11.684 1180 2HG1 VAL 153 2HG1 VAL 153 1.161 8.686 -10.663 1181 3HG1 VAL 153 3HG1 VAL 153 1.598 8.659 -12.372 1182 1HG2 VAL 153 1HG2 VAL 153 2.896 9.433 -9.061 1183 2HG2 VAL 153 2HG2 VAL 153 2.082 10.941 -9.480 1184 3HG2 VAL 153 3HG2 VAL 153 3.843 10.849 -9.518 1185 H TYR 154 H TYR 154 5.650 7.795 -9.867 1186 HA TYR 154 HA TYR 154 3.734 5.830 -8.838 1187 1HB TYR 154 1HB TYR 154 6.330 5.269 -10.208 1188 2HB TYR 154 2HB TYR 154 5.836 4.227 -8.877 1189 HD1 TYR 154 HD1 TYR 154 3.925 2.749 -9.096 1190 HD2 TYR 154 HD2 TYR 154 5.081 5.300 -12.299 1191 HE1 TYR 154 HE1 TYR 154 2.491 1.466 -10.627 1192 HE2 TYR 154 HE2 TYR 154 3.650 4.025 -13.839 1193 HH TYR 154 HH TYR 154 1.266 2.037 -12.915 1194 H PHE 155 H PHE 155 4.026 5.251 -6.710 1195 HA PHE 155 HA PHE 155 6.122 6.735 -5.267 1196 1HB PHE 155 1HB PHE 155 3.254 6.266 -4.715 1197 2HB PHE 155 2HB PHE 155 4.327 6.145 -3.325 1198 HD1 PHE 155 HD1 PHE 155 4.676 8.053 -2.110 1199 HD2 PHE 155 HD2 PHE 155 3.770 8.392 -6.254 1200 HE1 PHE 155 HE1 PHE 155 4.691 10.505 -1.908 1201 HE2 PHE 155 HE2 PHE 155 3.784 10.846 -6.060 1202 HZ PHE 155 HZ PHE 155 4.245 11.904 -3.885 1203 H ALA 156 H ALA 156 7.277 5.709 -3.639 1204 HA ALA 156 HA ALA 156 7.144 2.773 -3.711 1205 1HB ALA 156 1HB ALA 156 9.396 2.687 -3.607 1206 2HB ALA 156 2HB ALA 156 9.505 4.069 -2.516 1207 3HB ALA 156 3HB ALA 156 9.276 4.326 -4.246 1208 H TRP 157 H TRP 157 7.680 1.631 -1.696 1209 HA TRP 157 HA TRP 157 7.487 2.994 0.810 1210 1HB TRP 157 1HB TRP 157 5.047 2.153 -0.465 1211 2HB TRP 157 2HB TRP 157 5.290 1.231 1.014 1212 HD1 TRP 157 HD1 TRP 157 5.746 2.824 3.289 1213 HE1 TRP 157 HE1 TRP 157 4.598 5.040 3.922 1214 HE3 TRP 157 HE3 TRP 157 3.992 4.176 -1.319 1215 HZ2 TRP 157 HZ2 TRP 157 3.143 7.090 2.638 1216 HZ3 TRP 157 HZ3 TRP 157 2.731 6.279 -1.531 1217 HH2 TRP 157 HH2 TRP 157 2.316 7.704 0.408 1218 H MET 158 H MET 158 7.279 1.354 2.646 1219 HA MET 158 HA MET 158 8.333 -1.276 1.894 1220 1HB MET 158 1HB MET 158 9.621 0.703 3.759 1221 2HB MET 158 2HB MET 158 9.932 -1.022 3.896 1222 1HG MET 158 1HG MET 158 10.618 -0.961 1.468 1223 2HG MET 158 2HG MET 158 10.569 0.796 1.594 1224 1HE MET 158 1HE MET 158 13.455 -2.064 1.938 1225 2HE MET 158 2HE MET 158 14.197 -0.580 1.339 1226 3HE MET 158 3HE MET 158 12.656 -1.126 0.676 1227 H ARG 159 H ARG 159 7.657 -2.936 3.166 1228 HA ARG 159 HA ARG 159 6.180 -2.280 5.619 1229 1HB ARG 159 1HB ARG 159 4.564 -2.599 3.775 1230 2HB ARG 159 2HB ARG 159 5.228 -4.202 3.488 1231 1HG ARG 159 1HG ARG 159 4.375 -5.043 5.494 1232 2HG ARG 159 2HG ARG 159 4.100 -3.430 6.155 1233 1HD ARG 159 1HD ARG 159 1.982 -4.352 5.526 1234 2HD ARG 159 2HD ARG 159 2.386 -3.069 4.385 1235 HE ARG 159 HE ARG 159 3.309 -5.290 3.156 1236 1HH1 ARG 159 1HH1 ARG 159 0.229 -4.462 4.571 1237 2HH1 ARG 159 2HH1 ARG 159 -0.679 -5.464 3.490 1238 1HH2 ARG 159 1HH2 ARG 159 2.117 -6.608 1.732 1239 2HH2 ARG 159 2HH2 ARG 159 0.393 -6.682 1.877 1240 H PHE 160 H PHE 160 6.848 -3.438 7.295 1241 HA PHE 160 HA PHE 160 8.434 -5.856 6.784 1242 1HB PHE 160 1HB PHE 160 8.350 -3.905 9.075 1243 2HB PHE 160 2HB PHE 160 9.085 -5.494 9.255 1244 HD1 PHE 160 HD1 PHE 160 11.368 -5.398 9.196 1245 HD2 PHE 160 HD2 PHE 160 9.141 -2.858 6.610 1246 HE1 PHE 160 HE1 PHE 160 13.467 -4.535 8.244 1247 HE2 PHE 160 HE2 PHE 160 11.235 -1.990 5.653 1248 HZ PHE 160 HZ PHE 160 13.401 -2.829 6.470 1249 H GLN 161 H GLN 161 8.034 -7.778 7.890 1250 HA GLN 161 HA GLN 161 5.436 -7.921 9.274 1251 1HB GLN 161 1HB GLN 161 6.627 -9.742 7.202 1252 2HB GLN 161 2HB GLN 161 5.429 -10.339 8.341 1253 1HG GLN 161 1HG GLN 161 3.959 -9.709 6.786 1254 2HG GLN 161 2HG GLN 161 4.211 -8.094 7.444 1255 1HE2 GLN 161 1HE2 GLN 161 3.351 -8.534 4.849 1256 2HE2 GLN 161 2HE2 GLN 161 4.583 -8.021 3.752 1257 H PHE 162 H PHE 162 5.390 -8.952 11.191 1258 HA PHE 162 HA PHE 162 7.701 -10.581 11.973 1259 1HB PHE 162 1HB PHE 162 6.478 -8.427 13.709 1260 2HB PHE 162 2HB PHE 162 7.802 -9.497 14.158 1261 HD1 PHE 162 HD1 PHE 162 6.873 -6.426 12.562 1262 HD2 PHE 162 HD2 PHE 162 9.976 -9.318 12.900 1263 HE1 PHE 162 HE1 PHE 162 8.483 -4.796 11.666 1264 HE2 PHE 162 HE2 PHE 162 11.593 -7.693 12.005 1265 HZ PHE 162 HZ PHE 162 10.847 -5.429 11.387 1266 H LEU 163 H LEU 163 7.190 -12.392 13.059 1267 HA LEU 163 HA LEU 163 4.362 -12.778 13.767 1268 1HB LEU 163 1HB LEU 163 5.578 -14.268 12.048 1269 2HB LEU 163 2HB LEU 163 6.380 -14.978 13.436 1270 HG LEU 163 HG LEU 163 3.877 -15.262 14.283 1271 1HD1 LEU 163 1HD1 LEU 163 2.433 -15.891 12.371 1272 2HD1 LEU 163 2HD1 LEU 163 3.644 -15.216 11.280 1273 3HD1 LEU 163 3HD1 LEU 163 2.810 -14.169 12.428 1274 1HD2 LEU 163 1HD2 LEU 163 5.422 -16.998 12.379 1275 2HD2 LEU 163 2HD2 LEU 163 3.906 -17.521 13.114 1276 3HD2 LEU 163 3HD2 LEU 163 5.294 -17.131 14.132 1277 H GLU 164 H GLU 164 3.822 -13.869 15.712 1278 HA GLU 164 HA GLU 164 5.955 -13.891 17.742 1279 1HB GLU 164 1HB GLU 164 3.108 -12.947 18.126 1280 2HB GLU 164 2HB GLU 164 4.321 -13.073 19.393 1281 1HG GLU 164 1HG GLU 164 4.796 -10.951 18.971 1282 2HG GLU 164 2HG GLU 164 5.557 -11.519 17.485 1283 HE2 GLU 164 HE2 GLU 164 3.024 -10.219 15.525 1284 H HIS 165 H HIS 165 6.268 -15.921 18.359 1285 HA HIS 165 HA HIS 165 4.493 -18.042 17.919 1286 1HB HIS 165 1HB HIS 165 7.087 -17.661 19.153 1287 2HB HIS 165 2HB HIS 165 6.121 -18.819 20.062 1288 HD1 HIS 165 HD1 HIS 165 8.694 -19.426 18.238 1289 HD2 HIS 165 HD2 HIS 165 4.717 -20.133 17.267 1290 HE1 HIS 165 HE1 HIS 165 8.741 -21.239 16.497 1291 HE2 HIS 165 HE2 HIS 165 6.328 -21.588 15.860 1292 H HIS 166 H HIS 166 4.171 -19.528 20.119 1293 HA HIS 166 HA HIS 166 3.005 -17.968 22.258 1294 1HB HIS 166 1HB HIS 166 1.389 -19.022 20.098 1295 2HB HIS 166 2HB HIS 166 0.915 -19.727 21.639 1296 HD1 HIS 166 HD1 HIS 166 -0.223 -18.192 23.341 1297 HD2 HIS 166 HD2 HIS 166 0.953 -16.241 19.867 1298 HE1 HIS 166 HE1 HIS 166 -1.331 -15.937 23.429 1299 HE2 HIS 166 HE2 HIS 166 -0.539 -14.744 21.357 1300 H HIS 167 H HIS 167 1.525 -19.860 23.530 1301 HA HIS 167 HA HIS 167 1.687 -21.641 24.935 1302 1HB HIS 167 1HB HIS 167 3.330 -22.749 22.651 1303 2HB HIS 167 2HB HIS 167 2.813 -23.692 24.044 1304 HD1 HIS 167 HD1 HIS 167 1.970 -23.844 20.850 1305 HD2 HIS 167 HD2 HIS 167 -0.329 -22.692 24.114 1306 HE1 HIS 167 HE1 HIS 167 -0.418 -24.196 20.147 1307 HE2 HIS 167 HE2 HIS 167 -1.788 -23.576 22.169 1308 H HIS 168 H HIS 168 2.786 -20.732 26.625 1309 HA HIS 168 HA HIS 168 4.466 -20.447 28.131 1310 1HB HIS 168 1HB HIS 168 4.903 -22.933 27.079 1311 2HB HIS 168 2HB HIS 168 6.443 -22.143 26.759 1312 HD1 HIS 168 HD1 HIS 168 4.253 -23.318 29.558 1313 HD2 HIS 168 HD2 HIS 168 7.996 -21.597 29.015 1314 HE1 HIS 168 HE1 HIS 168 5.405 -23.501 31.785 1315 HE2 HIS 168 HE2 HIS 168 7.702 -22.534 31.409 1316 H HIS 169 H HIS 169 5.908 -18.848 28.387 1317 HA HIS 169 HA HIS 169 7.943 -18.241 26.485 1318 1HB HIS 169 1HB HIS 169 5.581 -17.251 25.674 1319 2HB HIS 169 2HB HIS 169 6.078 -15.944 26.742 1320 HD1 HIS 169 HD1 HIS 169 7.675 -17.954 23.922 1321 HD2 HIS 169 HD2 HIS 169 7.524 -14.084 25.429 1322 HE1 HIS 169 HE1 HIS 169 9.064 -16.566 22.352 1323 HE2 HIS 169 HE2 HIS 169 8.885 -14.213 23.234 1324 H HIS 170 H HIS 170 7.705 -18.760 29.308 1325 HA HIS 170 HA HIS 170 9.455 -16.807 30.310 1326 1HB HIS 170 1HB HIS 170 6.980 -15.759 30.306 1327 2HB HIS 170 2HB HIS 170 6.932 -16.590 31.858 1328 HD1 HIS 170 HD1 HIS 170 8.922 -13.937 30.037 1329 HD2 HIS 170 HD2 HIS 170 8.224 -15.302 33.899 1330 HE1 HIS 170 HE1 HIS 170 10.026 -12.262 31.552 1331 HE2 HIS 170 HE2 HIS 170 9.664 -13.154 33.879 Start of MODEL 8 1 1H MET 1 1H MET 1 -3.375 1.693 42.596 2 2H MET 1 2H MET 1 -1.748 1.651 43.139 3 H MET 1 H MET 1 -3.031 1.172 44.079 4 3H MET 1 3H MET 1 -2.996 0.978 44.107 5 HA MET 1 HA MET 1 -2.002 0.014 41.514 6 1HB MET 1 1HB MET 1 -1.755 -0.787 44.378 7 2HB MET 1 2HB MET 1 -1.798 -2.058 43.165 8 1HG MET 1 1HG MET 1 0.252 -1.570 42.381 9 2HG MET 1 2HG MET 1 0.051 0.165 42.620 10 1HE MET 1 1HE MET 1 1.283 0.953 46.012 11 2HE MET 1 2HE MET 1 0.207 1.368 44.679 12 3HE MET 1 3HE MET 1 1.944 1.240 44.402 13 H ASN 2 H ASN 2 -4.323 -0.559 44.155 14 HA ASN 2 HA ASN 2 -6.371 -1.545 44.199 15 1HB ASN 2 1HB ASN 2 -6.204 -0.226 41.589 16 2HB ASN 2 2HB ASN 2 -7.344 -1.568 41.616 17 1HD2 ASN 2 1HD2 ASN 2 -9.298 -1.220 42.418 18 2HD2 ASN 2 2HD2 ASN 2 -9.780 0.173 43.318 19 H ALA 3 H ALA 3 -6.204 -3.647 44.665 20 HA ALA 3 HA ALA 3 -4.870 -5.583 43.153 21 1HB ALA 3 1HB ALA 3 -5.442 -7.024 44.797 22 2HB ALA 3 2HB ALA 3 -7.128 -6.507 44.815 23 3HB ALA 3 3HB ALA 3 -5.901 -5.539 45.631 24 H ASP 4 H ASP 4 -8.058 -4.269 42.837 25 HA ASP 4 HA ASP 4 -9.128 -6.435 41.288 26 1HB ASP 4 1HB ASP 4 -10.299 -4.447 42.671 27 2HB ASP 4 2HB ASP 4 -10.321 -3.726 41.065 28 HD2 ASP 4 HD2 ASP 4 -13.207 -5.495 40.544 29 H GLU 5 H GLU 5 -8.224 -3.080 40.490 30 HA GLU 5 HA GLU 5 -8.381 -3.499 37.682 31 1HB GLU 5 1HB GLU 5 -7.030 -1.319 39.282 32 2HB GLU 5 2HB GLU 5 -7.241 -1.289 37.536 33 1HG GLU 5 1HG GLU 5 -9.784 -1.726 38.351 34 2HG GLU 5 2HG GLU 5 -9.163 -0.753 39.684 35 HE2 GLU 5 HE2 GLU 5 -10.402 1.432 37.027 36 H TRP 6 H TRP 6 -5.908 -3.968 40.064 37 HA TRP 6 HA TRP 6 -3.681 -3.956 38.290 38 1HB TRP 6 1HB TRP 6 -3.454 -3.626 40.728 39 2HB TRP 6 2HB TRP 6 -3.966 -5.290 40.992 40 HD1 TRP 6 HD1 TRP 6 -1.377 -4.085 38.381 41 HE1 TRP 6 HE1 TRP 6 0.856 -5.269 38.869 42 HE3 TRP 6 HE3 TRP 6 -2.681 -6.540 42.673 43 HZ2 TRP 6 HZ2 TRP 6 1.923 -7.013 40.816 44 HZ3 TRP 6 HZ3 TRP 6 -0.995 -7.946 43.785 45 HH2 TRP 6 HH2 TRP 6 1.259 -8.176 42.875 46 H MET 7 H MET 7 -5.830 -6.466 39.528 47 HA MET 7 HA MET 7 -4.380 -8.606 38.274 48 1HB MET 7 1HB MET 7 -6.894 -8.355 39.852 49 2HB MET 7 2HB MET 7 -6.703 -9.776 38.834 50 1HG MET 7 1HG MET 7 -4.390 -9.123 40.521 51 2HG MET 7 2HG MET 7 -5.851 -9.596 41.386 52 1HE MET 7 1HE MET 7 -3.014 -10.336 39.244 53 2HE MET 7 2HE MET 7 -2.995 -12.075 38.959 54 3HE MET 7 3HE MET 7 -2.642 -11.441 40.567 55 H THR 8 H THR 8 -7.147 -6.603 37.491 56 HA THR 8 HA THR 8 -8.206 -8.098 35.376 57 HB THR 8 HB THR 8 -9.158 -5.928 34.598 58 HG1 THR 8 HG1 THR 8 -7.314 -4.663 35.285 59 1HG2 THR 8 1HG2 THR 8 -9.836 -5.392 37.255 60 2HG2 THR 8 2HG2 THR 8 -9.584 -7.136 37.156 61 3HG2 THR 8 3HG2 THR 8 -10.738 -6.348 36.080 62 H THR 9 H THR 9 -5.436 -5.985 35.544 63 HA THR 9 HA THR 9 -5.059 -5.447 32.830 64 HB THR 9 HB THR 9 -2.836 -5.907 34.819 65 HG1 THR 9 HG1 THR 9 -4.596 -3.716 34.533 66 1HG2 THR 9 1HG2 THR 9 -1.476 -4.789 33.456 67 2HG2 THR 9 2HG2 THR 9 -2.716 -3.612 33.024 68 3HG2 THR 9 3HG2 THR 9 -2.659 -5.174 32.207 69 H PHE 10 H PHE 10 -4.368 -8.300 34.720 70 HA PHE 10 HA PHE 10 -2.633 -9.563 32.871 71 1HB PHE 10 1HB PHE 10 -4.241 -10.461 35.227 72 2HB PHE 10 2HB PHE 10 -3.564 -11.677 34.150 73 HD1 PHE 10 HD1 PHE 10 -2.726 -8.879 36.402 74 HD2 PHE 10 HD2 PHE 10 -1.265 -12.209 34.193 75 HE1 PHE 10 HE1 PHE 10 -0.567 -8.700 37.568 76 HE2 PHE 10 HE2 PHE 10 0.898 -12.037 35.355 77 HZ PHE 10 HZ PHE 10 1.249 -10.280 37.045 78 H ARG 11 H ARG 11 -6.117 -9.935 33.499 79 HA ARG 11 HA ARG 11 -6.559 -11.812 31.429 80 1HB ARG 11 1HB ARG 11 -8.041 -10.890 33.511 81 2HB ARG 11 2HB ARG 11 -8.810 -10.052 32.170 82 1HG ARG 11 1HG ARG 11 -8.426 -13.028 32.418 83 2HG ARG 11 2HG ARG 11 -9.937 -12.143 32.644 84 1HD ARG 11 1HD ARG 11 -10.276 -12.658 30.480 85 2HD ARG 11 2HD ARG 11 -9.215 -11.280 30.186 86 HE ARG 11 HE ARG 11 -7.486 -13.343 30.404 87 1HH1 ARG 11 1HH1 ARG 11 -10.364 -12.847 28.494 88 2HH1 ARG 11 2HH1 ARG 11 -9.823 -13.851 27.190 89 1HH2 ARG 11 1HH2 ARG 11 -6.772 -14.662 28.691 90 2HH2 ARG 11 2HH2 ARG 11 -7.783 -14.882 27.302 91 H GLU 12 H GLU 12 -6.540 -8.315 31.536 92 HA GLU 12 HA GLU 12 -7.778 -7.921 28.998 93 1HB GLU 12 1HB GLU 12 -7.268 -6.284 31.074 94 2HB GLU 12 2HB GLU 12 -5.912 -5.865 30.037 95 1HG GLU 12 1HG GLU 12 -7.405 -5.265 28.246 96 2HG GLU 12 2HG GLU 12 -8.796 -5.807 29.184 97 HE2 GLU 12 HE2 GLU 12 -9.089 -2.689 30.539 98 H ASN 13 H ASN 13 -4.489 -8.393 30.094 99 HA ASN 13 HA ASN 13 -3.236 -7.595 27.660 100 1HB ASN 13 1HB ASN 13 -2.400 -8.810 30.215 101 2HB ASN 13 2HB ASN 13 -1.413 -9.253 28.825 102 1HD2 ASN 13 1HD2 ASN 13 -0.971 -7.515 31.234 103 2HD2 ASN 13 2HD2 ASN 13 -0.381 -6.026 30.587 104 H ILE 14 H ILE 14 -4.312 -10.682 28.996 105 HA ILE 14 HA ILE 14 -3.236 -12.253 26.862 106 HB ILE 14 HB ILE 14 -5.444 -13.032 28.767 107 1HG1 ILE 14 1HG1 ILE 14 -2.529 -13.657 29.165 108 2HG1 ILE 14 2HG1 ILE 14 -3.220 -12.157 29.778 109 1HG2 ILE 14 1HG2 ILE 14 -3.529 -14.611 27.065 110 2HG2 ILE 14 2HG2 ILE 14 -5.289 -14.574 26.965 111 3HG2 ILE 14 3HG2 ILE 14 -4.500 -15.320 28.355 112 1HD1 ILE 14 1HD1 ILE 14 -4.700 -13.335 31.212 113 2HD1 ILE 14 2HD1 ILE 14 -3.091 -14.025 31.426 114 3HD1 ILE 14 3HD1 ILE 14 -4.296 -14.877 30.460 115 H ALA 15 H ALA 15 -6.414 -10.899 27.615 116 HA ALA 15 HA ALA 15 -7.793 -12.136 25.471 117 1HB ALA 15 1HB ALA 15 -9.321 -11.403 26.970 118 2HB ALA 15 2HB ALA 15 -9.308 -9.976 25.935 119 3HB ALA 15 3HB ALA 15 -8.363 -9.993 27.424 120 H GLN 16 H GLN 16 -5.902 -9.212 25.754 121 HA GLN 16 HA GLN 16 -6.778 -8.044 23.299 122 1HB GLN 16 1HB GLN 16 -4.636 -7.493 25.292 123 2HB GLN 16 2HB GLN 16 -4.444 -6.812 23.683 124 1HG GLN 16 1HG GLN 16 -7.090 -6.422 24.890 125 2HG GLN 16 2HG GLN 16 -5.759 -5.611 25.711 126 1HE2 GLN 16 1HE2 GLN 16 -4.130 -4.797 23.796 127 2HE2 GLN 16 2HE2 GLN 16 -4.921 -3.726 22.695 128 H THR 17 H THR 17 -3.816 -9.771 24.262 129 HA THR 17 HA THR 17 -2.587 -9.755 21.745 130 HB THR 17 HB THR 17 -2.231 -12.048 23.641 131 HG1 THR 17 HG1 THR 17 -1.487 -9.358 24.077 132 1HG2 THR 17 1HG2 THR 17 0.228 -11.032 23.081 133 2HG2 THR 17 2HG2 THR 17 -0.644 -10.730 21.577 134 3HG2 THR 17 3HG2 THR 17 -0.542 -12.367 22.224 135 H TRP 18 H TRP 18 -4.956 -11.923 23.166 136 HA TRP 18 HA TRP 18 -4.790 -13.931 21.164 137 1HB TRP 18 1HB TRP 18 -6.286 -13.472 23.565 138 2HB TRP 18 2HB TRP 18 -7.399 -13.931 22.281 139 HD1 TRP 18 HD1 TRP 18 -6.194 -15.671 24.934 140 HE1 TRP 18 HE1 TRP 18 -5.446 -18.081 24.427 141 HE3 TRP 18 HE3 TRP 18 -5.628 -15.300 19.866 142 HZ2 TRP 18 HZ2 TRP 18 -4.711 -19.621 22.178 143 HZ3 TRP 18 HZ3 TRP 18 -4.900 -17.286 18.611 144 HH2 TRP 18 HH2 TRP 18 -4.451 -19.402 19.746 145 H GLN 19 H GLN 19 -7.175 -11.343 21.734 146 HA GLN 19 HA GLN 19 -8.691 -11.787 19.423 147 1HB GLN 19 1HB GLN 19 -8.370 -9.576 21.366 148 2HB GLN 19 2HB GLN 19 -9.048 -9.137 19.805 149 1HG GLN 19 1HG GLN 19 -11.000 -10.136 20.230 150 2HG GLN 19 2HG GLN 19 -10.236 -11.528 20.998 151 1HE2 GLN 19 1HE2 GLN 19 -11.815 -8.540 21.462 152 2HE2 GLN 19 2HE2 GLN 19 -11.774 -8.521 23.190 153 H GLN 20 H GLN 20 -5.778 -9.899 19.964 154 HA GLN 20 HA GLN 20 -5.761 -8.503 17.517 155 1HB GLN 20 1HB GLN 20 -3.775 -9.134 19.631 156 2HB GLN 20 2HB GLN 20 -3.135 -8.669 18.061 157 1HG GLN 20 1HG GLN 20 -4.685 -6.652 18.219 158 2HG GLN 20 2HG GLN 20 -4.863 -7.078 19.920 159 1HE2 GLN 20 1HE2 GLN 20 -3.414 -4.941 18.132 160 2HE2 GLN 20 2HE2 GLN 20 -1.897 -4.764 18.939 161 HA PRO 21 HA PRO 21 -4.776 -11.437 14.387 162 1HB PRO 21 1HB PRO 21 -2.603 -9.557 13.591 163 2HB PRO 21 2HB PRO 21 -3.893 -10.267 12.613 164 1HG PRO 21 1HG PRO 21 -4.023 -7.724 13.389 165 2HG PRO 21 2HG PRO 21 -5.475 -8.742 13.355 166 1HD PRO 21 1HD PRO 21 -3.841 -7.842 15.685 167 2HD PRO 21 2HD PRO 21 -5.595 -8.086 15.562 168 H GLU 22 H GLU 22 -2.725 -12.472 13.340 169 HA GLU 22 HA GLU 22 -0.933 -13.206 15.548 170 1HB GLU 22 1HB GLU 22 -2.421 -14.834 13.987 171 2HB GLU 22 2HB GLU 22 -0.928 -14.806 13.058 172 1HG GLU 22 1HG GLU 22 -0.613 -16.621 14.431 173 2HG GLU 22 2HG GLU 22 0.202 -15.338 15.326 174 HE2 GLU 22 HE2 GLU 22 -2.888 -17.116 16.952 175 H HIS 23 H HIS 23 -1.012 -11.985 12.274 176 HA HIS 23 HA HIS 23 1.914 -11.942 12.158 177 1HB HIS 23 1HB HIS 23 -0.180 -11.371 10.052 178 2HB HIS 23 2HB HIS 23 1.555 -11.231 9.786 179 HD1 HIS 23 HD1 HIS 23 -1.059 -13.479 9.142 180 HD2 HIS 23 HD2 HIS 23 2.808 -13.931 10.594 181 HE1 HIS 23 HE1 HIS 23 -0.470 -15.892 8.748 182 HE2 HIS 23 HE2 HIS 23 1.840 -16.163 9.716 183 H TYR 24 H TYR 24 3.072 -10.023 11.753 184 HA TYR 24 HA TYR 24 1.590 -7.530 12.248 185 1HB TYR 24 1HB TYR 24 3.917 -8.658 13.707 186 2HB TYR 24 2HB TYR 24 3.943 -6.927 13.393 187 HD1 TYR 24 HD1 TYR 24 1.847 -5.587 14.109 188 HD2 TYR 24 HD2 TYR 24 2.749 -9.491 15.541 189 HE1 TYR 24 HE1 TYR 24 0.376 -5.212 16.043 190 HE2 TYR 24 HE2 TYR 24 1.281 -9.127 17.479 191 HH TYR 24 HH TYR 24 -0.778 -7.603 17.968 192 H ASP 25 H ASP 25 2.165 -5.798 11.033 193 HA ASP 25 HA ASP 25 4.419 -6.164 9.168 194 1HB ASP 25 1HB ASP 25 1.663 -5.052 8.706 195 2HB ASP 25 2HB ASP 25 3.007 -4.592 7.665 196 HD2 ASP 25 HD2 ASP 25 1.296 -8.029 7.075 197 H LEU 26 H LEU 26 5.263 -4.070 8.289 198 HA LEU 26 HA LEU 26 4.970 -1.826 10.145 199 1HB LEU 26 1HB LEU 26 7.002 -3.439 10.590 200 2HB LEU 26 2HB LEU 26 7.715 -2.575 9.242 201 HG LEU 26 HG LEU 26 7.409 -0.447 10.464 202 1HD1 LEU 26 1HD1 LEU 26 7.046 -0.951 13.046 203 2HD1 LEU 26 2HD1 LEU 26 6.077 -2.268 12.386 204 3HD1 LEU 26 3HD1 LEU 26 5.705 -0.599 11.958 205 1HD2 LEU 26 1HD2 LEU 26 8.982 -1.267 12.469 206 2HD2 LEU 26 2HD2 LEU 26 9.551 -1.092 10.809 207 3HD2 LEU 26 3HD2 LEU 26 9.091 -2.681 11.420 208 H TYR 27 H TYR 27 4.919 0.103 9.156 209 HA TYR 27 HA TYR 27 5.620 0.177 6.295 210 1HB TYR 27 1HB TYR 27 3.181 0.682 7.382 211 2HB TYR 27 2HB TYR 27 3.872 2.301 7.373 212 HD1 TYR 27 HD1 TYR 27 4.270 3.470 5.306 213 HD2 TYR 27 HD2 TYR 27 2.799 -0.522 5.279 214 HE1 TYR 27 HE1 TYR 27 3.706 3.700 2.924 215 HE2 TYR 27 HE2 TYR 27 2.232 -0.303 2.896 216 HH TYR 27 HH TYR 27 1.782 1.400 1.259 217 H ILE 28 H ILE 28 7.483 1.179 5.946 218 HA ILE 28 HA ILE 28 8.079 3.608 7.504 219 HB ILE 28 HB ILE 28 10.145 1.643 6.514 220 1HG1 ILE 28 1HG1 ILE 28 9.785 1.990 9.415 221 2HG1 ILE 28 2HG1 ILE 28 8.438 1.196 8.608 222 1HG2 ILE 28 1HG2 ILE 28 10.880 3.988 6.706 223 2HG2 ILE 28 2HG2 ILE 28 11.704 2.923 7.845 224 3HG2 ILE 28 3HG2 ILE 28 10.405 3.976 8.404 225 1HD1 ILE 28 1HD1 ILE 28 11.078 0.192 9.250 226 2HD1 ILE 28 2HD1 ILE 28 10.640 -0.077 7.562 227 3HD1 ILE 28 3HD1 ILE 28 9.597 -0.679 8.851 228 HA PRO 29 HA PRO 29 8.332 5.485 3.480 229 1HB PRO 29 1HB PRO 29 9.558 7.799 4.182 230 2HB PRO 29 2HB PRO 29 7.856 7.475 4.529 231 1HG PRO 29 1HG PRO 29 10.236 7.238 6.332 232 2HG PRO 29 2HG PRO 29 8.635 7.917 6.677 233 1HD PRO 29 1HD PRO 29 9.356 5.424 7.449 234 2HD PRO 29 2HD PRO 29 7.688 5.844 7.015 235 H ALA 30 H ALA 30 9.783 5.599 1.829 236 HA ALA 30 HA ALA 30 12.497 4.710 2.406 237 1HB ALA 30 1HB ALA 30 10.851 3.838 0.539 238 2HB ALA 30 2HB ALA 30 12.592 3.906 0.269 239 3HB ALA 30 3HB ALA 30 11.550 5.175 -0.375 240 H ILE 31 H ILE 31 11.087 7.133 0.194 241 HA ILE 31 HA ILE 31 13.261 8.966 0.944 242 HB ILE 31 HB ILE 31 13.347 9.732 -1.437 243 1HG1 ILE 31 1HG1 ILE 31 12.126 7.117 -2.231 244 2HG1 ILE 31 2HG1 ILE 31 11.068 8.476 -1.865 245 1HG2 ILE 31 1HG2 ILE 31 14.297 7.125 -0.430 246 2HG2 ILE 31 2HG2 ILE 31 15.205 8.508 -1.041 247 3HG2 ILE 31 3HG2 ILE 31 14.434 7.391 -2.168 248 1HD1 ILE 31 1HD1 ILE 31 13.070 8.189 -4.064 249 2HD1 ILE 31 2HD1 ILE 31 12.515 9.779 -3.538 250 3HD1 ILE 31 3HD1 ILE 31 11.358 8.601 -4.158 251 H THR 32 H THR 32 12.773 11.174 0.829 252 HA THR 32 HA THR 32 9.910 11.793 0.499 253 HB THR 32 HB THR 32 11.824 13.160 2.397 254 HG1 THR 32 HG1 THR 32 11.323 10.939 2.943 255 1HG2 THR 32 1HG2 THR 32 10.230 14.635 2.768 256 2HG2 THR 32 2HG2 THR 32 9.101 13.342 3.172 257 3HG2 THR 32 3HG2 THR 32 9.252 13.891 1.503 258 H TRP 33 H TRP 33 12.966 13.609 0.807 259 HA TRP 33 HA TRP 33 12.055 15.512 -1.179 260 1HB TRP 33 1HB TRP 33 14.245 15.377 0.811 261 2HB TRP 33 2HB TRP 33 14.583 16.299 -0.651 262 HD1 TRP 33 HD1 TRP 33 12.823 16.536 2.638 263 HE1 TRP 33 HE1 TRP 33 11.610 18.798 2.821 264 HE3 TRP 33 HE3 TRP 33 13.236 18.076 -2.220 265 HZ2 TRP 33 HZ2 TRP 33 10.918 20.951 1.131 266 HZ3 TRP 33 HZ3 TRP 33 12.271 20.249 -2.854 267 HH2 TRP 33 HH2 TRP 33 11.137 21.656 -1.212 268 H HIS 34 H HIS 34 14.136 16.270 -2.611 269 HA HIS 34 HA HIS 34 14.387 14.277 -4.589 270 1HB HIS 34 1HB HIS 34 15.844 16.886 -4.162 271 2HB HIS 34 2HB HIS 34 16.106 15.862 -5.570 272 HD1 HIS 34 HD1 HIS 34 13.766 15.347 -6.953 273 HD2 HIS 34 HD2 HIS 34 13.877 18.708 -4.514 274 HE1 HIS 34 HE1 HIS 34 11.892 16.819 -7.753 275 HE2 HIS 34 HE2 HIS 34 11.919 18.804 -6.201 276 H ALA 35 H ALA 35 15.264 12.426 -3.638 277 HA ALA 35 HA ALA 35 18.081 12.206 -3.759 278 1HB ALA 35 1HB ALA 35 17.273 11.598 -0.986 279 2HB ALA 35 2HB ALA 35 17.388 13.308 -1.408 280 3HB ALA 35 3HB ALA 35 18.786 12.252 -1.612 281 H ARG 36 H ARG 36 18.828 10.000 -3.074 282 HA ARG 36 HA ARG 36 16.856 7.960 -2.665 283 1HB ARG 36 1HB ARG 36 17.070 8.711 -5.263 284 2HB ARG 36 2HB ARG 36 18.307 7.463 -5.190 285 1HG ARG 36 1HG ARG 36 16.645 5.881 -4.323 286 2HG ARG 36 2HG ARG 36 15.408 7.135 -4.442 287 1HD ARG 36 1HD ARG 36 16.495 7.168 -6.948 288 2HD ARG 36 2HD ARG 36 16.604 5.460 -6.526 289 HE ARG 36 HE ARG 36 14.266 6.854 -7.248 290 1HH1 ARG 36 1HH1 ARG 36 15.388 4.452 -4.977 291 2HH1 ARG 36 2HH1 ARG 36 13.841 3.688 -4.832 292 1HH2 ARG 36 1HH2 ARG 36 12.232 5.850 -7.057 293 2HH2 ARG 36 2HH2 ARG 36 12.049 4.480 -6.012 294 H PHE 37 H PHE 37 17.801 6.465 -1.455 295 HA PHE 37 HA PHE 37 19.374 5.156 -0.464 296 1HB PHE 37 1HB PHE 37 20.783 5.507 -3.118 297 2HB PHE 37 2HB PHE 37 21.235 4.335 -1.885 298 HD1 PHE 37 HD1 PHE 37 19.029 5.083 -4.630 299 HD2 PHE 37 HD2 PHE 37 19.654 2.495 -1.310 300 HE1 PHE 37 HE1 PHE 37 17.447 3.465 -5.598 301 HE2 PHE 37 HE2 PHE 37 18.075 0.872 -2.273 302 HZ PHE 37 HZ PHE 37 16.969 1.357 -4.419 303 H ALA 38 H ALA 38 19.798 6.849 1.057 304 HA ALA 38 HA ALA 38 21.761 8.837 0.681 305 1HB ALA 38 1HB ALA 38 20.919 7.639 3.314 306 2HB ALA 38 2HB ALA 38 19.981 8.849 2.437 307 3HB ALA 38 3HB ALA 38 21.596 9.242 3.029 308 H TYR 39 H TYR 39 23.628 7.921 -0.174 309 HA TYR 39 HA TYR 39 24.960 5.696 0.966 310 1HB TYR 39 1HB TYR 39 25.221 7.174 -1.353 311 2HB TYR 39 2HB TYR 39 26.687 7.577 -0.465 312 HD1 TYR 39 HD1 TYR 39 24.749 4.394 -0.729 313 HD2 TYR 39 HD2 TYR 39 28.438 6.400 -1.413 314 HE1 TYR 39 HE1 TYR 39 25.761 2.273 -1.452 315 HE2 TYR 39 HE2 TYR 39 29.461 4.284 -2.139 316 HH TYR 39 HH TYR 39 27.923 1.250 -1.690 317 H ASP 40 H ASP 40 27.265 5.872 1.784 318 HA ASP 40 HA ASP 40 27.263 7.459 4.150 319 1HB ASP 40 1HB ASP 40 29.067 5.449 2.912 320 2HB ASP 40 2HB ASP 40 29.792 6.560 4.071 321 HD2 ASP 40 HD2 ASP 40 28.074 3.554 5.577 322 H LYS 41 H LYS 41 27.478 9.604 3.974 323 HA LYS 41 HA LYS 41 29.021 10.875 1.944 324 1HB LYS 41 1HB LYS 41 27.004 11.690 3.562 325 2HB LYS 41 2HB LYS 41 28.381 12.415 4.382 326 1HG LYS 41 1HG LYS 41 28.892 13.094 1.806 327 2HG LYS 41 2HG LYS 41 27.128 13.105 1.825 328 1HD LYS 41 1HD LYS 41 27.377 15.203 2.598 329 2HD LYS 41 2HD LYS 41 27.689 14.408 4.142 330 1HE LYS 41 1HE LYS 41 30.048 14.545 3.822 331 2HE LYS 41 2HE LYS 41 29.848 15.077 2.153 332 1HZ LYS 41 1HZ LYS 41 30.271 16.740 4.178 333 2HZ LYS 41 2HZ LYS 41 28.579 16.733 4.174 334 3HZ LYS 41 3HZ LYS 41 29.426 17.182 2.780 335 H GLU 42 H GLU 42 29.712 9.693 5.122 336 HA GLU 42 HA GLU 42 31.668 9.494 6.270 337 1HB GLU 42 1HB GLU 42 32.492 9.447 3.686 338 2HB GLU 42 2HB GLU 42 33.345 10.872 4.264 339 1HG GLU 42 1HG GLU 42 34.909 9.340 4.789 340 2HG GLU 42 2HG GLU 42 33.937 9.199 6.254 341 HE2 GLU 42 HE2 GLU 42 33.253 5.921 5.578 342 H LYS 43 H LYS 43 32.121 12.503 4.403 343 HA LYS 43 HA LYS 43 33.077 13.917 6.694 344 1HB LYS 43 1HB LYS 43 32.571 14.540 3.839 345 2HB LYS 43 2HB LYS 43 32.556 15.899 4.954 346 1HG LYS 43 1HG LYS 43 34.754 15.869 4.318 347 2HG LYS 43 2HG LYS 43 34.813 14.877 5.776 348 1HD LYS 43 1HD LYS 43 34.361 12.930 4.056 349 2HD LYS 43 2HD LYS 43 35.066 14.079 2.917 350 1HE LYS 43 1HE LYS 43 37.013 13.166 3.577 351 2HE LYS 43 2HE LYS 43 36.833 14.248 4.957 352 1HZ LYS 43 1HZ LYS 43 35.541 11.642 5.150 353 2HZ LYS 43 2HZ LYS 43 36.328 12.551 6.340 354 3HZ LYS 43 3HZ LYS 43 37.232 11.657 5.224 355 H THR 44 H THR 44 31.173 13.393 8.053 356 HA THR 44 HA THR 44 29.093 15.447 7.710 357 HB THR 44 HB THR 44 28.603 12.687 8.838 358 HG1 THR 44 HG1 THR 44 28.988 12.451 6.661 359 1HG2 THR 44 1HG2 THR 44 26.300 13.969 7.753 360 2HG2 THR 44 2HG2 THR 44 27.057 15.026 8.944 361 3HG2 THR 44 3HG2 THR 44 26.587 13.387 9.392 362 H ASP 45 H ASP 45 29.201 16.858 9.314 363 HA ASP 45 HA ASP 45 30.436 16.097 11.841 364 1HB ASP 45 1HB ASP 45 29.869 18.657 10.442 365 2HB ASP 45 2HB ASP 45 29.889 18.695 12.202 366 HD2 ASP 45 HD2 ASP 45 33.295 18.839 12.140 367 H ARG 46 H ARG 46 27.350 17.202 10.561 368 HA ARG 46 HA ARG 46 26.133 17.272 13.191 369 1HB ARG 46 1HB ARG 46 25.617 18.742 11.050 370 2HB ARG 46 2HB ARG 46 24.526 17.415 10.680 371 1HG ARG 46 1HG ARG 46 23.198 18.951 11.814 372 2HG ARG 46 2HG ARG 46 23.607 17.750 13.041 373 1HD ARG 46 1HD ARG 46 24.272 19.470 14.298 374 2HD ARG 46 2HD ARG 46 25.667 19.569 13.227 375 HE ARG 46 HE ARG 46 24.797 21.484 12.317 376 1HH1 ARG 46 1HH1 ARG 46 22.323 19.887 14.191 377 2HH1 ARG 46 2HH1 ARG 46 21.211 21.210 14.081 378 1HH2 ARG 46 1HH2 ARG 46 23.335 23.225 12.172 379 2HH2 ARG 46 2HH2 ARG 46 21.784 23.105 12.935 380 H TYR 47 H TYR 47 24.394 15.940 13.847 381 HA TYR 47 HA TYR 47 24.704 13.202 13.161 382 1HB TYR 47 1HB TYR 47 23.756 14.473 15.343 383 2HB TYR 47 2HB TYR 47 22.234 14.043 14.569 384 HD1 TYR 47 HD1 TYR 47 25.525 12.413 15.300 385 HD2 TYR 47 HD2 TYR 47 21.286 12.064 15.257 386 HE1 TYR 47 HE1 TYR 47 25.709 10.141 16.221 387 HE2 TYR 47 HE2 TYR 47 21.458 9.791 16.179 388 HH TYR 47 HH TYR 47 23.946 7.946 16.074 389 H ASN 48 H ASN 48 23.124 11.780 12.262 390 HA ASN 48 HA ASN 48 21.361 13.117 10.320 391 1HB ASN 48 1HB ASN 48 23.049 10.666 10.180 392 2HB ASN 48 2HB ASN 48 21.537 10.670 9.278 393 1HD2 ASN 48 1HD2 ASN 48 23.974 13.157 9.948 394 2HD2 ASN 48 2HD2 ASN 48 24.266 13.560 8.294 395 H GLU 49 H GLU 49 19.315 13.105 10.971 396 HA GLU 49 HA GLU 49 18.299 10.724 12.376 397 1HB GLU 49 1HB GLU 49 17.748 13.633 12.661 398 2HB GLU 49 2HB GLU 49 16.401 12.530 12.910 399 1HG GLU 49 1HG GLU 49 17.221 11.753 14.854 400 2HG GLU 49 2HG GLU 49 18.894 11.825 14.303 401 HE2 GLU 49 HE2 GLU 49 19.378 14.761 15.979 402 H ARG 50 H ARG 50 16.067 10.113 11.931 403 HA ARG 50 HA ARG 50 15.442 10.479 9.092 404 1HB ARG 50 1HB ARG 50 14.511 8.424 11.103 405 2HB ARG 50 2HB ARG 50 13.928 8.511 9.447 406 1HG ARG 50 1HG ARG 50 15.882 7.729 8.566 407 2HG ARG 50 2HG ARG 50 16.860 8.351 9.898 408 1HD ARG 50 1HD ARG 50 16.807 6.366 10.889 409 2HD ARG 50 2HD ARG 50 15.045 6.415 10.932 410 HE ARG 50 HE ARG 50 16.684 4.899 9.145 411 1HH1 ARG 50 1HH1 ARG 50 13.596 6.488 9.480 412 2HH1 ARG 50 2HH1 ARG 50 12.812 5.488 8.304 413 1HH2 ARG 50 1HH2 ARG 50 15.656 3.582 7.596 414 2HH2 ARG 50 2HH2 ARG 50 13.981 3.838 7.235 415 HA PRO 51 HA PRO 51 11.856 12.921 9.864 416 1HB PRO 51 1HB PRO 51 10.163 12.070 7.921 417 2HB PRO 51 2HB PRO 51 11.580 13.072 7.587 418 1HG PRO 51 1HG PRO 51 11.245 10.109 7.304 419 2HG PRO 51 2HG PRO 51 12.025 11.258 6.201 420 1HD PRO 51 1HD PRO 51 13.431 9.687 7.899 421 2HD PRO 51 2HD PRO 51 13.973 11.313 7.436 422 H TRP 52 H TRP 52 9.882 12.895 10.905 423 HA TRP 52 HA TRP 52 9.130 10.356 12.094 424 1HB TRP 52 1HB TRP 52 8.615 13.224 12.681 425 2HB TRP 52 2HB TRP 52 7.395 12.068 13.204 426 HD1 TRP 52 HD1 TRP 52 8.847 9.770 14.464 427 HE1 TRP 52 HE1 TRP 52 10.447 10.030 16.463 428 HE3 TRP 52 HE3 TRP 52 9.982 14.730 13.958 429 HZ2 TRP 52 HZ2 TRP 52 11.985 12.067 17.668 430 HZ3 TRP 52 HZ3 TRP 52 11.525 15.757 15.576 431 HH2 TRP 52 HH2 TRP 52 12.505 14.452 17.392 432 H GLY 53 H GLY 53 8.202 9.300 10.293 433 1HA GLY 53 1HA GLY 53 5.401 9.902 9.941 434 2HA GLY 53 2HA GLY 53 6.361 10.144 8.490 435 H GLY 54 H GLY 54 4.991 7.827 10.676 436 1HA GLY 54 1HA GLY 54 4.791 5.797 8.780 437 2HA GLY 54 2HA GLY 54 6.274 5.507 9.677 438 H GLY 55 H GLY 55 4.837 3.490 10.042 439 1HA GLY 55 1HA GLY 55 4.083 3.459 12.752 440 2HA GLY 55 2HA GLY 55 2.631 3.575 11.769 441 H PHE 56 H PHE 56 1.840 1.556 12.285 442 HA PHE 56 HA PHE 56 3.394 -0.706 11.216 443 1HB PHE 56 1HB PHE 56 2.399 -2.134 12.957 444 2HB PHE 56 2HB PHE 56 3.351 -0.829 13.656 445 HD1 PHE 56 HD1 PHE 56 2.429 0.528 15.287 446 HD2 PHE 56 HD2 PHE 56 -0.142 -1.744 12.770 447 HE1 PHE 56 HE1 PHE 56 0.499 1.204 16.655 448 HE2 PHE 56 HE2 PHE 56 -2.077 -1.071 14.132 449 HZ PHE 56 HZ PHE 56 -1.758 0.405 16.078 450 H GLY 57 H GLY 57 1.847 -2.671 10.890 451 1HA GLY 57 1HA GLY 57 -0.790 -1.813 9.944 452 2HA GLY 57 2HA GLY 57 0.312 -2.515 8.769 453 H LEU 58 H LEU 58 -2.335 -3.385 9.936 454 HA LEU 58 HA LEU 58 -1.476 -6.076 10.776 455 1HB LEU 58 1HB LEU 58 -4.037 -4.692 11.569 456 2HB LEU 58 2HB LEU 58 -3.475 -6.257 12.124 457 HG LEU 58 HG LEU 58 -1.725 -3.913 12.652 458 1HD1 LEU 58 1HD1 LEU 58 -3.134 -3.746 14.860 459 2HD1 LEU 58 2HD1 LEU 58 -4.435 -4.316 13.815 460 3HD1 LEU 58 3HD1 LEU 58 -3.583 -2.822 13.426 461 1HD2 LEU 58 1HD2 LEU 58 -1.786 -5.323 14.909 462 2HD2 LEU 58 2HD2 LEU 58 -0.753 -5.759 13.547 463 3HD2 LEU 58 3HD2 LEU 58 -2.291 -6.589 13.789 464 H SER 59 H SER 59 -3.497 -7.633 10.484 465 HA SER 59 HA SER 59 -5.229 -7.140 8.296 466 1HB SER 59 1HB SER 59 -4.151 -8.923 6.793 467 2HB SER 59 2HB SER 59 -3.381 -7.339 6.836 468 HG SER 59 HG SER 59 -1.678 -8.517 7.264 469 H ARG 60 H ARG 60 -6.326 -9.210 7.571 470 HA ARG 60 HA ARG 60 -6.310 -11.232 9.705 471 1HB ARG 60 1HB ARG 60 -8.291 -9.362 9.479 472 2HB ARG 60 2HB ARG 60 -8.943 -10.678 8.512 473 1HG ARG 60 1HG ARG 60 -8.487 -12.188 10.482 474 2HG ARG 60 2HG ARG 60 -8.167 -10.723 11.413 475 1HD ARG 60 1HD ARG 60 -10.457 -9.925 10.628 476 2HD ARG 60 2HD ARG 60 -10.734 -11.587 10.109 477 HE ARG 60 HE ARG 60 -11.059 -12.168 12.292 478 1HH1 ARG 60 1HH1 ARG 60 -9.395 -9.102 12.198 479 2HH1 ARG 60 2HH1 ARG 60 -9.501 -8.851 13.908 480 1HH2 ARG 60 1HH2 ARG 60 -11.200 -11.839 14.540 481 2HH2 ARG 60 2HH2 ARG 60 -10.525 -10.405 15.239 482 H TRP 61 H TRP 61 -7.609 -13.215 9.014 483 HA TRP 61 HA TRP 61 -6.902 -13.829 6.227 484 1HB TRP 61 1HB TRP 61 -6.998 -16.215 6.967 485 2HB TRP 61 2HB TRP 61 -5.772 -15.264 7.801 486 HD1 TRP 61 HD1 TRP 61 -8.969 -17.212 8.406 487 HE1 TRP 61 HE1 TRP 61 -9.379 -17.392 10.941 488 HE3 TRP 61 HE3 TRP 61 -5.369 -13.971 10.044 489 HZ2 TRP 61 HZ2 TRP 61 -8.318 -16.303 13.319 490 HZ3 TRP 61 HZ3 TRP 61 -5.133 -13.597 12.463 491 HH2 TRP 61 HH2 TRP 61 -6.578 -14.739 14.067 492 H ASP 62 H ASP 62 -8.345 -15.091 4.947 493 HA ASP 62 HA ASP 62 -11.102 -15.295 5.889 494 1HB ASP 62 1HB ASP 62 -10.376 -13.134 4.386 495 2HB ASP 62 2HB ASP 62 -10.882 -14.269 3.138 496 HD2 ASP 62 HD2 ASP 62 -13.671 -12.350 4.819 497 H GLU 63 H GLU 63 -11.873 -17.234 5.429 498 HA GLU 63 HA GLU 63 -10.494 -19.201 4.040 499 1HB GLU 63 1HB GLU 63 -13.277 -18.895 5.039 500 2HB GLU 63 2HB GLU 63 -12.969 -20.191 3.891 501 1HG GLU 63 1HG GLU 63 -11.815 -21.414 5.376 502 2HG GLU 63 2HG GLU 63 -11.050 -20.003 6.106 503 HE2 GLU 63 HE2 GLU 63 -13.791 -21.612 8.160 504 H LYS 64 H LYS 64 -12.452 -16.660 2.801 505 HA LYS 64 HA LYS 64 -12.928 -17.999 0.265 506 1HB LYS 64 1HB LYS 64 -14.168 -15.998 -0.345 507 2HB LYS 64 2HB LYS 64 -14.680 -16.572 1.236 508 1HG LYS 64 1HG LYS 64 -12.859 -14.846 2.060 509 2HG LYS 64 2HG LYS 64 -13.204 -14.108 0.494 510 1HD LYS 64 1HD LYS 64 -15.665 -14.277 1.151 511 2HD LYS 64 2HD LYS 64 -15.085 -14.606 2.785 512 1HE LYS 64 1HE LYS 64 -13.625 -12.420 2.187 513 2HE LYS 64 2HE LYS 64 -15.070 -12.100 1.230 514 1HZ LYS 64 1HZ LYS 64 -15.249 -11.159 3.447 515 2HZ LYS 64 2HZ LYS 64 -15.024 -12.684 4.142 516 3HZ LYS 64 3HZ LYS 64 -16.409 -12.370 3.223 517 H GLY 65 H GLY 65 -10.166 -17.323 1.189 518 1HA GLY 65 1HA GLY 65 -8.213 -16.629 0.204 519 2HA GLY 65 2HA GLY 65 -9.122 -16.484 -1.293 520 H ASN 66 H ASN 66 -9.547 -14.755 1.774 521 HA ASN 66 HA ASN 66 -8.760 -12.272 0.410 522 1HB ASN 66 1HB ASN 66 -11.371 -12.965 1.554 523 2HB ASN 66 2HB ASN 66 -10.730 -11.432 2.138 524 1HD2 ASN 66 1HD2 ASN 66 -12.982 -12.132 0.317 525 2HD2 ASN 66 2HD2 ASN 66 -12.707 -11.194 -1.107 526 H TRP 67 H TRP 67 -8.120 -10.541 1.847 527 HA TRP 67 HA TRP 67 -7.529 -11.310 4.600 528 1HB TRP 67 1HB TRP 67 -5.433 -10.426 2.608 529 2HB TRP 67 2HB TRP 67 -5.172 -10.499 4.348 530 HD1 TRP 67 HD1 TRP 67 -4.964 -12.929 5.460 531 HE1 TRP 67 HE1 TRP 67 -4.432 -15.236 4.449 532 HE3 TRP 67 HE3 TRP 67 -5.778 -11.862 0.526 533 HZ2 TRP 67 HZ2 TRP 67 -4.366 -16.444 1.898 534 HZ3 TRP 67 HZ3 TRP 67 -5.458 -13.648 -1.136 535 HH2 TRP 67 HH2 TRP 67 -4.767 -15.891 -0.462 536 H HIS 68 H HIS 68 -8.009 -9.702 5.936 537 HA HIS 68 HA HIS 68 -8.881 -7.178 4.984 538 1HB HIS 68 1HB HIS 68 -9.412 -8.539 7.213 539 2HB HIS 68 2HB HIS 68 -8.127 -7.515 7.847 540 HD1 HIS 68 HD1 HIS 68 -10.470 -6.816 9.256 541 HD2 HIS 68 HD2 HIS 68 -9.943 -5.383 5.391 542 HE1 HIS 68 HE1 HIS 68 -11.994 -4.826 9.063 543 HE2 HIS 68 HE2 HIS 68 -11.594 -3.924 6.745 544 H GLY 69 H GLY 69 -7.924 -5.174 5.044 545 1HA GLY 69 1HA GLY 69 -5.035 -5.166 5.674 546 2HA GLY 69 2HA GLY 69 -5.740 -4.256 4.347 547 H LEU 70 H LEU 70 -4.573 -4.022 7.418 548 HA LEU 70 HA LEU 70 -6.019 -1.496 7.859 549 1HB LEU 70 1HB LEU 70 -5.210 -3.512 9.955 550 2HB LEU 70 2HB LEU 70 -5.838 -1.912 10.301 551 HG LEU 70 HG LEU 70 -7.848 -2.785 8.786 552 1HD1 LEU 70 1HD1 LEU 70 -6.389 -5.020 8.709 553 2HD1 LEU 70 2HD1 LEU 70 -8.153 -5.024 8.671 554 3HD1 LEU 70 3HD1 LEU 70 -7.304 -5.330 10.186 555 1HD2 LEU 70 1HD2 LEU 70 -9.056 -2.881 10.714 556 2HD2 LEU 70 2HD2 LEU 70 -7.593 -2.117 11.337 557 3HD2 LEU 70 3HD2 LEU 70 -7.845 -3.849 11.556 558 H TYR 71 H TYR 71 -4.802 0.231 8.526 559 HA TYR 71 HA TYR 71 -1.998 -0.190 9.213 560 1HB TYR 71 1HB TYR 71 -2.977 1.105 6.718 561 2HB TYR 71 2HB TYR 71 -1.600 1.842 7.528 562 HD1 TYR 71 HD1 TYR 71 -2.610 -0.605 5.199 563 HD2 TYR 71 HD2 TYR 71 0.348 0.199 8.150 564 HE1 TYR 71 HE1 TYR 71 -1.119 -2.251 4.144 565 HE2 TYR 71 HE2 TYR 71 1.847 -1.446 7.103 566 HH TYR 71 HH TYR 71 1.911 -2.417 4.396 567 H ALA 72 H ALA 72 -1.018 1.586 10.264 568 HA ALA 72 HA ALA 72 -2.641 3.922 10.857 569 1HB ALA 72 1HB ALA 72 -1.551 2.578 13.263 570 2HB ALA 72 2HB ALA 72 -3.003 1.888 12.536 571 3HB ALA 72 3HB ALA 72 -2.999 3.568 13.074 572 H MET 73 H MET 73 -1.253 5.491 10.355 573 HA MET 73 HA MET 73 1.505 5.285 11.376 574 1HB MET 73 1HB MET 73 0.464 6.416 8.788 575 2HB MET 73 2HB MET 73 2.034 6.879 9.430 576 1HG MET 73 1HG MET 73 2.986 4.931 8.870 577 2HG MET 73 2HG MET 73 1.561 3.989 9.307 578 1HE MET 73 1HE MET 73 -0.119 3.033 6.460 579 2HE MET 73 2HE MET 73 0.623 2.708 8.026 580 3HE MET 73 3HE MET 73 1.508 2.358 6.542 581 H ALA 74 H ALA 74 2.521 7.640 11.297 582 HA ALA 74 HA ALA 74 0.653 9.701 12.119 583 1HB ALA 74 1HB ALA 74 2.177 10.014 14.238 584 2HB ALA 74 2HB ALA 74 2.450 8.285 14.025 585 3HB ALA 74 3HB ALA 74 0.813 8.896 14.259 586 H PHE 75 H PHE 75 1.415 11.724 11.739 587 HA PHE 75 HA PHE 75 4.267 12.018 11.086 588 1HB PHE 75 1HB PHE 75 3.676 13.460 9.183 589 2HB PHE 75 2HB PHE 75 3.034 11.834 8.981 590 HD1 PHE 75 HD1 PHE 75 0.766 11.497 8.584 591 HD2 PHE 75 HD2 PHE 75 2.103 15.260 10.055 592 HE1 PHE 75 HE1 PHE 75 -1.484 12.430 8.233 593 HE2 PHE 75 HE2 PHE 75 -0.144 16.199 9.707 594 HZ PHE 75 HZ PHE 75 -1.942 14.784 8.796 595 H LYS 76 H LYS 76 5.111 14.153 11.329 596 HA LYS 76 HA LYS 76 3.860 15.587 13.504 597 1HB LYS 76 1HB LYS 76 5.929 17.009 13.366 598 2HB LYS 76 2HB LYS 76 6.223 15.302 13.666 599 1HG LYS 76 1HG LYS 76 7.253 14.988 11.678 600 2HG LYS 76 2HG LYS 76 6.243 16.170 10.843 601 1HD LYS 76 1HD LYS 76 7.567 17.947 11.480 602 2HD LYS 76 2HD LYS 76 8.194 17.107 12.899 603 1HE LYS 76 1HE LYS 76 9.783 15.977 11.699 604 2HE LYS 76 2HE LYS 76 8.839 16.011 10.211 605 1HZ LYS 76 1HZ LYS 76 9.394 18.294 9.888 606 2HZ LYS 76 2HZ LYS 76 10.833 17.453 10.176 607 3HZ LYS 76 3HZ LYS 76 10.146 18.395 11.401 608 H ASP 77 H ASP 77 2.962 17.593 13.442 609 HA ASP 77 HA ASP 77 2.294 18.623 10.796 610 1HB ASP 77 1HB ASP 77 0.753 18.283 13.003 611 2HB ASP 77 2HB ASP 77 1.212 19.972 13.194 612 HD2 ASP 77 HD2 ASP 77 -1.249 20.811 10.985 613 H SER 78 H SER 78 1.857 21.266 11.260 614 HA SER 78 HA SER 78 4.485 22.339 11.089 615 1HB SER 78 1HB SER 78 2.086 23.144 10.140 616 2HB SER 78 2HB SER 78 2.225 24.201 11.545 617 HG SER 78 HG SER 78 3.915 25.185 10.664 618 H TRP 79 H TRP 79 2.146 22.038 13.650 619 HA TRP 79 HA TRP 79 3.713 23.792 15.391 620 1HB TRP 79 1HB TRP 79 1.022 22.474 15.796 621 2HB TRP 79 2HB TRP 79 1.819 23.500 16.984 622 HD1 TRP 79 HD1 TRP 79 -0.710 23.707 14.389 623 HE1 TRP 79 HE1 TRP 79 -1.089 26.137 13.630 624 HE3 TRP 79 HE3 TRP 79 3.456 25.856 16.430 625 HZ2 TRP 79 HZ2 TRP 79 0.205 28.634 13.867 626 HZ3 TRP 79 HZ3 TRP 79 3.811 28.271 16.118 627 HH2 TRP 79 HH2 TRP 79 2.219 29.630 14.861 628 H ASN 80 H ASN 80 4.670 21.151 14.515 629 HA ASN 80 HA ASN 80 5.704 19.307 15.357 630 1HB ASN 80 1HB ASN 80 5.791 21.279 17.591 631 2HB ASN 80 2HB ASN 80 6.252 19.616 17.946 632 1HD2 ASN 80 1HD2 ASN 80 7.843 18.661 16.380 633 2HD2 ASN 80 2HD2 ASN 80 9.137 19.683 15.862 634 H LYS 81 H LYS 81 2.785 19.394 15.380 635 HA LYS 81 HA LYS 81 2.188 17.682 17.694 636 1HB LYS 81 1HB LYS 81 0.803 19.846 16.719 637 2HB LYS 81 2HB LYS 81 -0.066 18.498 16.001 638 1HG LYS 81 1HG LYS 81 -1.215 18.667 17.945 639 2HG LYS 81 2HG LYS 81 0.065 17.580 18.485 640 1HD LYS 81 1HD LYS 81 0.032 19.195 20.152 641 2HD LYS 81 2HD LYS 81 1.326 19.760 19.093 642 1HE LYS 81 1HE LYS 81 -0.409 21.199 17.952 643 2HE LYS 81 2HE LYS 81 -1.501 20.778 19.269 644 1HZ LYS 81 1HZ LYS 81 -0.596 22.706 20.050 645 2HZ LYS 81 2HZ LYS 81 0.906 22.451 19.316 646 3HZ LYS 81 3HZ LYS 81 0.493 21.595 20.715 647 H TRP 82 H TRP 82 2.396 15.587 17.271 648 HA TRP 82 HA TRP 82 2.356 14.499 14.649 649 1HB TRP 82 1HB TRP 82 2.546 12.325 15.760 650 2HB TRP 82 2HB TRP 82 3.660 13.489 16.470 651 HD1 TRP 82 HD1 TRP 82 3.166 14.293 18.979 652 HE1 TRP 82 HE1 TRP 82 1.741 13.264 20.859 653 HE3 TRP 82 HE3 TRP 82 0.401 11.010 16.200 654 HZ2 TRP 82 HZ2 TRP 82 -0.286 11.318 21.130 655 HZ3 TRP 82 HZ3 TRP 82 -1.259 9.602 17.346 656 HH2 TRP 82 HH2 TRP 82 -1.593 9.753 19.760 657 H GLU 83 H GLU 83 0.619 14.176 13.440 658 HA GLU 83 HA GLU 83 -1.971 13.756 14.751 659 1HB GLU 83 1HB GLU 83 -1.521 15.597 12.976 660 2HB GLU 83 2HB GLU 83 -1.610 14.278 11.816 661 1HG GLU 83 1HG GLU 83 -3.758 15.165 11.850 662 2HG GLU 83 2HG GLU 83 -3.865 13.731 12.870 663 HE2 GLU 83 HE2 GLU 83 -4.316 15.685 15.747 664 HA PRO 84 HA PRO 84 -1.620 9.483 13.465 665 1HB PRO 84 1HB PRO 84 -3.988 8.623 14.422 666 2HB PRO 84 2HB PRO 84 -2.624 8.993 15.484 667 1HG PRO 84 1HG PRO 84 -5.021 10.662 14.830 668 2HG PRO 84 2HG PRO 84 -4.243 10.388 16.401 669 1HD PRO 84 1HD PRO 84 -3.829 12.624 14.897 670 2HD PRO 84 2HD PRO 84 -2.614 11.958 16.006 671 H ILE 85 H ILE 85 -2.747 7.982 12.062 672 HA ILE 85 HA ILE 85 -4.937 9.039 10.464 673 HB ILE 85 HB ILE 85 -2.824 9.822 9.372 674 1HG1 ILE 85 1HG1 ILE 85 -5.002 9.375 8.166 675 2HG1 ILE 85 2HG1 ILE 85 -3.561 9.349 7.158 676 1HG2 ILE 85 1HG2 ILE 85 -2.367 6.932 8.674 677 2HG2 ILE 85 2HG2 ILE 85 -1.521 7.762 9.980 678 3HG2 ILE 85 3HG2 ILE 85 -1.332 8.316 8.317 679 1HD1 ILE 85 1HD1 ILE 85 -4.752 7.529 6.404 680 2HD1 ILE 85 2HD1 ILE 85 -5.307 7.090 8.019 681 3HD1 ILE 85 3HD1 ILE 85 -3.633 6.794 7.552 682 H ALA 86 H ALA 86 -6.381 7.468 10.300 683 HA ALA 86 HA ALA 86 -5.532 4.691 10.618 684 1HB ALA 86 1HB ALA 86 -7.309 4.911 12.009 685 2HB ALA 86 2HB ALA 86 -8.194 4.492 10.542 686 3HB ALA 86 3HB ALA 86 -8.055 6.179 11.037 687 H GLY 87 H GLY 87 -5.644 3.184 9.047 688 1HA GLY 87 1HA GLY 87 -6.946 3.938 6.509 689 2HA GLY 87 2HA GLY 87 -5.318 3.279 6.522 690 H TYR 88 H TYR 88 -8.114 2.391 5.533 691 HA TYR 88 HA TYR 88 -7.749 -0.398 6.336 692 1HB TYR 88 1HB TYR 88 -10.491 0.862 6.292 693 2HB TYR 88 2HB TYR 88 -10.052 -0.746 6.858 694 HD1 TYR 88 HD1 TYR 88 -8.670 -0.954 8.959 695 HD2 TYR 88 HD2 TYR 88 -10.444 2.718 7.746 696 HE1 TYR 88 HE1 TYR 88 -8.419 -0.085 11.245 697 HE2 TYR 88 HE2 TYR 88 -10.197 3.598 10.029 698 HH TYR 88 HH TYR 88 -8.242 2.201 12.338 699 H GLY 89 H GLY 89 -8.619 -1.929 4.849 700 1HA GLY 89 1HA GLY 89 -10.060 -1.320 2.536 701 2HA GLY 89 2HA GLY 89 -8.354 -1.173 2.141 702 H TRP 90 H TRP 90 -8.852 -2.925 0.624 703 HA TRP 90 HA TRP 90 -9.006 -5.555 1.937 704 1HB TRP 90 1HB TRP 90 -10.066 -4.482 -0.596 705 2HB TRP 90 2HB TRP 90 -9.358 -6.089 -0.716 706 HD1 TRP 90 HD1 TRP 90 -10.359 -7.811 1.399 707 HE1 TRP 90 HE1 TRP 90 -12.836 -8.136 2.018 708 HE3 TRP 90 HE3 TRP 90 -12.271 -3.520 -0.620 709 HZ2 TRP 90 HZ2 TRP 90 -15.277 -6.756 1.694 710 HZ3 TRP 90 HZ3 TRP 90 -14.687 -3.098 -0.421 711 HH2 TRP 90 HH2 TRP 90 -16.157 -4.684 0.712 712 H GLU 91 H GLU 91 -7.571 -7.205 1.333 713 HA GLU 91 HA GLU 91 -5.270 -6.418 -0.305 714 1HB GLU 91 1HB GLU 91 -5.084 -7.667 2.443 715 2HB GLU 91 2HB GLU 91 -3.727 -7.404 1.355 716 1HG GLU 91 1HG GLU 91 -5.209 -4.967 1.769 717 2HG GLU 91 2HG GLU 91 -4.692 -5.669 3.300 718 HE2 GLU 91 HE2 GLU 91 -1.324 -5.125 2.547 719 H SER 92 H SER 92 -4.427 -8.021 -1.542 720 HA SER 92 HA SER 92 -5.362 -10.765 -1.088 721 1HB SER 92 1HB SER 92 -6.828 -9.786 -2.797 722 2HB SER 92 2HB SER 92 -5.419 -9.336 -3.757 723 HG SER 92 HG SER 92 -6.320 -11.946 -3.119 724 H THR 93 H THR 93 -3.499 -11.757 -0.602 725 HA THR 93 HA THR 93 -1.066 -11.094 -2.063 726 HB THR 93 HB THR 93 0.049 -12.569 -0.426 727 HG1 THR 93 HG1 THR 93 -2.512 -12.846 0.750 728 1HG2 THR 93 1HG2 THR 93 0.192 -10.649 0.683 729 2HG2 THR 93 2HG2 THR 93 -1.117 -11.281 1.682 730 3HG2 THR 93 3HG2 THR 93 -1.479 -10.212 0.326 731 H TRP 94 H TRP 94 0.005 -12.463 -3.423 732 HA TRP 94 HA TRP 94 -1.166 -15.114 -3.901 733 1HB TRP 94 1HB TRP 94 -1.796 -13.163 -5.579 734 2HB TRP 94 2HB TRP 94 -0.208 -13.531 -6.245 735 HD1 TRP 94 HD1 TRP 94 -0.601 -14.937 -8.346 736 HE1 TRP 94 HE1 TRP 94 -2.029 -16.991 -8.950 737 HE3 TRP 94 HE3 TRP 94 -3.157 -15.470 -3.951 738 HZ2 TRP 94 HZ2 TRP 94 -3.981 -18.622 -7.724 739 HZ3 TRP 94 HZ3 TRP 94 -4.786 -17.302 -3.747 740 HH2 TRP 94 HH2 TRP 94 -5.189 -18.845 -5.597 741 H ARG 95 H ARG 95 0.302 -16.687 -3.980 742 HA ARG 95 HA ARG 95 3.060 -16.035 -4.729 743 1HB ARG 95 1HB ARG 95 2.998 -15.999 -2.290 744 2HB ARG 95 2HB ARG 95 2.246 -17.588 -2.266 745 1HG ARG 95 1HG ARG 95 4.347 -18.388 -3.496 746 2HG ARG 95 2HG ARG 95 5.058 -16.854 -2.991 747 1HD ARG 95 1HD ARG 95 3.707 -18.185 -0.802 748 2HD ARG 95 2HD ARG 95 4.949 -19.210 -1.519 749 HE ARG 95 HE ARG 95 6.091 -16.714 -1.171 750 1HH1 ARG 95 1HH1 ARG 95 4.708 -19.205 0.845 751 2HH1 ARG 95 2HH1 ARG 95 5.700 -18.823 2.212 752 1HH2 ARG 95 1HH2 ARG 95 7.396 -16.211 0.625 753 2HH2 ARG 95 2HH2 ARG 95 7.226 -17.123 2.088 754 HA PRO 96 HA PRO 96 2.808 -19.573 -7.360 755 1HB PRO 96 1HB PRO 96 5.585 -20.133 -6.436 756 2HB PRO 96 2HB PRO 96 4.953 -19.988 -8.080 757 1HG PRO 96 1HG PRO 96 6.394 -18.027 -7.003 758 2HG PRO 96 2HG PRO 96 4.995 -17.668 -8.032 759 1HD PRO 96 1HD PRO 96 5.255 -17.522 -5.062 760 2HD PRO 96 2HD PRO 96 4.345 -16.474 -6.169 761 H LEU 97 H LEU 97 3.709 -22.003 -7.233 762 HA LEU 97 HA LEU 97 2.573 -23.073 -4.770 763 1HB LEU 97 1HB LEU 97 3.379 -24.468 -7.324 764 2HB LEU 97 2HB LEU 97 2.565 -25.224 -5.967 765 HG LEU 97 HG LEU 97 1.271 -22.873 -7.272 766 1HD1 LEU 97 1HD1 LEU 97 0.564 -23.968 -9.129 767 2HD1 LEU 97 2HD1 LEU 97 0.656 -25.555 -8.366 768 3HD1 LEU 97 3HD1 LEU 97 2.127 -24.764 -8.933 769 1HD2 LEU 97 1HD2 LEU 97 -0.168 -25.329 -6.469 770 2HD2 LEU 97 2HD2 LEU 97 -0.613 -23.635 -6.271 771 3HD2 LEU 97 3HD2 LEU 97 0.558 -24.373 -5.178 772 H ALA 98 H ALA 98 4.896 -21.974 -4.119 773 HA ALA 98 HA ALA 98 6.886 -22.361 -3.086 774 1HB ALA 98 1HB ALA 98 6.250 -25.297 -3.221 775 2HB ALA 98 2HB ALA 98 5.478 -24.208 -2.071 776 3HB ALA 98 3HB ALA 98 7.225 -24.441 -2.027 777 H ASP 99 H ASP 99 6.772 -22.257 -5.973 778 HA ASP 99 HA ASP 99 9.003 -24.034 -6.698 779 1HB ASP 99 1HB ASP 99 6.849 -24.140 -8.040 780 2HB ASP 99 2HB ASP 99 7.228 -22.519 -8.614 781 HD2 ASP 99 HD2 ASP 99 9.050 -23.976 -11.110 782 H GLU 100 H GLU 100 7.794 -20.729 -7.260 783 HA GLU 100 HA GLU 100 10.531 -19.865 -7.843 784 1HB GLU 100 1HB GLU 100 8.486 -19.295 -9.314 785 2HB GLU 100 2HB GLU 100 8.081 -18.135 -8.054 786 1HG GLU 100 1HG GLU 100 9.256 -16.934 -9.694 787 2HG GLU 100 2HG GLU 100 10.389 -17.173 -8.363 788 HE2 GLU 100 HE2 GLU 100 11.671 -19.870 -10.644 789 H ASN 101 H ASN 101 7.954 -19.488 -5.521 790 HA ASN 101 HA ASN 101 7.870 -18.526 -3.462 791 1HB ASN 101 1HB ASN 101 10.880 -18.323 -3.663 792 2HB ASN 101 2HB ASN 101 9.912 -18.321 -2.193 793 1HD2 ASN 101 1HD2 ASN 101 11.842 -20.160 -4.080 794 2HD2 ASN 101 2HD2 ASN 101 11.286 -21.733 -3.631 795 H PHE 102 H PHE 102 7.533 -16.872 -5.728 796 HA PHE 102 HA PHE 102 8.841 -14.359 -4.974 797 1HB PHE 102 1HB PHE 102 8.525 -15.424 -7.434 798 2HB PHE 102 2HB PHE 102 7.063 -14.448 -7.342 799 HD1 PHE 102 HD1 PHE 102 10.585 -13.937 -6.216 800 HD2 PHE 102 HD2 PHE 102 7.306 -12.496 -8.513 801 HE1 PHE 102 HE1 PHE 102 11.889 -11.938 -6.815 802 HE2 PHE 102 HE2 PHE 102 8.602 -10.494 -9.117 803 HZ PHE 102 HZ PHE 102 10.898 -10.213 -8.268 804 H HIS 103 H HIS 103 7.767 -12.762 -3.995 805 HA HIS 103 HA HIS 103 4.981 -13.187 -3.304 806 1HB HIS 103 1HB HIS 103 7.075 -11.210 -2.422 807 2HB HIS 103 2HB HIS 103 5.384 -11.023 -1.971 808 HD1 HIS 103 HD1 HIS 103 8.298 -12.125 -0.488 809 HD2 HIS 103 HD2 HIS 103 4.546 -13.863 -0.900 810 HE1 HIS 103 HE1 HIS 103 8.156 -13.858 1.329 811 HE2 HIS 103 HE2 HIS 103 5.845 -14.838 1.112 812 H LEU 104 H LEU 104 3.350 -12.359 -4.415 813 HA LEU 104 HA LEU 104 3.576 -9.731 -5.630 814 1HB LEU 104 1HB LEU 104 4.216 -11.784 -7.228 815 2HB LEU 104 2HB LEU 104 2.474 -11.817 -7.429 816 HG LEU 104 HG LEU 104 4.019 -9.273 -7.821 817 1HD1 LEU 104 1HD1 LEU 104 3.730 -10.005 -10.330 818 2HD1 LEU 104 2HD1 LEU 104 3.817 -11.624 -9.633 819 3HD1 LEU 104 3HD1 LEU 104 5.146 -10.490 -9.396 820 1HD2 LEU 104 1HD2 LEU 104 1.506 -9.323 -7.597 821 2HD2 LEU 104 2HD2 LEU 104 1.475 -10.226 -9.112 822 3HD2 LEU 104 3HD2 LEU 104 2.131 -8.590 -9.074 823 H GLY 105 H GLY 105 1.803 -8.660 -5.079 824 1HA GLY 105 1HA GLY 105 -0.804 -9.929 -5.304 825 2HA GLY 105 2HA GLY 105 -0.338 -9.442 -3.681 826 H LEU 106 H LEU 106 -2.541 -8.302 -4.453 827 HA LEU 106 HA LEU 106 -1.773 -5.528 -4.883 828 1HB LEU 106 1HB LEU 106 -2.547 -6.887 -7.063 829 2HB LEU 106 2HB LEU 106 -4.123 -6.420 -6.454 830 HG LEU 106 HG LEU 106 -2.060 -4.292 -6.688 831 1HD1 LEU 106 1HD1 LEU 106 -2.255 -5.891 -8.816 832 2HD1 LEU 106 2HD1 LEU 106 -2.034 -4.146 -8.946 833 3HD1 LEU 106 3HD1 LEU 106 -3.643 -4.847 -9.122 834 1HD2 LEU 106 1HD2 LEU 106 -3.901 -2.889 -6.995 835 2HD2 LEU 106 2HD2 LEU 106 -4.455 -4.066 -5.804 836 3HD2 LEU 106 3HD2 LEU 106 -4.949 -4.219 -7.491 837 H GLY 107 H GLY 107 -3.035 -4.103 -3.789 838 1HA GLY 107 1HA GLY 107 -5.682 -4.822 -2.882 839 2HA GLY 107 2HA GLY 107 -4.482 -4.768 -1.600 840 H PHE 108 H PHE 108 -6.842 -3.103 -1.962 841 HA PHE 108 HA PHE 108 -5.649 -0.478 -2.506 842 1HB PHE 108 1HB PHE 108 -8.531 -1.351 -2.244 843 2HB PHE 108 2HB PHE 108 -8.029 0.325 -2.443 844 HD1 PHE 108 HD1 PHE 108 -7.363 -2.975 -4.061 845 HD2 PHE 108 HD2 PHE 108 -8.178 1.171 -4.561 846 HE1 PHE 108 HE1 PHE 108 -7.358 -3.273 -6.503 847 HE2 PHE 108 HE2 PHE 108 -8.175 0.881 -7.004 848 HZ PHE 108 HZ PHE 108 -7.766 -1.344 -7.978 849 H THR 109 H THR 109 -5.550 1.120 -0.978 850 HA THR 109 HA THR 109 -6.475 0.436 1.732 851 HB THR 109 HB THR 109 -3.985 2.046 1.368 852 HG1 THR 109 HG1 THR 109 -2.792 0.084 1.386 853 1HG2 THR 109 1HG2 THR 109 -3.316 0.843 3.423 854 2HG2 THR 109 2HG2 THR 109 -4.904 0.076 3.443 855 3HG2 THR 109 3HG2 THR 109 -4.767 1.826 3.614 856 H ALA 110 H ALA 110 -7.841 1.890 2.507 857 HA ALA 110 HA ALA 110 -7.887 4.569 1.313 858 1HB ALA 110 1HB ALA 110 -10.130 4.637 1.664 859 2HB ALA 110 2HB ALA 110 -10.039 3.700 3.154 860 3HB ALA 110 3HB ALA 110 -9.932 2.885 1.593 861 H GLY 111 H GLY 111 -6.826 6.091 2.394 862 1HA GLY 111 1HA GLY 111 -6.437 5.808 5.281 863 2HA GLY 111 2HA GLY 111 -5.584 6.925 4.224 864 H VAL 112 H VAL 112 -7.155 7.230 6.797 865 HA VAL 112 HA VAL 112 -8.829 9.466 5.864 866 HB VAL 112 HB VAL 112 -9.517 7.725 8.233 867 1HG1 VAL 112 1HG1 VAL 112 -10.648 10.170 7.015 868 2HG1 VAL 112 2HG1 VAL 112 -10.646 9.633 8.695 869 3HG1 VAL 112 3HG1 VAL 112 -11.800 8.947 7.551 870 1HG2 VAL 112 1HG2 VAL 112 -10.929 7.720 5.577 871 2HG2 VAL 112 2HG2 VAL 112 -11.137 6.609 6.930 872 3HG2 VAL 112 3HG2 VAL 112 -9.653 6.571 5.978 873 H THR 113 H THR 113 -8.207 11.347 6.682 874 HA THR 113 HA THR 113 -6.687 11.345 9.208 875 HB THR 113 HB THR 113 -6.489 13.471 7.082 876 HG1 THR 113 HG1 THR 113 -5.369 12.147 5.933 877 1HG2 THR 113 1HG2 THR 113 -4.324 13.925 8.061 878 2HG2 THR 113 2HG2 THR 113 -4.563 12.629 9.234 879 3HG2 THR 113 3HG2 THR 113 -5.594 14.060 9.276 880 H ALA 114 H ALA 114 -7.285 12.715 10.815 881 HA ALA 114 HA ALA 114 -9.283 14.772 10.297 882 1HB ALA 114 1HB ALA 114 -10.895 13.979 11.805 883 2HB ALA 114 2HB ALA 114 -9.795 12.780 12.485 884 3HB ALA 114 3HB ALA 114 -10.436 12.565 10.856 885 H ARG 115 H ARG 115 -8.826 16.556 11.411 886 HA ARG 115 HA ARG 115 -7.091 16.310 13.781 887 1HB ARG 115 1HB ARG 115 -6.316 18.636 13.197 888 2HB ARG 115 2HB ARG 115 -5.831 17.380 12.065 889 1HG ARG 115 1HG ARG 115 -7.639 18.037 10.559 890 2HG ARG 115 2HG ARG 115 -8.121 19.300 11.693 891 1HD ARG 115 1HD ARG 115 -6.417 20.657 11.107 892 2HD ARG 115 2HD ARG 115 -5.285 19.321 10.904 893 HE ARG 115 HE ARG 115 -5.807 19.260 8.677 894 1HH1 ARG 115 1HH1 ARG 115 -8.219 21.146 10.350 895 2HH1 ARG 115 2HH1 ARG 115 -8.984 21.691 8.895 896 1HH2 ARG 115 1HH2 ARG 115 -6.810 19.977 6.761 897 2HH2 ARG 115 2HH2 ARG 115 -8.184 21.027 6.858 898 H ASP 116 H ASP 116 -7.670 17.347 15.622 899 HA ASP 116 HA ASP 116 -8.995 18.392 17.147 900 1HB ASP 116 1HB ASP 116 -8.515 20.252 15.261 901 2HB ASP 116 2HB ASP 116 -10.268 20.160 15.132 902 HD2 ASP 116 HD2 ASP 116 -8.829 22.261 17.996 903 H ASN 117 H ASN 117 -11.254 18.760 17.814 904 HA ASN 117 HA ASN 117 -13.045 16.909 16.395 905 1HB ASN 117 1HB ASN 117 -12.426 16.398 18.783 906 2HB ASN 117 2HB ASN 117 -13.282 17.863 19.254 907 1HD2 ASN 117 1HD2 ASN 117 -14.649 16.530 20.525 908 2HD2 ASN 117 2HD2 ASN 117 -15.940 15.644 19.797 909 H TRP 118 H TRP 118 -12.703 20.166 17.574 910 HA TRP 118 HA TRP 118 -15.353 21.023 17.524 911 1HB TRP 118 1HB TRP 118 -12.922 22.206 18.013 912 2HB TRP 118 2HB TRP 118 -13.425 22.998 16.524 913 HD1 TRP 118 HD1 TRP 118 -16.606 22.996 17.287 914 HE1 TRP 118 HE1 TRP 118 -17.422 24.726 19.010 915 HE3 TRP 118 HE3 TRP 118 -12.148 24.043 19.562 916 HZ2 TRP 118 HZ2 TRP 118 -16.322 26.323 21.061 917 HZ3 TRP 118 HZ3 TRP 118 -12.117 25.684 21.395 918 HH2 TRP 118 HH2 TRP 118 -14.161 26.800 22.128 919 H ASN 119 H ASN 119 -12.928 21.084 14.921 920 HA ASN 119 HA ASN 119 -14.833 22.034 12.987 921 1HB ASN 119 1HB ASN 119 -12.145 22.202 13.125 922 2HB ASN 119 2HB ASN 119 -12.298 20.805 12.063 923 1HD2 ASN 119 1HD2 ASN 119 -11.348 22.074 10.410 924 2HD2 ASN 119 2HD2 ASN 119 -12.287 23.230 9.535 925 H TYR 120 H TYR 120 -13.001 19.000 13.384 926 HA TYR 120 HA TYR 120 -13.421 16.869 12.712 927 1HB TYR 120 1HB TYR 120 -15.522 17.394 14.076 928 2HB TYR 120 2HB TYR 120 -16.332 17.633 12.531 929 HD1 TYR 120 HD1 TYR 120 -16.324 15.681 10.875 930 HD2 TYR 120 HD2 TYR 120 -15.300 15.248 14.982 931 HE1 TYR 120 HE1 TYR 120 -16.748 13.264 10.720 932 HE2 TYR 120 HE2 TYR 120 -15.721 12.830 14.838 933 HH TYR 120 HH TYR 120 -17.269 11.391 12.139 934 H ILE 121 H ILE 121 -12.335 17.224 10.715 935 HA ILE 121 HA ILE 121 -14.160 17.247 8.404 936 HB ILE 121 HB ILE 121 -11.402 18.466 8.389 937 1HG1 ILE 121 1HG1 ILE 121 -12.937 19.735 9.863 938 2HG1 ILE 121 2HG1 ILE 121 -12.478 20.647 8.428 939 1HG2 ILE 121 1HG2 ILE 121 -11.905 19.236 6.226 940 2HG2 ILE 121 2HG2 ILE 121 -13.619 18.863 6.402 941 3HG2 ILE 121 3HG2 ILE 121 -12.443 17.556 6.256 942 1HD1 ILE 121 1HD1 ILE 121 -14.684 21.075 8.371 943 2HD1 ILE 121 2HD1 ILE 121 -15.104 19.612 9.261 944 3HD1 ILE 121 3HD1 ILE 121 -14.738 19.521 7.537 945 HA PRO 122 HA PRO 122 -11.915 13.235 8.284 946 1HB PRO 122 1HB PRO 122 -14.043 12.782 6.262 947 2HB PRO 122 2HB PRO 122 -13.539 11.762 7.614 948 1HG PRO 122 1HG PRO 122 -15.820 13.138 7.717 949 2HG PRO 122 2HG PRO 122 -14.797 12.953 9.154 950 1HD PRO 122 1HD PRO 122 -15.120 15.312 7.345 951 2HD PRO 122 2HD PRO 122 -14.928 15.261 9.109 952 H LEU 123 H LEU 123 -10.520 12.395 6.753 953 HA LEU 123 HA LEU 123 -10.405 13.789 4.163 954 1HB LEU 123 1HB LEU 123 -8.279 13.388 6.204 955 2HB LEU 123 2HB LEU 123 -7.816 13.272 4.517 956 HG LEU 123 HG LEU 123 -9.247 15.662 5.671 957 1HD1 LEU 123 1HD1 LEU 123 -6.768 16.568 5.230 958 2HD1 LEU 123 2HD1 LEU 123 -6.390 14.910 5.698 959 3HD1 LEU 123 3HD1 LEU 123 -7.305 15.947 6.792 960 1HD2 LEU 123 1HD2 LEU 123 -7.922 15.039 3.051 961 2HD2 LEU 123 2HD2 LEU 123 -8.149 16.699 3.602 962 3HD2 LEU 123 3HD2 LEU 123 -9.547 15.654 3.353 963 HA PRO 124 HA PRO 124 -10.389 9.208 3.495 964 1HB PRO 124 1HB PRO 124 -12.406 9.098 1.727 965 2HB PRO 124 2HB PRO 124 -12.703 9.177 3.468 966 1HG PRO 124 1HG PRO 124 -12.825 11.360 1.424 967 2HG PRO 124 2HG PRO 124 -13.931 11.023 2.768 968 1HD PRO 124 1HD PRO 124 -11.961 12.930 2.849 969 2HD PRO 124 2HD PRO 124 -12.609 12.115 4.286 970 H VAL 125 H VAL 125 -9.104 8.306 1.997 971 HA VAL 125 HA VAL 125 -9.019 9.314 -0.716 972 HB VAL 125 HB VAL 125 -6.524 9.551 -0.681 973 1HG1 VAL 125 1HG1 VAL 125 -8.105 11.474 -0.642 974 2HG1 VAL 125 2HG1 VAL 125 -6.545 11.815 0.106 975 3HG1 VAL 125 3HG1 VAL 125 -7.956 11.501 1.115 976 1HG2 VAL 125 1HG2 VAL 125 -7.005 8.969 2.171 977 2HG2 VAL 125 2HG2 VAL 125 -5.847 10.254 1.826 978 3HG2 VAL 125 3HG2 VAL 125 -5.594 8.639 1.166 979 H LEU 126 H LEU 126 -8.766 7.671 -2.083 980 HA LEU 126 HA LEU 126 -8.009 5.067 -1.007 981 1HB LEU 126 1HB LEU 126 -9.879 5.949 -2.924 982 2HB LEU 126 2HB LEU 126 -8.682 5.018 -3.803 983 HG LEU 126 HG LEU 126 -10.455 3.542 -3.184 984 1HD1 LEU 126 1HD1 LEU 126 -8.065 2.773 -2.946 985 2HD1 LEU 126 2HD1 LEU 126 -9.266 1.845 -2.049 986 3HD1 LEU 126 3HD1 LEU 126 -8.249 3.016 -1.209 987 1HD2 LEU 126 1HD2 LEU 126 -10.012 4.238 -0.292 988 2HD2 LEU 126 2HD2 LEU 126 -11.316 3.285 -1.002 989 3HD2 LEU 126 3HD2 LEU 126 -11.240 5.024 -1.286 990 H LEU 127 H LEU 127 -6.070 4.194 -1.324 991 HA LEU 127 HA LEU 127 -4.435 5.169 -3.568 992 1HB LEU 127 1HB LEU 127 -3.935 5.651 -0.872 993 2HB LEU 127 2HB LEU 127 -2.855 4.332 -1.282 994 HG LEU 127 HG LEU 127 -1.685 6.411 -1.570 995 1HD1 LEU 127 1HD1 LEU 127 -2.468 5.199 -4.215 996 2HD1 LEU 127 2HD1 LEU 127 -1.138 4.694 -3.173 997 3HD1 LEU 127 3HD1 LEU 127 -1.090 6.271 -3.960 998 1HD2 LEU 127 1HD2 LEU 127 -3.730 7.803 -1.872 999 2HD2 LEU 127 2HD2 LEU 127 -3.819 7.224 -3.535 1000 3HD2 LEU 127 3HD2 LEU 127 -2.431 8.175 -3.005 1001 HA PRO 128 HA PRO 128 -4.551 0.639 -4.012 1002 1HB PRO 128 1HB PRO 128 -4.077 0.603 -6.666 1003 2HB PRO 128 2HB PRO 128 -5.675 0.961 -6.002 1004 1HG PRO 128 1HG PRO 128 -3.579 2.844 -7.013 1005 2HG PRO 128 2HG PRO 128 -5.330 2.868 -7.289 1006 1HD PRO 128 1HD PRO 128 -4.091 4.449 -5.451 1007 2HD PRO 128 2HD PRO 128 -5.759 3.874 -5.267 1008 H LEU 129 H LEU 129 -2.872 -0.704 -3.746 1009 HA LEU 129 HA LEU 129 -0.277 -0.030 -4.914 1010 1HB LEU 129 1HB LEU 129 0.762 -0.742 -2.675 1011 2HB LEU 129 2HB LEU 129 0.102 0.877 -2.810 1012 HG LEU 129 HG LEU 129 -2.049 -0.181 -1.792 1013 1HD1 LEU 129 1HD1 LEU 129 -1.132 -1.972 -0.082 1014 2HD1 LEU 129 2HD1 LEU 129 0.002 -2.291 -1.394 1015 3HD1 LEU 129 3HD1 LEU 129 -1.732 -2.435 -1.674 1016 1HD2 LEU 129 1HD2 LEU 129 -0.804 -0.020 0.537 1017 2HD2 LEU 129 2HD2 LEU 129 -1.118 1.408 -0.447 1018 3HD2 LEU 129 3HD2 LEU 129 0.477 0.655 -0.470 1019 H ALA 130 H ALA 130 1.257 -1.855 -4.826 1020 HA ALA 130 HA ALA 130 -0.100 -4.461 -4.646 1021 1HB ALA 130 1HB ALA 130 0.699 -5.179 -6.691 1022 2HB ALA 130 2HB ALA 130 1.983 -3.970 -6.732 1023 3HB ALA 130 3HB ALA 130 0.310 -3.490 -7.020 1024 H SER 131 H SER 131 0.927 -5.910 -3.429 1025 HA SER 131 HA SER 131 3.481 -5.237 -2.267 1026 1HB SER 131 1HB SER 131 1.329 -6.530 -1.273 1027 2HB SER 131 2HB SER 131 2.307 -7.912 -1.766 1028 HG SER 131 HG SER 131 3.077 -7.513 0.197 1029 H VAL 132 H VAL 132 5.353 -5.734 -3.175 1030 HA VAL 132 HA VAL 132 5.676 -8.323 -4.489 1031 HB VAL 132 HB VAL 132 6.964 -7.221 -6.351 1032 1HG1 VAL 132 1HG1 VAL 132 4.365 -7.910 -6.204 1033 2HG1 VAL 132 2HG1 VAL 132 5.137 -7.314 -7.673 1034 3HG1 VAL 132 3HG1 VAL 132 4.211 -6.212 -6.655 1035 1HG2 VAL 132 1HG2 VAL 132 7.413 -5.058 -5.601 1036 2HG2 VAL 132 2HG2 VAL 132 5.749 -4.788 -5.086 1037 3HG2 VAL 132 3HG2 VAL 132 6.145 -4.825 -6.804 1038 H GLY 133 H GLY 133 7.486 -9.278 -3.818 1039 1HA GLY 133 1HA GLY 133 10.003 -8.095 -3.616 1040 2HA GLY 133 2HA GLY 133 9.270 -8.017 -2.021 1041 H TYR 134 H TYR 134 11.106 -9.379 -1.411 1042 HA TYR 134 HA TYR 134 10.379 -12.193 -1.638 1043 1HB TYR 134 1HB TYR 134 12.010 -11.835 -3.442 1044 2HB TYR 134 2HB TYR 134 13.156 -11.175 -2.280 1045 HD1 TYR 134 HD1 TYR 134 14.903 -12.620 -1.890 1046 HD2 TYR 134 HD2 TYR 134 10.995 -14.231 -2.380 1047 HE1 TYR 134 HE1 TYR 134 15.788 -14.877 -1.477 1048 HE2 TYR 134 HE2 TYR 134 11.869 -16.492 -1.968 1049 HH TYR 134 HH TYR 134 14.887 -17.087 -0.656 1050 H GLY 135 H GLY 135 11.034 -13.458 0.099 1051 1HA GLY 135 1HA GLY 135 11.562 -13.877 2.293 1052 2HA GLY 135 2HA GLY 135 12.913 -12.781 2.045 1053 HA PRO 136 HA PRO 136 10.331 -10.799 5.282 1054 1HB PRO 136 1HB PRO 136 12.406 -9.638 6.584 1055 2HB PRO 136 2HB PRO 136 11.922 -11.316 6.858 1056 1HG PRO 136 1HG PRO 136 14.137 -10.236 5.156 1057 2HG PRO 136 2HG PRO 136 14.150 -11.623 6.262 1058 1HD PRO 136 1HD PRO 136 13.894 -11.898 3.579 1059 2HD PRO 136 2HD PRO 136 13.134 -13.014 4.732 1060 H VAL 137 H VAL 137 12.405 -9.654 2.821 1061 HA VAL 137 HA VAL 137 11.704 -6.857 3.359 1062 HB VAL 137 HB VAL 137 13.370 -6.272 1.652 1063 1HG1 VAL 137 1HG1 VAL 137 13.892 -6.772 4.138 1064 2HG1 VAL 137 2HG1 VAL 137 15.226 -6.579 3.002 1065 3HG1 VAL 137 3HG1 VAL 137 14.723 -8.193 3.504 1066 1HG2 VAL 137 1HG2 VAL 137 13.723 -9.257 1.444 1067 2HG2 VAL 137 2HG2 VAL 137 14.904 -8.093 0.845 1068 3HG2 VAL 137 3HG2 VAL 137 13.277 -8.128 0.165 1069 H THR 138 H THR 138 10.057 -5.975 2.315 1070 HA THR 138 HA THR 138 9.445 -6.863 -0.410 1071 HB THR 138 HB THR 138 7.165 -6.313 1.441 1072 HG1 THR 138 HG1 THR 138 7.408 -8.102 2.493 1073 1HG2 THR 138 1HG2 THR 138 7.090 -8.556 -0.445 1074 2HG2 THR 138 2HG2 THR 138 7.227 -6.956 -1.174 1075 3HG2 THR 138 3HG2 THR 138 5.884 -7.319 -0.091 1076 H PHE 139 H PHE 139 8.472 -5.307 -1.729 1077 HA PHE 139 HA PHE 139 8.257 -2.605 -0.582 1078 1HB PHE 139 1HB PHE 139 9.212 -1.745 -2.751 1079 2HB PHE 139 2HB PHE 139 10.354 -2.612 -1.730 1080 HD1 PHE 139 HD1 PHE 139 8.938 -2.351 -4.968 1081 HD2 PHE 139 HD2 PHE 139 10.734 -5.100 -2.262 1082 HE1 PHE 139 HE1 PHE 139 9.475 -3.844 -6.848 1083 HE2 PHE 139 HE2 PHE 139 11.275 -6.598 -4.137 1084 HZ PHE 139 HZ PHE 139 10.646 -5.970 -6.433 1085 H GLN 140 H GLN 140 6.448 -1.540 -1.096 1086 HA GLN 140 HA GLN 140 4.671 -2.759 -3.093 1087 1HB GLN 140 1HB GLN 140 2.850 -1.567 -1.940 1088 2HB GLN 140 2HB GLN 140 3.729 -2.634 -0.853 1089 1HG GLN 140 1HG GLN 140 4.699 0.138 -0.958 1090 2HG GLN 140 2HG GLN 140 3.082 -0.081 -0.288 1091 1HE2 GLN 140 1HE2 GLN 140 2.872 -1.690 1.443 1092 2HE2 GLN 140 2HE2 GLN 140 4.177 -1.874 2.561 1093 H MET 141 H MET 141 3.751 -1.555 -4.722 1094 HA MET 141 HA MET 141 4.916 1.119 -5.131 1095 1HB MET 141 1HB MET 141 3.899 -0.828 -7.210 1096 2HB MET 141 2HB MET 141 4.633 0.737 -7.532 1097 1HG MET 141 1HG MET 141 6.723 -0.023 -7.204 1098 2HG MET 141 2HG MET 141 6.241 -1.113 -5.905 1099 1HE MET 141 1HE MET 141 6.547 -1.539 -10.289 1100 2HE MET 141 2HE MET 141 5.670 -0.270 -9.434 1101 3HE MET 141 3HE MET 141 4.814 -1.701 -10.006 1102 H THR 142 H THR 142 3.564 2.773 -4.988 1103 HA THR 142 HA THR 142 0.683 2.272 -5.178 1104 HB THR 142 HB THR 142 0.574 4.644 -4.205 1105 HG1 THR 142 HG1 THR 142 2.377 5.612 -3.791 1106 1HG2 THR 142 1HG2 THR 142 1.322 3.883 -1.908 1107 2HG2 THR 142 2HG2 THR 142 1.733 2.346 -2.671 1108 3HG2 THR 142 3HG2 THR 142 0.068 2.928 -2.699 1109 H TYR 143 H TYR 143 -0.645 3.386 -6.574 1110 HA TYR 143 HA TYR 143 0.726 4.965 -8.652 1111 1HB TYR 143 1HB TYR 143 -0.286 2.679 -9.273 1112 2HB TYR 143 2HB TYR 143 -1.850 3.467 -9.087 1113 HD1 TYR 143 HD1 TYR 143 -2.789 3.887 -11.149 1114 HD2 TYR 143 HD2 TYR 143 1.388 4.520 -10.640 1115 HE1 TYR 143 HE1 TYR 143 -2.641 4.729 -13.454 1116 HE2 TYR 143 HE2 TYR 143 1.546 5.365 -12.944 1117 HH TYR 143 HH TYR 143 -0.655 6.509 -14.639 1118 H ILE 144 H ILE 144 0.180 7.033 -8.722 1119 HA ILE 144 HA ILE 144 -2.565 7.825 -8.079 1120 HB ILE 144 HB ILE 144 -1.623 9.829 -6.837 1121 1HG1 ILE 144 1HG1 ILE 144 0.744 8.228 -6.079 1122 2HG1 ILE 144 2HG1 ILE 144 0.792 8.928 -7.694 1123 1HG2 ILE 144 1HG2 ILE 144 -1.096 8.277 -4.767 1124 2HG2 ILE 144 2HG2 ILE 144 -1.712 7.028 -5.851 1125 3HG2 ILE 144 3HG2 ILE 144 -2.724 8.410 -5.430 1126 1HD1 ILE 144 1HD1 ILE 144 0.025 10.680 -5.424 1127 2HD1 ILE 144 2HD1 ILE 144 0.890 11.065 -6.913 1128 3HD1 ILE 144 3HD1 ILE 144 1.718 10.219 -5.605 1129 HA PRO 145 HA PRO 145 -1.337 9.936 -11.930 1130 1HB PRO 145 1HB PRO 145 -3.866 10.339 -12.816 1131 2HB PRO 145 2HB PRO 145 -3.019 8.801 -13.013 1132 1HG PRO 145 1HG PRO 145 -5.046 9.598 -10.957 1133 2HG PRO 145 2HG PRO 145 -4.916 8.084 -11.871 1134 1HD PRO 145 1HD PRO 145 -4.052 8.323 -9.315 1135 2HD PRO 145 2HD PRO 145 -3.271 7.245 -10.490 1136 H GLY 146 H GLY 146 -1.782 12.094 -12.778 1137 1HA GLY 146 1HA GLY 146 -3.162 13.922 -10.960 1138 2HA GLY 146 2HA GLY 146 -1.447 14.195 -11.224 1139 H THR 147 H THR 147 -2.075 16.286 -12.046 1140 HA THR 147 HA THR 147 -3.491 16.313 -14.593 1141 HB THR 147 HB THR 147 -2.286 18.713 -13.237 1142 HG1 THR 147 HG1 THR 147 -3.504 17.840 -11.634 1143 1HG2 THR 147 1HG2 THR 147 -4.840 19.255 -14.222 1144 2HG2 THR 147 2HG2 THR 147 -4.030 18.313 -15.473 1145 3HG2 THR 147 3HG2 THR 147 -3.294 19.798 -14.874 1146 H TYR 148 H TYR 148 -1.834 15.125 -15.740 1147 HA TYR 148 HA TYR 148 0.145 16.923 -16.876 1148 1HB TYR 148 1HB TYR 148 1.063 15.456 -14.857 1149 2HB TYR 148 2HB TYR 148 1.175 14.229 -16.113 1150 HD1 TYR 148 HD1 TYR 148 3.124 14.099 -17.349 1151 HD2 TYR 148 HD2 TYR 148 2.107 17.797 -15.509 1152 HE1 TYR 148 HE1 TYR 148 5.266 15.052 -18.092 1153 HE2 TYR 148 HE2 TYR 148 4.245 18.761 -16.249 1154 HH TYR 148 HH TYR 148 5.925 18.116 -18.350 1155 H ASN 149 H ASN 149 1.426 15.588 -18.641 1156 HA ASN 149 HA ASN 149 -0.524 14.706 -20.509 1157 1HB ASN 149 1HB ASN 149 2.467 14.348 -20.729 1158 2HB ASN 149 2HB ASN 149 1.297 14.432 -22.043 1159 1HD2 ASN 149 1HD2 ASN 149 -0.217 16.575 -21.333 1160 2HD2 ASN 149 2HD2 ASN 149 0.747 18.008 -21.342 1161 H ASN 150 H ASN 150 2.097 13.014 -18.794 1162 HA ASN 150 HA ASN 150 1.072 10.445 -19.698 1163 1HB ASN 150 1HB ASN 150 3.606 11.296 -19.295 1164 2HB ASN 150 2HB ASN 150 3.289 10.541 -17.736 1165 1HD2 ASN 150 1HD2 ASN 150 5.053 9.803 -20.011 1166 2HD2 ASN 150 2HD2 ASN 150 4.631 8.172 -20.393 1167 H GLY 151 H GLY 151 2.146 11.618 -16.501 1168 1HA GLY 151 1HA GLY 151 1.172 11.413 -14.425 1169 2HA GLY 151 2HA GLY 151 -0.338 11.023 -15.236 1170 H ASN 152 H ASN 152 2.706 9.275 -15.565 1171 HA ASN 152 HA ASN 152 1.384 6.929 -14.374 1172 1HB ASN 152 1HB ASN 152 2.915 5.561 -15.739 1173 2HB ASN 152 2HB ASN 152 1.928 6.625 -16.737 1174 1HD2 ASN 152 1HD2 ASN 152 4.493 5.360 -17.305 1175 2HD2 ASN 152 2HD2 ASN 152 5.582 6.643 -17.694 1176 H VAL 153 H VAL 153 2.691 8.914 -12.795 1177 HA VAL 153 HA VAL 153 5.313 7.968 -12.096 1178 HB VAL 153 HB VAL 153 3.537 9.835 -10.520 1179 1HG1 VAL 153 1HG1 VAL 153 6.028 10.654 -10.009 1180 2HG1 VAL 153 2HG1 VAL 153 6.350 8.945 -10.304 1181 3HG1 VAL 153 3HG1 VAL 153 5.210 9.423 -9.046 1182 1HG2 VAL 153 1HG2 VAL 153 5.698 10.975 -12.148 1183 2HG2 VAL 153 2HG2 VAL 153 4.055 11.553 -11.873 1184 3HG2 VAL 153 3HG2 VAL 153 4.358 10.294 -13.070 1185 H TYR 154 H TYR 154 5.861 6.495 -10.610 1186 HA TYR 154 HA TYR 154 3.796 5.569 -8.728 1187 1HB TYR 154 1HB TYR 154 4.557 3.267 -9.030 1188 2HB TYR 154 2HB TYR 154 4.023 3.944 -10.565 1189 HD1 TYR 154 HD1 TYR 154 6.599 2.179 -8.927 1190 HD2 TYR 154 HD2 TYR 154 5.916 4.985 -12.051 1191 HE1 TYR 154 HE1 TYR 154 8.757 1.570 -9.937 1192 HE2 TYR 154 HE2 TYR 154 8.072 4.384 -13.070 1193 HH TYR 154 HH TYR 154 9.603 2.214 -12.998 1194 H PHE 155 H PHE 155 4.446 5.240 -6.665 1195 HA PHE 155 HA PHE 155 7.296 5.711 -6.085 1196 1HB PHE 155 1HB PHE 155 4.891 6.279 -4.339 1197 2HB PHE 155 2HB PHE 155 6.568 6.585 -3.901 1198 HD1 PHE 155 HD1 PHE 155 3.650 7.867 -5.507 1199 HD2 PHE 155 HD2 PHE 155 7.884 8.240 -5.302 1200 HE1 PHE 155 HE1 PHE 155 3.497 10.107 -6.515 1201 HE2 PHE 155 HE2 PHE 155 7.740 10.480 -6.309 1202 HZ PHE 155 HZ PHE 155 5.544 11.417 -6.918 1203 H ALA 156 H ALA 156 8.312 4.476 -4.480 1204 HA ALA 156 HA ALA 156 6.946 1.938 -3.878 1205 1HB ALA 156 1HB ALA 156 8.901 1.658 -5.290 1206 2HB ALA 156 2HB ALA 156 9.185 0.947 -3.702 1207 3HB ALA 156 3HB ALA 156 9.898 2.507 -4.109 1208 H TRP 157 H TRP 157 7.136 1.028 -1.810 1209 HA TRP 157 HA TRP 157 8.205 2.798 0.280 1210 1HB TRP 157 1HB TRP 157 5.575 1.309 0.416 1211 2HB TRP 157 2HB TRP 157 6.275 2.286 1.702 1212 HD1 TRP 157 HD1 TRP 157 4.419 2.580 -1.613 1213 HE1 TRP 157 HE1 TRP 157 3.631 5.012 -1.912 1214 HE3 TRP 157 HE3 TRP 157 6.868 4.720 2.332 1215 HZ2 TRP 157 HZ2 TRP 157 3.999 7.507 -0.643 1216 HZ3 TRP 157 HZ3 TRP 157 6.599 7.134 2.719 1217 HH2 TRP 157 HH2 TRP 157 5.193 8.497 1.260 1218 H MET 158 H MET 158 8.613 1.681 2.342 1219 HA MET 158 HA MET 158 9.675 -0.993 1.831 1220 1HB MET 158 1HB MET 158 10.289 1.193 3.748 1221 2HB MET 158 2HB MET 158 10.582 -0.453 4.291 1222 1HG MET 158 1HG MET 158 12.576 0.587 3.325 1223 2HG MET 158 2HG MET 158 12.067 -0.847 2.435 1224 1HE MET 158 1HE MET 158 14.059 1.266 0.542 1225 2HE MET 158 2HE MET 158 13.086 0.505 -0.717 1226 3HE MET 158 3HE MET 158 13.524 -0.404 0.728 1227 H ARG 159 H ARG 159 8.806 -2.786 2.655 1228 HA ARG 159 HA ARG 159 6.910 -2.536 4.889 1229 1HB ARG 159 1HB ARG 159 5.973 -2.910 2.436 1230 2HB ARG 159 2HB ARG 159 6.405 -4.580 2.775 1231 1HG ARG 159 1HG ARG 159 4.749 -3.029 4.720 1232 2HG ARG 159 2HG ARG 159 4.012 -3.758 3.290 1233 1HD ARG 159 1HD ARG 159 5.762 -5.356 5.128 1234 2HD ARG 159 2HD ARG 159 4.052 -5.112 5.480 1235 HE ARG 159 HE ARG 159 5.182 -6.811 3.456 1236 1HH1 ARG 159 1HH1 ARG 159 2.355 -5.011 4.429 1237 2HH1 ARG 159 2HH1 ARG 159 1.264 -5.980 3.496 1238 1HH2 ARG 159 1HH2 ARG 159 3.747 -8.086 2.228 1239 2HH2 ARG 159 2HH2 ARG 159 2.054 -7.726 2.248 1240 H PHE 160 H PHE 160 7.553 -3.718 6.552 1241 HA PHE 160 HA PHE 160 9.157 -6.133 6.025 1242 1HB PHE 160 1HB PHE 160 9.845 -3.922 7.540 1243 2HB PHE 160 2HB PHE 160 9.305 -5.083 8.748 1244 HD1 PHE 160 HD1 PHE 160 11.910 -4.172 6.434 1245 HD2 PHE 160 HD2 PHE 160 10.410 -7.311 8.886 1246 HE1 PHE 160 HE1 PHE 160 14.090 -5.307 6.307 1247 HE2 PHE 160 HE2 PHE 160 12.587 -8.451 8.764 1248 HZ PHE 160 HZ PHE 160 14.431 -7.449 7.474 1249 H GLN 161 H GLN 161 8.189 -7.991 6.466 1250 HA GLN 161 HA GLN 161 5.912 -7.989 8.326 1251 1HB GLN 161 1HB GLN 161 5.181 -10.032 7.205 1252 2HB GLN 161 2HB GLN 161 5.401 -8.729 6.044 1253 1HG GLN 161 1HG GLN 161 7.854 -9.957 6.048 1254 2HG GLN 161 2HG GLN 161 6.736 -11.307 6.247 1255 1HE2 GLN 161 1HE2 GLN 161 8.433 -10.583 3.980 1256 2HE2 GLN 161 2HE2 GLN 161 7.373 -10.410 2.627 1257 H PHE 162 H PHE 162 6.195 -8.862 10.259 1258 HA PHE 162 HA PHE 162 8.124 -11.058 10.561 1259 1HB PHE 162 1HB PHE 162 8.796 -10.076 12.765 1260 2HB PHE 162 2HB PHE 162 9.286 -9.115 11.373 1261 HD1 PHE 162 HD1 PHE 162 8.289 -6.962 10.935 1262 HD2 PHE 162 HD2 PHE 162 7.079 -9.297 14.280 1263 HE1 PHE 162 HE1 PHE 162 7.175 -4.992 11.901 1264 HE2 PHE 162 HE2 PHE 162 5.961 -7.332 15.252 1265 HZ PHE 162 HZ PHE 162 6.008 -5.176 14.062 1266 H LEU 163 H LEU 163 7.726 -12.451 12.377 1267 HA LEU 163 HA LEU 163 4.884 -12.684 12.950 1268 1HB LEU 163 1HB LEU 163 6.962 -14.510 12.511 1269 2HB LEU 163 2HB LEU 163 6.544 -14.692 14.204 1270 HG LEU 163 HG LEU 163 4.075 -14.750 13.161 1271 1HD1 LEU 163 1HD1 LEU 163 5.382 -14.580 10.860 1272 2HD1 LEU 163 2HD1 LEU 163 3.908 -15.533 11.034 1273 3HD1 LEU 163 3HD1 LEU 163 5.482 -16.326 11.081 1274 1HD2 LEU 163 1HD2 LEU 163 4.215 -17.189 13.282 1275 2HD2 LEU 163 2HD2 LEU 163 5.054 -16.429 14.633 1276 3HD2 LEU 163 3HD2 LEU 163 5.976 -17.089 13.284 1277 H GLU 164 H GLU 164 4.137 -13.161 15.141 1278 HA GLU 164 HA GLU 164 5.470 -11.424 17.069 1279 1HB GLU 164 1HB GLU 164 3.383 -11.625 18.366 1280 2HB GLU 164 2HB GLU 164 3.092 -11.063 16.726 1281 1HG GLU 164 1HG GLU 164 1.564 -12.652 16.547 1282 2HG GLU 164 2HG GLU 164 2.878 -13.826 16.564 1283 HE2 GLU 164 HE2 GLU 164 0.903 -13.270 19.974 1284 H HIS 165 H HIS 165 7.223 -12.797 17.601 1285 HA HIS 165 HA HIS 165 6.520 -15.264 19.030 1286 1HB HIS 165 1HB HIS 165 8.639 -14.577 17.240 1287 2HB HIS 165 2HB HIS 165 9.343 -14.970 18.805 1288 HD1 HIS 165 HD1 HIS 165 9.424 -17.402 19.458 1289 HD2 HIS 165 HD2 HIS 165 7.123 -16.721 16.066 1290 HE1 HIS 165 HE1 HIS 165 8.894 -19.681 18.538 1291 HE2 HIS 165 HE2 HIS 165 7.426 -19.247 16.537 1292 H HIS 166 H HIS 166 8.028 -12.134 19.397 1293 HA HIS 166 HA HIS 166 8.680 -10.945 21.222 1294 1HB HIS 166 1HB HIS 166 6.380 -12.268 21.982 1295 2HB HIS 166 2HB HIS 166 7.514 -12.693 23.260 1296 HD1 HIS 166 HD1 HIS 166 5.110 -10.915 23.892 1297 HD2 HIS 166 HD2 HIS 166 8.848 -9.451 22.820 1298 HE1 HIS 166 HE1 HIS 166 5.202 -8.574 24.806 1299 HE2 HIS 166 HE2 HIS 166 7.439 -7.678 24.070 1300 H HIS 167 H HIS 167 9.722 -11.286 23.540 1301 HA HIS 167 HA HIS 167 12.047 -12.915 23.079 1302 1HB HIS 167 1HB HIS 167 11.582 -10.583 24.459 1303 2HB HIS 167 2HB HIS 167 11.744 -11.759 25.760 1304 HD1 HIS 167 HD1 HIS 167 13.800 -9.417 24.858 1305 HD2 HIS 167 HD2 HIS 167 14.185 -13.509 24.250 1306 HE1 HIS 167 HE1 HIS 167 16.265 -9.825 24.575 1307 HE2 HIS 167 HE2 HIS 167 16.481 -12.319 24.291 1308 H HIS 168 H HIS 168 12.637 -14.782 24.079 1309 HA HIS 168 HA HIS 168 10.575 -16.078 25.724 1310 1HB HIS 168 1HB HIS 168 11.657 -17.025 23.462 1311 2HB HIS 168 2HB HIS 168 12.837 -17.652 24.608 1312 HD1 HIS 168 HD1 HIS 168 9.831 -18.608 22.998 1313 HD2 HIS 168 HD2 HIS 168 11.342 -19.093 26.837 1314 HE1 HIS 168 HE1 HIS 168 8.539 -20.523 23.991 1315 HE2 HIS 168 HE2 HIS 168 9.531 -20.854 26.283 1316 H HIS 169 H HIS 169 11.461 -14.729 27.520 1317 HA HIS 169 HA HIS 169 13.676 -16.163 28.817 1318 1HB HIS 169 1HB HIS 169 14.005 -13.656 27.857 1319 2HB HIS 169 2HB HIS 169 13.394 -13.289 29.466 1320 HD1 HIS 169 HD1 HIS 169 16.463 -13.695 27.795 1321 HD2 HIS 169 HD2 HIS 169 15.001 -14.977 31.468 1322 HE1 HIS 169 HE1 HIS 169 18.494 -14.218 29.181 1323 HE2 HIS 169 HE2 HIS 169 17.586 -14.906 31.429 1324 H HIS 170 H HIS 170 10.799 -16.474 29.077 1325 HA HIS 170 HA HIS 170 9.907 -15.201 31.461 1326 1HB HIS 170 1HB HIS 170 8.919 -17.537 29.845 1327 2HB HIS 170 2HB HIS 170 8.169 -17.113 31.380 1328 HD1 HIS 170 HD1 HIS 170 9.047 -13.974 30.127 1329 HD2 HIS 170 HD2 HIS 170 6.131 -16.739 29.071 1330 HE1 HIS 170 HE1 HIS 170 7.308 -12.668 28.864 1331 HE2 HIS 170 HE2 HIS 170 5.598 -14.378 28.160 Start of MODEL 9 1 1H MET 1 1H MET 1 20.030 -34.577 9.899 2 2H MET 1 2H MET 1 21.534 -35.356 10.171 3 H MET 1 H MET 1 20.757 -35.281 10.347 4 3H MET 1 3H MET 1 21.225 -34.581 8.671 5 HA MET 1 HA MET 1 21.707 -33.398 11.307 6 1HB MET 1 1HB MET 1 23.598 -33.953 9.798 7 2HB MET 1 2HB MET 1 22.879 -32.939 8.554 8 1HG MET 1 1HG MET 1 24.676 -31.780 9.691 9 2HG MET 1 2HG MET 1 23.130 -30.985 9.983 10 1HE MET 1 1HE MET 1 26.297 -32.494 12.285 11 2HE MET 1 2HE MET 1 25.577 -33.508 11.036 12 3HE MET 1 3HE MET 1 25.263 -33.848 12.737 13 H ASN 2 H ASN 2 20.074 -33.002 8.242 14 HA ASN 2 HA ASN 2 19.606 -30.204 8.467 15 1HB ASN 2 1HB ASN 2 17.958 -32.195 6.902 16 2HB ASN 2 2HB ASN 2 18.118 -30.468 6.601 17 1HD2 ASN 2 1HD2 ASN 2 18.632 -32.707 4.826 18 2HD2 ASN 2 2HD2 ASN 2 20.282 -32.566 4.335 19 H ALA 3 H ALA 3 17.879 -33.075 9.513 20 HA ALA 3 HA ALA 3 15.386 -32.027 10.095 21 1HB ALA 3 1HB ALA 3 15.031 -33.894 11.465 22 2HB ALA 3 2HB ALA 3 16.738 -34.020 11.887 23 3HB ALA 3 3HB ALA 3 16.198 -34.440 10.261 24 H ASP 4 H ASP 4 18.402 -31.471 11.697 25 HA ASP 4 HA ASP 4 17.271 -30.533 14.162 26 1HB ASP 4 1HB ASP 4 20.045 -30.242 12.991 27 2HB ASP 4 2HB ASP 4 19.591 -29.724 14.613 28 HD2 ASP 4 HD2 ASP 4 20.298 -32.864 15.745 29 H GLU 5 H GLU 5 18.976 -28.913 11.484 30 HA GLU 5 HA GLU 5 18.321 -26.297 12.367 31 1HB GLU 5 1HB GLU 5 19.547 -27.496 9.939 32 2HB GLU 5 2HB GLU 5 18.876 -25.879 9.780 33 1HG GLU 5 1HG GLU 5 20.537 -24.944 10.940 34 2HG GLU 5 2HG GLU 5 20.551 -26.231 12.145 35 HE2 GLU 5 HE2 GLU 5 23.463 -27.367 10.765 36 H TRP 6 H TRP 6 16.677 -28.664 10.438 37 HA TRP 6 HA TRP 6 14.848 -26.814 9.216 38 1HB TRP 6 1HB TRP 6 15.580 -29.239 8.469 39 2HB TRP 6 2HB TRP 6 14.225 -29.726 9.482 40 HD1 TRP 6 HD1 TRP 6 12.207 -30.186 7.989 41 HE1 TRP 6 HE1 TRP 6 11.135 -29.072 5.931 42 HE3 TRP 6 HE3 TRP 6 15.583 -26.416 7.253 43 HZ2 TRP 6 HZ2 TRP 6 11.651 -26.884 4.222 44 HZ3 TRP 6 HZ3 TRP 6 15.221 -24.856 5.385 45 HH2 TRP 6 HH2 TRP 6 13.295 -25.088 3.901 46 H MET 7 H MET 7 14.936 -28.738 12.126 47 HA MET 7 HA MET 7 12.173 -28.584 12.747 48 1HB MET 7 1HB MET 7 13.652 -30.259 13.756 49 2HB MET 7 2HB MET 7 14.549 -28.986 14.573 50 1HG MET 7 1HG MET 7 13.208 -29.444 16.295 51 2HG MET 7 2HG MET 7 12.029 -28.469 15.420 52 1HE MET 7 1HE MET 7 10.179 -31.310 17.182 53 2HE MET 7 2HE MET 7 11.524 -30.250 17.606 54 3HE MET 7 3HE MET 7 11.807 -31.970 17.337 55 H THR 8 H THR 8 14.986 -26.671 13.761 56 HA THR 8 HA THR 8 13.623 -24.949 15.509 57 HB THR 8 HB THR 8 15.566 -23.425 15.174 58 HG1 THR 8 HG1 THR 8 16.462 -25.389 13.340 59 1HG2 THR 8 1HG2 THR 8 15.600 -25.875 16.392 60 2HG2 THR 8 2HG2 THR 8 16.856 -24.642 16.511 61 3HG2 THR 8 3HG2 THR 8 17.006 -25.944 15.330 62 H THR 9 H THR 9 14.315 -24.697 12.047 63 HA THR 9 HA THR 9 13.339 -22.103 11.644 64 HB THR 9 HB THR 9 12.855 -23.113 9.254 65 HG1 THR 9 HG1 THR 9 12.999 -25.286 9.934 66 1HG2 THR 9 1HG2 THR 9 15.246 -23.026 8.686 67 2HG2 THR 9 2HG2 THR 9 15.627 -22.932 10.405 68 3HG2 THR 9 3HG2 THR 9 14.712 -21.637 9.632 69 H PHE 10 H PHE 10 11.698 -25.242 11.469 70 HA PHE 10 HA PHE 10 9.184 -24.200 10.679 71 1HB PHE 10 1HB PHE 10 10.278 -26.794 11.479 72 2HB PHE 10 2HB PHE 10 8.609 -26.563 11.988 73 HD1 PHE 10 HD1 PHE 10 7.181 -25.327 9.994 74 HD2 PHE 10 HD2 PHE 10 10.515 -27.926 9.511 75 HE1 PHE 10 HE1 PHE 10 6.407 -25.890 7.727 76 HE2 PHE 10 HE2 PHE 10 9.749 -28.495 7.243 77 HZ PHE 10 HZ PHE 10 7.692 -27.476 6.348 78 H ARG 11 H ARG 11 10.576 -25.033 13.825 79 HA ARG 11 HA ARG 11 8.288 -24.617 15.384 80 1HB ARG 11 1HB ARG 11 10.652 -25.586 15.984 81 2HB ARG 11 2HB ARG 11 11.006 -23.922 16.427 82 1HG ARG 11 1HG ARG 11 8.731 -24.187 17.759 83 2HG ARG 11 2HG ARG 11 9.200 -25.888 17.711 84 1HD ARG 11 1HD ARG 11 11.543 -24.777 18.430 85 2HD ARG 11 2HD ARG 11 10.425 -23.615 19.144 86 HE ARG 11 HE ARG 11 9.489 -26.084 19.898 87 1HH1 ARG 11 1HH1 ARG 11 12.474 -24.314 20.276 88 2HH1 ARG 11 2HH1 ARG 11 12.873 -25.064 21.784 89 1HH2 ARG 11 1HH2 ARG 11 10.013 -27.071 21.883 90 2HH2 ARG 11 2HH2 ARG 11 11.477 -26.630 22.697 91 H GLU 12 H GLU 12 10.605 -22.380 14.034 92 HA GLU 12 HA GLU 12 9.910 -20.132 15.615 93 1HB GLU 12 1HB GLU 12 11.904 -20.634 13.876 94 2HB GLU 12 2HB GLU 12 10.848 -19.687 12.837 95 1HG GLU 12 1HG GLU 12 10.835 -18.091 14.956 96 2HG GLU 12 2HG GLU 12 12.390 -18.875 15.230 97 HE2 GLU 12 HE2 GLU 12 13.824 -17.288 12.491 98 H ASN 13 H ASN 13 8.824 -21.280 12.441 99 HA ASN 13 HA ASN 13 7.094 -19.097 11.926 100 1HB ASN 13 1HB ASN 13 7.618 -21.752 10.732 101 2HB ASN 13 2HB ASN 13 6.010 -21.093 10.444 102 1HD2 ASN 13 1HD2 ASN 13 9.200 -21.121 9.448 103 2HD2 ASN 13 2HD2 ASN 13 9.152 -19.763 8.381 104 H ILE 14 H ILE 14 6.402 -22.429 12.997 105 HA ILE 14 HA ILE 14 3.656 -22.079 13.400 106 HB ILE 14 HB ILE 14 4.728 -24.288 13.320 107 1HG1 ILE 14 1HG1 ILE 14 3.304 -23.825 15.950 108 2HG1 ILE 14 2HG1 ILE 14 2.499 -23.969 14.390 109 1HG2 ILE 14 1HG2 ILE 14 6.715 -23.574 14.699 110 2HG2 ILE 14 2HG2 ILE 14 6.046 -25.161 15.079 111 3HG2 ILE 14 3HG2 ILE 14 5.695 -23.783 16.122 112 1HD1 ILE 14 1HD1 ILE 14 2.408 -26.155 14.676 113 2HD1 ILE 14 2HD1 ILE 14 3.304 -26.017 16.188 114 3HD1 ILE 14 3HD1 ILE 14 4.171 -26.220 14.665 115 H ALA 15 H ALA 15 6.404 -21.389 15.468 116 HA ALA 15 HA ALA 15 4.990 -21.014 17.881 117 1HB ALA 15 1HB ALA 15 7.629 -19.910 16.934 118 2HB ALA 15 2HB ALA 15 7.356 -21.321 17.956 119 3HB ALA 15 3HB ALA 15 7.007 -19.706 18.571 120 H GLN 16 H GLN 16 6.222 -18.615 15.544 121 HA GLN 16 HA GLN 16 5.075 -16.371 16.764 122 1HB GLN 16 1HB GLN 16 5.725 -16.813 13.844 123 2HB GLN 16 2HB GLN 16 5.409 -15.252 14.588 124 1HG GLN 16 1HG GLN 16 7.402 -15.286 15.792 125 2HG GLN 16 2HG GLN 16 7.608 -17.024 15.579 126 1HE2 GLN 16 1HE2 GLN 16 7.863 -13.897 14.064 127 2HE2 GLN 16 2HE2 GLN 16 8.863 -14.396 12.746 128 H THR 17 H THR 17 3.758 -18.733 14.553 129 HA THR 17 HA THR 17 1.418 -17.242 13.877 130 HB THR 17 HB THR 17 1.759 -20.237 13.732 131 HG1 THR 17 HG1 THR 17 2.668 -18.217 11.974 132 1HG2 THR 17 1HG2 THR 17 0.341 -20.008 11.721 133 2HG2 THR 17 2HG2 THR 17 0.097 -18.310 12.131 134 3HG2 THR 17 3HG2 THR 17 -0.480 -19.573 13.219 135 H TRP 18 H TRP 18 2.070 -19.926 16.115 136 HA TRP 18 HA TRP 18 -0.538 -20.193 17.105 137 1HB TRP 18 1HB TRP 18 1.927 -21.415 17.561 138 2HB TRP 18 2HB TRP 18 1.485 -20.732 19.122 139 HD1 TRP 18 HD1 TRP 18 0.362 -23.356 16.577 140 HE1 TRP 18 HE1 TRP 18 -1.328 -24.931 17.709 141 HE3 TRP 18 HE3 TRP 18 -0.249 -20.851 20.990 142 HZ2 TRP 18 HZ2 TRP 18 -2.735 -25.091 20.152 143 HZ3 TRP 18 HZ3 TRP 18 -1.785 -21.781 22.672 144 HH2 TRP 18 HH2 TRP 18 -3.002 -23.857 22.259 145 H GLN 19 H GLN 19 2.183 -18.226 18.240 146 HA GLN 19 HA GLN 19 0.936 -17.204 20.543 147 1HB GLN 19 1HB GLN 19 3.403 -16.855 19.180 148 2HB GLN 19 2HB GLN 19 2.720 -15.256 19.442 149 1HG GLN 19 1HG GLN 19 3.930 -15.539 21.359 150 2HG GLN 19 2HG GLN 19 2.348 -16.127 21.872 151 1HE2 GLN 19 1HE2 GLN 19 5.141 -17.471 20.132 152 2HE2 GLN 19 2HE2 GLN 19 5.260 -18.905 21.088 153 H GLN 20 H GLN 20 1.415 -15.629 17.376 154 HA GLN 20 HA GLN 20 -1.137 -14.242 17.757 155 1HB GLN 20 1HB GLN 20 1.308 -12.799 16.742 156 2HB GLN 20 2HB GLN 20 -0.246 -12.109 17.194 157 1HG GLN 20 1HG GLN 20 1.462 -13.530 19.199 158 2HG GLN 20 2HG GLN 20 1.728 -11.833 18.800 159 1HE2 GLN 20 1HE2 GLN 20 0.783 -13.239 21.266 160 2HE2 GLN 20 2HE2 GLN 20 -0.689 -12.439 21.689 161 HA PRO 21 HA PRO 21 -1.467 -15.764 13.555 162 1HB PRO 21 1HB PRO 21 -3.962 -14.841 13.054 163 2HB PRO 21 2HB PRO 21 -3.657 -16.261 14.064 164 1HG PRO 21 1HG PRO 21 -4.231 -13.439 14.885 165 2HG PRO 21 2HG PRO 21 -4.875 -14.951 15.552 166 1HD PRO 21 1HD PRO 21 -2.857 -13.570 16.727 167 2HD PRO 21 2HD PRO 21 -2.994 -15.337 16.823 168 H GLU 22 H GLU 22 -2.406 -12.451 14.420 169 HA GLU 22 HA GLU 22 -1.969 -11.509 11.718 170 1HB GLU 22 1HB GLU 22 -2.457 -9.807 14.157 171 2HB GLU 22 2HB GLU 22 -2.770 -9.402 12.475 172 1HG GLU 22 1HG GLU 22 -4.325 -11.596 12.768 173 2HG GLU 22 2HG GLU 22 -4.398 -10.910 14.391 174 HE2 GLU 22 HE2 GLU 22 -5.858 -7.934 13.006 175 H HIS 23 H HIS 23 -0.237 -10.394 10.975 176 HA HIS 23 HA HIS 23 2.060 -10.177 12.792 177 1HB HIS 23 1HB HIS 23 2.070 -10.076 9.770 178 2HB HIS 23 2HB HIS 23 3.466 -10.227 10.832 179 HD1 HIS 23 HD1 HIS 23 2.648 -12.505 12.639 180 HD2 HIS 23 HD2 HIS 23 1.922 -12.486 8.547 181 HE1 HIS 23 HE1 HIS 23 2.390 -14.922 11.991 182 HE2 HIS 23 HE2 HIS 23 2.036 -14.890 9.497 183 H TYR 24 H TYR 24 3.128 -8.272 13.104 184 HA TYR 24 HA TYR 24 1.678 -5.863 12.561 185 1HB TYR 24 1HB TYR 24 4.346 -6.407 13.863 186 2HB TYR 24 2HB TYR 24 3.698 -4.782 13.661 187 HD1 TYR 24 HD1 TYR 24 4.011 -7.396 15.912 188 HD2 TYR 24 HD2 TYR 24 1.136 -4.594 14.505 189 HE1 TYR 24 HE1 TYR 24 2.750 -7.647 18.007 190 HE2 TYR 24 HE2 TYR 24 -0.133 -4.836 16.598 191 HH TYR 24 HH TYR 24 -0.181 -7.035 18.476 192 H ASP 25 H ASP 25 1.691 -4.946 10.619 193 HA ASP 25 HA ASP 25 3.895 -5.311 8.792 194 1HB ASP 25 1HB ASP 25 1.193 -4.026 8.635 195 2HB ASP 25 2HB ASP 25 2.402 -3.649 7.412 196 HD2 ASP 25 HD2 ASP 25 0.501 -7.033 7.166 197 H LEU 26 H LEU 26 5.282 -3.734 8.024 198 HA LEU 26 HA LEU 26 5.268 -1.172 9.477 199 1HB LEU 26 1HB LEU 26 7.019 -2.617 10.370 200 2HB LEU 26 2HB LEU 26 7.662 -2.865 8.757 201 HG LEU 26 HG LEU 26 8.190 -0.435 8.640 202 1HD1 LEU 26 1HD1 LEU 26 8.303 0.537 11.108 203 2HD1 LEU 26 2HD1 LEU 26 6.901 -0.514 11.307 204 3HD1 LEU 26 3HD1 LEU 26 6.888 0.749 10.077 205 1HD2 LEU 26 1HD2 LEU 26 10.107 -1.523 9.156 206 2HD2 LEU 26 2HD2 LEU 26 9.398 -2.344 10.547 207 3HD2 LEU 26 3HD2 LEU 26 9.906 -0.661 10.681 208 H TYR 27 H TYR 27 5.748 0.648 8.318 209 HA TYR 27 HA TYR 27 6.347 0.291 5.458 210 1HB TYR 27 1HB TYR 27 4.405 2.290 6.637 211 2HB TYR 27 2HB TYR 27 4.824 2.140 4.933 212 HD1 TYR 27 HD1 TYR 27 2.447 1.301 7.340 213 HD2 TYR 27 HD2 TYR 27 4.469 -0.334 3.972 214 HE1 TYR 27 HE1 TYR 27 0.627 -0.327 7.044 215 HE2 TYR 27 HE2 TYR 27 2.654 -1.965 3.666 216 HH TYR 27 HH TYR 27 0.230 -2.481 6.026 217 H ILE 28 H ILE 28 8.250 1.173 5.025 218 HA ILE 28 HA ILE 28 8.884 3.806 6.140 219 HB ILE 28 HB ILE 28 11.196 3.147 6.610 220 1HG1 ILE 28 1HG1 ILE 28 11.240 1.226 4.997 221 2HG1 ILE 28 2HG1 ILE 28 11.918 0.854 6.578 222 1HG2 ILE 28 1HG2 ILE 28 9.846 3.158 8.513 223 2HG2 ILE 28 2HG2 ILE 28 10.656 1.591 8.572 224 3HG2 ILE 28 3HG2 ILE 28 8.984 1.700 8.022 225 1HD1 ILE 28 1HD1 ILE 28 10.608 -0.929 6.603 226 2HD1 ILE 28 2HD1 ILE 28 9.729 -0.379 5.176 227 3HD1 ILE 28 3HD1 ILE 28 9.235 0.163 6.780 228 HA PRO 29 HA PRO 29 10.285 5.041 2.161 229 1HB PRO 29 1HB PRO 29 12.917 5.695 3.400 230 2HB PRO 29 2HB PRO 29 11.858 6.704 2.409 231 1HG PRO 29 1HG PRO 29 11.997 7.068 5.040 232 2HG PRO 29 2HG PRO 29 10.450 7.203 4.184 233 1HD PRO 29 1HD PRO 29 11.476 4.996 5.910 234 2HD PRO 29 2HD PRO 29 9.820 5.609 5.724 235 H ALA 30 H ALA 30 11.741 4.503 0.440 236 HA ALA 30 HA ALA 30 12.896 1.850 0.760 237 1HB ALA 30 1HB ALA 30 11.935 3.480 -1.508 238 2HB ALA 30 2HB ALA 30 11.748 1.756 -1.186 239 3HB ALA 30 3HB ALA 30 13.265 2.371 -1.842 240 H ILE 31 H ILE 31 14.900 1.653 -0.942 241 HA ILE 31 HA ILE 31 16.944 3.402 0.213 242 HB ILE 31 HB ILE 31 18.557 1.747 -0.739 243 1HG1 ILE 31 1HG1 ILE 31 16.348 -0.212 -1.091 244 2HG1 ILE 31 2HG1 ILE 31 16.583 0.968 -2.376 245 1HG2 ILE 31 1HG2 ILE 31 18.368 0.312 1.060 246 2HG2 ILE 31 2HG2 ILE 31 16.607 0.264 0.971 247 3HG2 ILE 31 3HG2 ILE 31 17.419 1.698 1.598 248 1HD1 ILE 31 1HD1 ILE 31 19.125 0.101 -1.955 249 2HD1 ILE 31 2HD1 ILE 31 18.027 -0.526 -3.185 250 3HD1 ILE 31 3HD1 ILE 31 18.185 -1.357 -1.637 251 H THR 32 H THR 32 18.342 4.620 -1.011 252 HA THR 32 HA THR 32 17.385 5.469 -3.569 253 HB THR 32 HB THR 32 18.425 7.029 -1.971 254 HG1 THR 32 HG1 THR 32 19.951 6.791 -4.348 255 1HG2 THR 32 1HG2 THR 32 20.659 7.043 -1.382 256 2HG2 THR 32 2HG2 THR 32 21.111 5.929 -2.673 257 3HG2 THR 32 3HG2 THR 32 20.227 5.337 -1.267 258 H TRP 33 H TRP 33 20.265 3.722 -2.446 259 HA TRP 33 HA TRP 33 20.497 2.492 -5.078 260 1HB TRP 33 1HB TRP 33 22.196 4.613 -4.237 261 2HB TRP 33 2HB TRP 33 23.152 3.135 -4.236 262 HD1 TRP 33 HD1 TRP 33 20.886 5.142 -6.655 263 HE1 TRP 33 HE1 TRP 33 21.745 4.755 -9.050 264 HE3 TRP 33 HE3 TRP 33 24.568 1.738 -5.658 265 HZ2 TRP 33 HZ2 TRP 33 23.721 3.211 -10.345 266 HZ3 TRP 33 HZ3 TRP 33 25.896 0.854 -7.531 267 HH2 TRP 33 HH2 TRP 33 25.480 1.576 -9.826 268 H HIS 34 H HIS 34 22.674 2.697 -2.273 269 HA HIS 34 HA HIS 34 22.012 -0.001 -1.458 270 1HB HIS 34 1HB HIS 34 24.564 0.699 -2.844 271 2HB HIS 34 2HB HIS 34 24.617 -0.471 -1.528 272 HD1 HIS 34 HD1 HIS 34 24.788 -0.700 -4.884 273 HD2 HIS 34 HD2 HIS 34 22.005 -2.254 -2.218 274 HE1 HIS 34 HE1 HIS 34 23.729 -2.645 -6.076 275 HE2 HIS 34 HE2 HIS 34 21.989 -3.516 -4.475 276 H ALA 35 H ALA 35 24.857 2.105 -1.045 277 HA ALA 35 HA ALA 35 25.815 3.026 0.801 278 1HB ALA 35 1HB ALA 35 23.345 2.986 2.410 279 2HB ALA 35 2HB ALA 35 23.248 3.830 0.864 280 3HB ALA 35 3HB ALA 35 24.453 4.313 2.058 281 H ARG 36 H ARG 36 27.056 1.170 1.255 282 HA ARG 36 HA ARG 36 26.131 -0.315 3.622 283 1HB ARG 36 1HB ARG 36 27.618 -1.417 1.233 284 2HB ARG 36 2HB ARG 36 27.387 -2.294 2.739 285 1HG ARG 36 1HG ARG 36 25.070 -1.233 1.160 286 2HG ARG 36 2HG ARG 36 25.797 -2.805 0.819 287 1HD ARG 36 1HD ARG 36 24.188 -3.460 2.291 288 2HD ARG 36 2HD ARG 36 25.486 -3.104 3.430 289 HE ARG 36 HE ARG 36 24.261 -1.338 4.227 290 1HH1 ARG 36 1HH1 ARG 36 22.884 -2.405 1.203 291 2HH1 ARG 36 2HH1 ARG 36 21.479 -1.403 1.346 292 1HH2 ARG 36 1HH2 ARG 36 22.414 -0.020 4.416 293 2HH2 ARG 36 2HH2 ARG 36 21.212 -0.048 3.169 294 H PHE 37 H PHE 37 29.145 -0.191 1.728 295 HA PHE 37 HA PHE 37 30.572 0.450 4.223 296 1HB PHE 37 1HB PHE 37 31.542 -0.949 1.723 297 2HB PHE 37 2HB PHE 37 32.577 -0.504 3.076 298 HD1 PHE 37 HD1 PHE 37 31.987 -1.470 5.371 299 HD2 PHE 37 HD2 PHE 37 30.425 -2.981 1.712 300 HE1 PHE 37 HE1 PHE 37 31.448 -3.596 6.485 301 HE2 PHE 37 HE2 PHE 37 29.882 -5.110 2.820 302 HZ PHE 37 HZ PHE 37 30.393 -5.420 5.210 303 H ALA 38 H ALA 38 29.270 2.411 2.537 304 HA ALA 38 HA ALA 38 31.446 3.766 1.153 305 1HB ALA 38 1HB ALA 38 29.444 5.493 0.886 306 2HB ALA 38 2HB ALA 38 28.496 4.050 1.246 307 3HB ALA 38 3HB ALA 38 29.594 4.062 -0.134 308 H TYR 39 H TYR 39 32.672 5.270 2.068 309 HA TYR 39 HA TYR 39 32.263 6.081 4.771 310 1HB TYR 39 1HB TYR 39 34.492 5.798 3.524 311 2HB TYR 39 2HB TYR 39 34.174 7.391 2.845 312 HD1 TYR 39 HD1 TYR 39 34.589 5.581 6.064 313 HD2 TYR 39 HD2 TYR 39 34.711 9.327 4.052 314 HE1 TYR 39 HE1 TYR 39 35.557 6.621 8.072 315 HE2 TYR 39 HE2 TYR 39 35.681 10.377 6.053 316 HH TYR 39 HH TYR 39 37.173 9.029 8.299 317 H ASP 40 H ASP 40 31.732 8.102 5.591 318 HA ASP 40 HA ASP 40 30.171 9.775 3.766 319 1HB ASP 40 1HB ASP 40 29.258 10.776 5.863 320 2HB ASP 40 2HB ASP 40 28.969 9.044 5.727 321 HD2 ASP 40 HD2 ASP 40 31.523 10.286 8.503 322 H LYS 41 H LYS 41 30.291 12.122 3.982 323 HA LYS 41 HA LYS 41 33.066 12.977 4.361 324 1HB LYS 41 1HB LYS 41 31.462 13.418 2.267 325 2HB LYS 41 2HB LYS 41 31.022 14.820 3.234 326 1HG LYS 41 1HG LYS 41 32.724 15.675 1.970 327 2HG LYS 41 2HG LYS 41 33.610 15.144 3.402 328 1HD LYS 41 1HD LYS 41 33.837 12.908 2.053 329 2HD LYS 41 2HD LYS 41 33.528 13.954 0.665 330 1HE LYS 41 1HE LYS 41 35.861 13.907 0.859 331 2HE LYS 41 2HE LYS 41 35.387 15.438 1.594 332 1HZ LYS 41 1HZ LYS 41 35.863 12.966 3.161 333 2HZ LYS 41 2HZ LYS 41 35.686 14.542 3.748 334 3HZ LYS 41 3HZ LYS 41 37.065 14.121 2.863 335 H GLU 42 H GLU 42 33.644 14.683 5.681 336 HA GLU 42 HA GLU 42 31.560 15.928 7.315 337 1HB GLU 42 1HB GLU 42 32.492 13.911 8.507 338 2HB GLU 42 2HB GLU 42 34.047 14.729 8.536 339 1HG GLU 42 1HG GLU 42 32.916 15.004 10.648 340 2HG GLU 42 2HG GLU 42 33.053 16.558 9.825 341 HE2 GLU 42 HE2 GLU 42 29.643 16.942 9.709 342 H LYS 43 H LYS 43 31.814 18.042 7.082 343 HA LYS 43 HA LYS 43 34.393 19.264 7.528 344 1HB LYS 43 1HB LYS 43 33.160 19.092 4.833 345 2HB LYS 43 2HB LYS 43 33.852 20.643 5.289 346 1HG LYS 43 1HG LYS 43 35.995 19.569 5.729 347 2HG LYS 43 2HG LYS 43 35.303 18.004 5.294 348 1HD LYS 43 1HD LYS 43 34.916 18.757 3.033 349 2HD LYS 43 2HD LYS 43 35.460 20.384 3.447 350 1HE LYS 43 1HE LYS 43 37.641 19.818 3.358 351 2HE LYS 43 2HE LYS 43 37.361 18.222 4.054 352 1HZ LYS 43 1HZ LYS 43 37.097 19.071 1.235 353 2HZ LYS 43 2HZ LYS 43 36.340 17.669 1.804 354 3HZ LYS 43 3HZ LYS 43 38.024 17.809 1.876 355 H THR 44 H THR 44 31.048 19.776 6.450 356 HA THR 44 HA THR 44 30.729 21.840 8.466 357 HB THR 44 HB THR 44 31.493 23.188 6.636 358 HG1 THR 44 HG1 THR 44 28.664 23.325 6.677 359 1HG2 THR 44 1HG2 THR 44 29.288 22.336 4.836 360 2HG2 THR 44 2HG2 THR 44 30.770 21.381 4.895 361 3HG2 THR 44 3HG2 THR 44 30.838 23.086 4.453 362 H ASP 45 H ASP 45 29.233 20.138 5.732 363 HA ASP 45 HA ASP 45 26.563 20.550 6.411 364 1HB ASP 45 1HB ASP 45 27.795 19.319 4.360 365 2HB ASP 45 2HB ASP 45 27.278 17.904 5.273 366 HD2 ASP 45 HD2 ASP 45 24.652 19.684 3.092 367 H ARG 46 H ARG 46 25.905 20.252 8.467 368 HA ARG 46 HA ARG 46 26.062 17.522 9.528 369 1HB ARG 46 1HB ARG 46 27.803 19.048 10.574 370 2HB ARG 46 2HB ARG 46 26.465 19.951 11.270 371 1HG ARG 46 1HG ARG 46 25.918 18.284 12.737 372 2HG ARG 46 2HG ARG 46 26.582 17.012 11.710 373 1HD ARG 46 1HD ARG 46 28.228 17.052 13.267 374 2HD ARG 46 2HD ARG 46 28.835 18.346 12.234 375 HE ARG 46 HE ARG 46 27.191 19.585 14.044 376 1HH1 ARG 46 1HH1 ARG 46 30.028 17.562 14.232 377 2HH1 ARG 46 2HH1 ARG 46 30.593 18.276 15.706 378 1HH2 ARG 46 1HH2 ARG 46 27.931 20.525 15.982 379 2HH2 ARG 46 2HH2 ARG 46 29.403 19.958 16.700 380 H TYR 47 H TYR 47 23.898 17.221 8.950 381 HA TYR 47 HA TYR 47 21.867 19.036 9.898 382 1HB TYR 47 1HB TYR 47 22.031 17.026 7.917 383 2HB TYR 47 2HB TYR 47 20.794 16.505 9.055 384 HD1 TYR 47 HD1 TYR 47 18.632 17.316 8.828 385 HD2 TYR 47 HD2 TYR 47 21.843 19.495 7.085 386 HE1 TYR 47 HE1 TYR 47 17.017 18.844 7.777 387 HE2 TYR 47 HE2 TYR 47 20.239 21.029 6.029 388 HH TYR 47 HH TYR 47 16.954 21.129 6.886 389 H ASN 48 H ASN 48 20.274 18.575 11.445 390 HA ASN 48 HA ASN 48 21.209 17.017 13.667 391 1HB ASN 48 1HB ASN 48 18.967 18.897 13.152 392 2HB ASN 48 2HB ASN 48 18.739 17.723 14.445 393 1HD2 ASN 48 1HD2 ASN 48 18.711 20.245 15.192 394 2HD2 ASN 48 2HD2 ASN 48 20.175 20.698 15.989 395 H GLU 49 H GLU 49 20.150 15.249 14.641 396 HA GLU 49 HA GLU 49 18.815 13.516 12.724 397 1HB GLU 49 1HB GLU 49 20.242 13.140 15.304 398 2HB GLU 49 2HB GLU 49 18.991 11.971 14.902 399 1HG GLU 49 1HG GLU 49 21.261 12.670 13.060 400 2HG GLU 49 2HG GLU 49 21.314 11.343 14.220 401 HE2 GLU 49 HE2 GLU 49 19.416 9.318 12.193 402 H ARG 50 H ARG 50 16.689 13.864 12.534 403 HA ARG 50 HA ARG 50 15.086 13.855 14.998 404 1HB ARG 50 1HB ARG 50 15.233 16.159 14.099 405 2HB ARG 50 2HB ARG 50 14.556 15.591 12.580 406 1HG ARG 50 1HG ARG 50 12.568 14.793 13.994 407 2HG ARG 50 2HG ARG 50 13.226 15.844 15.249 408 1HD ARG 50 1HD ARG 50 12.026 17.463 14.283 409 2HD ARG 50 2HD ARG 50 13.275 17.463 13.039 410 HE ARG 50 HE ARG 50 11.770 16.548 11.582 411 1HH1 ARG 50 1HH1 ARG 50 10.563 16.149 14.833 412 2HH1 ARG 50 2HH1 ARG 50 9.020 15.553 14.320 413 1HH2 ARG 50 1HH2 ARG 50 9.742 15.763 10.907 414 2HH2 ARG 50 2HH2 ARG 50 8.554 15.333 12.092 415 HA PRO 51 HA PRO 51 12.953 10.593 12.874 416 1HB PRO 51 1HB PRO 51 10.759 10.411 14.440 417 2HB PRO 51 2HB PRO 51 12.352 9.864 14.977 418 1HG PRO 51 1HG PRO 51 10.925 12.423 15.587 419 2HG PRO 51 2HG PRO 51 11.842 11.368 16.677 420 1HD PRO 51 1HD PRO 51 12.870 13.647 15.608 421 2HD PRO 51 2HD PRO 51 13.866 12.236 16.015 422 H TRP 52 H TRP 52 10.662 10.124 12.048 423 HA TRP 52 HA TRP 52 9.114 12.488 11.376 424 1HB TRP 52 1HB TRP 52 11.073 11.617 9.604 425 2HB TRP 52 2HB TRP 52 9.585 10.926 8.964 426 HD1 TRP 52 HD1 TRP 52 7.551 12.783 8.495 427 HE1 TRP 52 HE1 TRP 52 7.754 15.193 7.617 428 HE3 TRP 52 HE3 TRP 52 12.486 13.616 9.542 429 HZ2 TRP 52 HZ2 TRP 52 9.742 17.185 7.398 430 HZ3 TRP 52 HZ3 TRP 52 13.461 15.801 8.966 431 HH2 TRP 52 HH2 TRP 52 12.117 17.547 7.916 432 H GLY 53 H GLY 53 8.696 10.047 12.924 433 1HA GLY 53 1HA GLY 53 6.990 8.557 13.296 434 2HA GLY 53 2HA GLY 53 6.090 9.417 12.056 435 H GLY 54 H GLY 54 5.224 7.364 11.411 436 1HA GLY 54 1HA GLY 54 6.401 6.270 9.151 437 2HA GLY 54 2HA GLY 54 6.885 5.245 10.495 438 H GLY 55 H GLY 55 5.606 3.787 8.895 439 1HA GLY 55 1HA GLY 55 2.738 3.894 9.579 440 2HA GLY 55 2HA GLY 55 3.397 3.111 8.152 441 H PHE 56 H PHE 56 1.768 2.267 10.640 442 HA PHE 56 HA PHE 56 3.052 -0.321 10.879 443 1HB PHE 56 1HB PHE 56 3.767 1.445 12.769 444 2HB PHE 56 2HB PHE 56 2.271 0.862 13.490 445 HD1 PHE 56 HD1 PHE 56 2.796 -0.567 15.211 446 HD2 PHE 56 HD2 PHE 56 4.944 -0.867 11.550 447 HE1 PHE 56 HE1 PHE 56 3.982 -2.544 16.073 448 HE2 PHE 56 HE2 PHE 56 6.133 -2.844 12.405 449 HZ PHE 56 HZ PHE 56 5.651 -3.685 14.669 450 H GLY 57 H GLY 57 1.607 -1.948 11.147 451 1HA GLY 57 1HA GLY 57 -0.981 -1.555 12.309 452 2HA GLY 57 2HA GLY 57 -1.057 -1.644 10.555 453 H LEU 58 H LEU 58 -2.330 -3.554 10.775 454 HA LEU 58 HA LEU 58 -0.672 -5.940 11.148 455 1HB LEU 58 1HB LEU 58 -3.486 -5.837 12.201 456 2HB LEU 58 2HB LEU 58 -2.259 -7.053 12.499 457 HG LEU 58 HG LEU 58 -1.014 -4.944 13.583 458 1HD1 LEU 58 1HD1 LEU 58 -3.866 -4.380 14.301 459 2HD1 LEU 58 2HD1 LEU 58 -3.081 -3.557 12.953 460 3HD1 LEU 58 3HD1 LEU 58 -2.432 -3.395 14.585 461 1HD2 LEU 58 1HD2 LEU 58 -3.122 -6.650 14.900 462 2HD2 LEU 58 2HD2 LEU 58 -1.904 -5.704 15.757 463 3HD2 LEU 58 3HD2 LEU 58 -1.412 -7.039 14.715 464 H SER 59 H SER 59 -2.130 -7.943 10.470 465 HA SER 59 HA SER 59 -3.792 -7.256 8.162 466 1HB SER 59 1HB SER 59 -2.569 -9.043 6.832 467 2HB SER 59 2HB SER 59 -1.673 -7.551 7.111 468 HG SER 59 HG SER 59 -0.628 -9.721 7.534 469 H ARG 60 H ARG 60 -4.842 -9.273 7.240 470 HA ARG 60 HA ARG 60 -5.132 -11.478 9.099 471 1HB ARG 60 1HB ARG 60 -6.733 -9.696 9.870 472 2HB ARG 60 2HB ARG 60 -7.558 -9.853 8.325 473 1HG ARG 60 1HG ARG 60 -8.075 -12.178 8.817 474 2HG ARG 60 2HG ARG 60 -7.211 -12.054 10.351 475 1HD ARG 60 1HD ARG 60 -9.596 -11.841 10.719 476 2HD ARG 60 2HD ARG 60 -8.789 -10.315 11.076 477 HE ARG 60 HE ARG 60 -9.555 -10.020 8.500 478 1HH1 ARG 60 1HH1 ARG 60 -11.256 -10.946 11.402 479 2HH1 ARG 60 2HH1 ARG 60 -12.769 -10.289 10.875 480 1HH2 ARG 60 1HH2 ARG 60 -11.543 -9.155 7.804 481 2HH2 ARG 60 2HH2 ARG 60 -12.933 -9.273 8.832 482 H TRP 61 H TRP 61 -6.470 -13.226 8.211 483 HA TRP 61 HA TRP 61 -6.300 -13.258 5.279 484 1HB TRP 61 1HB TRP 61 -5.176 -15.005 6.959 485 2HB TRP 61 2HB TRP 61 -6.760 -15.763 6.821 486 HD1 TRP 61 HD1 TRP 61 -7.541 -16.189 4.114 487 HE1 TRP 61 HE1 TRP 61 -6.078 -17.109 2.208 488 HE3 TRP 61 HE3 TRP 61 -2.928 -15.211 6.087 489 HZ2 TRP 61 HZ2 TRP 61 -3.331 -17.383 1.618 490 HZ3 TRP 61 HZ3 TRP 61 -0.933 -15.833 4.788 491 HH2 TRP 61 HH2 TRP 61 -1.133 -16.898 2.600 492 H ASP 62 H ASP 62 -8.048 -13.717 4.023 493 HA ASP 62 HA ASP 62 -10.632 -13.896 5.419 494 1HB ASP 62 1HB ASP 62 -9.770 -12.102 3.475 495 2HB ASP 62 2HB ASP 62 -10.787 -13.232 2.586 496 HD2 ASP 62 HD2 ASP 62 -12.614 -10.505 4.480 497 H GLU 63 H GLU 63 -11.729 -15.726 5.282 498 HA GLU 63 HA GLU 63 -10.813 -17.993 3.929 499 1HB GLU 63 1HB GLU 63 -13.561 -17.361 5.010 500 2HB GLU 63 2HB GLU 63 -13.055 -18.953 4.462 501 1HG GLU 63 1HG GLU 63 -11.594 -17.473 6.622 502 2HG GLU 63 2HG GLU 63 -12.989 -18.498 6.957 503 HE2 GLU 63 HE2 GLU 63 -9.567 -20.225 5.952 504 H LYS 64 H LYS 64 -12.634 -15.327 2.774 505 HA LYS 64 HA LYS 64 -13.704 -16.813 0.506 506 1HB LYS 64 1HB LYS 64 -14.954 -14.972 1.813 507 2HB LYS 64 2HB LYS 64 -13.944 -13.845 0.917 508 1HG LYS 64 1HG LYS 64 -14.796 -14.893 -1.190 509 2HG LYS 64 2HG LYS 64 -15.938 -15.801 -0.197 510 1HD LYS 64 1HD LYS 64 -17.261 -14.015 -0.671 511 2HD LYS 64 2HD LYS 64 -16.434 -13.350 0.738 512 1HE LYS 64 1HE LYS 64 -15.663 -12.915 -2.146 513 2HE LYS 64 2HE LYS 64 -16.471 -11.747 -1.102 514 1HZ LYS 64 1HZ LYS 64 -14.481 -11.910 0.379 515 2HZ LYS 64 2HZ LYS 64 -14.186 -11.201 -1.127 516 3HZ LYS 64 3HZ LYS 64 -13.712 -12.799 -0.837 517 H GLY 65 H GLY 65 -10.779 -16.347 0.889 518 1HA GLY 65 1HA GLY 65 -8.996 -15.996 -0.517 519 2HA GLY 65 2HA GLY 65 -10.154 -15.742 -1.814 520 H ASN 66 H ASN 66 -9.552 -13.971 1.215 521 HA ASN 66 HA ASN 66 -8.860 -11.611 -0.395 522 1HB ASN 66 1HB ASN 66 -11.241 -11.930 1.077 523 2HB ASN 66 2HB ASN 66 -10.236 -10.832 2.017 524 1HD2 ASN 66 1HD2 ASN 66 -11.878 -9.258 1.528 525 2HD2 ASN 66 2HD2 ASN 66 -11.836 -8.420 0.018 526 H TRP 67 H TRP 67 -7.598 -10.006 0.731 527 HA TRP 67 HA TRP 67 -6.198 -11.055 3.099 528 1HB TRP 67 1HB TRP 67 -5.088 -10.762 0.562 529 2HB TRP 67 2HB TRP 67 -4.534 -9.338 1.437 530 HD1 TRP 67 HD1 TRP 67 -4.825 -13.091 2.438 531 HE1 TRP 67 HE1 TRP 67 -2.594 -13.786 3.516 532 HE3 TRP 67 HE3 TRP 67 -2.304 -8.663 2.019 533 HZ2 TRP 67 HZ2 TRP 67 -0.096 -12.614 4.111 534 HZ3 TRP 67 HZ3 TRP 67 0.002 -8.533 2.867 535 HH2 TRP 67 HH2 TRP 67 1.081 -10.469 3.892 536 H HIS 68 H HIS 68 -7.120 -9.782 4.630 537 HA HIS 68 HA HIS 68 -7.672 -7.012 4.249 538 1HB HIS 68 1HB HIS 68 -8.846 -8.568 5.871 539 2HB HIS 68 2HB HIS 68 -7.418 -8.445 6.895 540 HD1 HIS 68 HD1 HIS 68 -10.630 -7.092 6.700 541 HD2 HIS 68 HD2 HIS 68 -6.871 -5.411 7.254 542 HE1 HIS 68 HE1 HIS 68 -11.045 -4.852 7.766 543 HE2 HIS 68 HE2 HIS 68 -8.752 -3.895 8.177 544 H GLY 69 H GLY 69 -6.446 -5.260 4.646 545 1HA GLY 69 1HA GLY 69 -3.930 -5.626 6.129 546 2HA GLY 69 2HA GLY 69 -3.897 -4.892 4.533 547 H LEU 70 H LEU 70 -4.136 -4.320 7.827 548 HA LEU 70 HA LEU 70 -5.346 -1.673 7.435 549 1HB LEU 70 1HB LEU 70 -5.936 -3.502 9.312 550 2HB LEU 70 2HB LEU 70 -4.665 -2.636 10.153 551 HG LEU 70 HG LEU 70 -6.922 -1.103 8.927 552 1HD1 LEU 70 1HD1 LEU 70 -7.783 -1.340 11.450 553 2HD1 LEU 70 2HD1 LEU 70 -7.071 -2.939 11.236 554 3HD1 LEU 70 3HD1 LEU 70 -8.335 -2.383 10.139 555 1HD2 LEU 70 1HD2 LEU 70 -5.663 -0.510 11.552 556 2HD2 LEU 70 2HD2 LEU 70 -6.255 0.588 10.304 557 3HD2 LEU 70 3HD2 LEU 70 -4.710 -0.236 10.093 558 H TYR 71 H TYR 71 -4.085 0.065 7.374 559 HA TYR 71 HA TYR 71 -1.375 -0.136 8.519 560 1HB TYR 71 1HB TYR 71 -0.709 1.540 6.774 561 2HB TYR 71 2HB TYR 71 -1.177 -0.030 6.132 562 HD1 TYR 71 HD1 TYR 71 -1.773 3.498 6.043 563 HD2 TYR 71 HD2 TYR 71 -3.537 -0.281 5.197 564 HE1 TYR 71 HE1 TYR 71 -3.405 4.596 4.567 565 HE2 TYR 71 HE2 TYR 71 -5.173 0.808 3.719 566 HH TYR 71 HH TYR 71 -6.191 3.166 3.519 567 H ALA 72 H ALA 72 -0.964 1.200 10.136 568 HA ALA 72 HA ALA 72 -2.510 3.703 10.333 569 1HB ALA 72 1HB ALA 72 -2.028 1.589 12.350 570 2HB ALA 72 2HB ALA 72 -3.422 2.645 12.121 571 3HB ALA 72 3HB ALA 72 -1.969 3.261 12.909 572 H MET 73 H MET 73 -1.148 5.312 9.888 573 HA MET 73 HA MET 73 1.627 5.125 10.833 574 1HB MET 73 1HB MET 73 0.559 7.130 8.853 575 2HB MET 73 2HB MET 73 2.233 6.667 9.134 576 1HG MET 73 1HG MET 73 1.156 4.287 8.428 577 2HG MET 73 2HG MET 73 0.168 5.398 7.482 578 1HE MET 73 1HE MET 73 2.139 4.360 4.668 579 2HE MET 73 2HE MET 73 1.073 3.683 5.900 580 3HE MET 73 3HE MET 73 2.781 3.245 5.874 581 H ALA 74 H ALA 74 2.552 7.491 11.161 582 HA ALA 74 HA ALA 74 0.744 9.330 12.436 583 1HB ALA 74 1HB ALA 74 1.174 8.971 14.626 584 2HB ALA 74 2HB ALA 74 2.831 8.445 14.327 585 3HB ALA 74 3HB ALA 74 1.491 7.329 14.065 586 H PHE 75 H PHE 75 1.712 11.344 12.900 587 HA PHE 75 HA PHE 75 4.523 11.646 12.120 588 1HB PHE 75 1HB PHE 75 2.362 13.510 11.133 589 2HB PHE 75 2HB PHE 75 4.059 13.488 10.663 590 HD1 PHE 75 HD1 PHE 75 0.777 12.246 9.975 591 HD2 PHE 75 HD2 PHE 75 4.922 11.489 9.379 592 HE1 PHE 75 HE1 PHE 75 0.230 10.759 8.093 593 HE2 PHE 75 HE2 PHE 75 4.382 10.000 7.495 594 HZ PHE 75 HZ PHE 75 2.034 9.634 6.850 595 H LYS 76 H LYS 76 5.638 12.866 13.495 596 HA LYS 76 HA LYS 76 4.202 14.264 15.607 597 1HB LYS 76 1HB LYS 76 6.818 13.015 15.313 598 2HB LYS 76 2HB LYS 76 6.922 14.598 16.069 599 1HG LYS 76 1HG LYS 76 6.662 13.217 17.885 600 2HG LYS 76 2HG LYS 76 4.999 13.718 17.574 601 1HD LYS 76 1HD LYS 76 4.781 11.429 17.848 602 2HD LYS 76 2HD LYS 76 4.905 11.586 16.095 603 1HE LYS 76 1HE LYS 76 6.408 9.899 16.460 604 2HE LYS 76 2HE LYS 76 7.473 11.298 16.582 605 1HZ LYS 76 1HZ LYS 76 7.426 11.180 18.931 606 2HZ LYS 76 2HZ LYS 76 7.725 9.608 18.381 607 3HZ LYS 76 3HZ LYS 76 6.183 10.030 18.932 608 H ASP 77 H ASP 77 3.458 16.167 14.776 609 HA ASP 77 HA ASP 77 4.978 17.846 13.059 610 1HB ASP 77 1HB ASP 77 3.197 19.528 13.536 611 2HB ASP 77 2HB ASP 77 2.567 17.968 13.014 612 HD2 ASP 77 HD2 ASP 77 0.509 18.316 15.763 613 H SER 78 H SER 78 5.889 19.897 13.515 614 HA SER 78 HA SER 78 7.516 19.998 15.786 615 1HB SER 78 1HB SER 78 8.238 22.128 15.015 616 2HB SER 78 2HB SER 78 7.849 21.203 13.565 617 HG SER 78 HG SER 78 7.004 23.444 13.749 618 H TRP 79 H TRP 79 4.242 20.963 15.340 619 HA TRP 79 HA TRP 79 3.928 23.006 17.179 620 1HB TRP 79 1HB TRP 79 2.235 21.272 15.713 621 2HB TRP 79 2HB TRP 79 1.697 21.212 17.388 622 HD1 TRP 79 HD1 TRP 79 0.248 23.185 18.217 623 HE1 TRP 79 HE1 TRP 79 -0.504 25.433 17.216 624 HE3 TRP 79 HE3 TRP 79 3.171 23.223 14.023 625 HZ2 TRP 79 HZ2 TRP 79 0.068 27.014 14.948 626 HZ3 TRP 79 HZ3 TRP 79 3.009 25.140 12.489 627 HH2 TRP 79 HH2 TRP 79 1.488 26.996 12.943 628 H ASN 80 H ASN 80 3.102 19.608 17.887 629 HA ASN 80 HA ASN 80 4.621 19.411 20.235 630 1HB ASN 80 1HB ASN 80 2.080 20.798 20.519 631 2HB ASN 80 2HB ASN 80 2.158 19.364 21.538 632 1HD2 ASN 80 1HD2 ASN 80 3.908 19.185 23.036 633 2HD2 ASN 80 2HD2 ASN 80 4.663 20.607 23.660 634 H LYS 81 H LYS 81 1.221 18.484 19.772 635 HA LYS 81 HA LYS 81 1.896 15.710 20.204 636 1HB LYS 81 1HB LYS 81 -0.265 17.110 20.890 637 2HB LYS 81 2HB LYS 81 -0.831 16.527 19.331 638 1HG LYS 81 1HG LYS 81 -0.257 14.207 20.106 639 2HG LYS 81 2HG LYS 81 0.015 14.895 21.708 640 1HD LYS 81 1HD LYS 81 -2.223 14.019 21.611 641 2HD LYS 81 2HD LYS 81 -2.304 15.782 21.664 642 1HE LYS 81 1HE LYS 81 -3.149 15.939 19.573 643 2HE LYS 81 2HE LYS 81 -2.206 14.574 18.976 644 1HZ LYS 81 1HZ LYS 81 -4.224 13.601 18.970 645 2HZ LYS 81 2HZ LYS 81 -4.861 14.618 20.161 646 3HZ LYS 81 3HZ LYS 81 -3.876 13.316 20.601 647 H TRP 82 H TRP 82 1.364 13.995 18.753 648 HA TRP 82 HA TRP 82 1.813 14.737 15.967 649 1HB TRP 82 1HB TRP 82 2.267 12.341 15.624 650 2HB TRP 82 2HB TRP 82 3.253 13.007 16.921 651 HD1 TRP 82 HD1 TRP 82 0.217 10.708 16.367 652 HE1 TRP 82 HE1 TRP 82 -0.054 9.211 18.443 653 HE3 TRP 82 HE3 TRP 82 3.784 12.817 19.362 654 HZ2 TRP 82 HZ2 TRP 82 1.091 8.958 21.010 655 HZ3 TRP 82 HZ3 TRP 82 4.133 11.888 21.613 656 HH2 TRP 82 HH2 TRP 82 2.813 9.999 22.419 657 H GLU 83 H GLU 83 0.564 13.765 14.249 658 HA GLU 83 HA GLU 83 -2.242 13.382 15.036 659 1HB GLU 83 1HB GLU 83 -0.958 14.413 12.518 660 2HB GLU 83 2HB GLU 83 -2.635 13.883 12.543 661 1HG GLU 83 1HG GLU 83 -2.892 15.522 14.512 662 2HG GLU 83 2HG GLU 83 -1.374 16.208 13.937 663 HE2 GLU 83 HE2 GLU 83 -4.418 16.479 11.391 664 HA PRO 84 HA PRO 84 -1.647 9.176 13.621 665 1HB PRO 84 1HB PRO 84 -4.001 8.186 14.409 666 2HB PRO 84 2HB PRO 84 -2.763 8.649 15.583 667 1HG PRO 84 1HG PRO 84 -5.220 10.128 14.736 668 2HG PRO 84 2HG PRO 84 -4.527 9.943 16.356 669 1HD PRO 84 1HD PRO 84 -4.185 12.161 14.742 670 2HD PRO 84 2HD PRO 84 -3.100 11.700 16.067 671 H ILE 85 H ILE 85 -2.859 7.608 12.228 672 HA ILE 85 HA ILE 85 -4.905 8.683 10.495 673 HB ILE 85 HB ILE 85 -2.861 9.588 9.465 674 1HG1 ILE 85 1HG1 ILE 85 -3.591 7.476 7.530 675 2HG1 ILE 85 2HG1 ILE 85 -4.943 8.372 8.216 676 1HG2 ILE 85 1HG2 ILE 85 -0.986 8.423 9.156 677 2HG2 ILE 85 2HG2 ILE 85 -1.851 7.054 8.457 678 3HG2 ILE 85 3HG2 ILE 85 -1.705 7.205 10.208 679 1HD1 ILE 85 1HD1 ILE 85 -2.619 9.461 6.657 680 2HD1 ILE 85 2HD1 ILE 85 -3.769 10.475 7.528 681 3HD1 ILE 85 3HD1 ILE 85 -4.322 9.450 6.203 682 H ALA 86 H ALA 86 -6.294 7.068 10.264 683 HA ALA 86 HA ALA 86 -5.363 4.312 10.513 684 1HB ALA 86 1HB ALA 86 -8.209 5.277 10.318 685 2HB ALA 86 2HB ALA 86 -7.315 5.166 11.835 686 3HB ALA 86 3HB ALA 86 -7.636 3.711 10.890 687 H GLY 87 H GLY 87 -5.684 2.735 8.956 688 1HA GLY 87 1HA GLY 87 -6.786 3.594 6.371 689 2HA GLY 87 2HA GLY 87 -5.154 2.945 6.422 690 H TYR 88 H TYR 88 -7.908 2.070 5.310 691 HA TYR 88 HA TYR 88 -7.609 -0.728 6.145 692 1HB TYR 88 1HB TYR 88 -10.316 0.521 5.691 693 2HB TYR 88 2HB TYR 88 -9.951 -1.055 6.384 694 HD1 TYR 88 HD1 TYR 88 -9.354 -1.282 8.704 695 HD2 TYR 88 HD2 TYR 88 -9.990 2.568 7.011 696 HE1 TYR 88 HE1 TYR 88 -9.423 -0.308 10.961 697 HE2 TYR 88 HE2 TYR 88 -10.060 3.553 9.264 698 HH TYR 88 HH TYR 88 -10.614 2.700 11.629 699 H GLY 89 H GLY 89 -7.038 -1.823 4.389 700 1HA GLY 89 1HA GLY 89 -8.478 -1.269 1.878 701 2HA GLY 89 2HA GLY 89 -6.725 -1.389 1.881 702 H TRP 90 H TRP 90 -8.169 -3.017 0.244 703 HA TRP 90 HA TRP 90 -7.700 -5.642 1.471 704 1HB TRP 90 1HB TRP 90 -9.707 -6.533 0.327 705 2HB TRP 90 2HB TRP 90 -10.108 -5.309 1.528 706 HD1 TRP 90 HD1 TRP 90 -10.151 -2.666 0.194 707 HE1 TRP 90 HE1 TRP 90 -11.567 -2.115 -1.883 708 HE3 TRP 90 HE3 TRP 90 -10.868 -7.407 -1.583 709 HZ2 TRP 90 HZ2 TRP 90 -12.821 -3.505 -3.995 710 HZ3 TRP 90 HZ3 TRP 90 -12.188 -7.709 -3.636 711 HH2 TRP 90 HH2 TRP 90 -13.144 -5.797 -4.817 712 H GLU 91 H GLU 91 -6.461 -6.928 0.263 713 HA GLU 91 HA GLU 91 -6.359 -6.514 -2.636 714 1HB GLU 91 1HB GLU 91 -3.898 -6.654 -2.610 715 2HB GLU 91 2HB GLU 91 -4.488 -5.240 -1.748 716 1HG GLU 91 1HG GLU 91 -4.030 -7.663 -0.130 717 2HG GLU 91 2HG GLU 91 -2.600 -6.873 -0.793 718 HE2 GLU 91 HE2 GLU 91 -4.705 -4.398 1.459 719 H SER 92 H SER 92 -5.608 -8.329 -3.832 720 HA SER 92 HA SER 92 -5.885 -10.857 -2.353 721 1HB SER 92 1HB SER 92 -6.669 -9.979 -5.089 722 2HB SER 92 2HB SER 92 -6.174 -11.661 -4.887 723 HG SER 92 HG SER 92 -8.516 -10.903 -4.508 724 H THR 93 H THR 93 -4.185 -12.159 -2.164 725 HA THR 93 HA THR 93 -1.837 -11.632 -3.860 726 HB THR 93 HB THR 93 -0.664 -12.934 -1.927 727 HG1 THR 93 HG1 THR 93 -2.075 -13.537 -0.495 728 1HG2 THR 93 1HG2 THR 93 -0.298 -10.934 -0.645 729 2HG2 THR 93 2HG2 THR 93 -1.716 -10.173 -1.367 730 3HG2 THR 93 3HG2 THR 93 -0.309 -10.542 -2.365 731 H TRP 94 H TRP 94 -0.840 -13.284 -4.934 732 HA TRP 94 HA TRP 94 -2.085 -15.946 -4.720 733 1HB TRP 94 1HB TRP 94 -2.675 -14.611 -6.813 734 2HB TRP 94 2HB TRP 94 -0.989 -14.794 -7.285 735 HD1 TRP 94 HD1 TRP 94 -3.668 -17.314 -6.004 736 HE1 TRP 94 HE1 TRP 94 -3.611 -19.371 -7.552 737 HE3 TRP 94 HE3 TRP 94 -0.011 -15.795 -9.238 738 HZ2 TRP 94 HZ2 TRP 94 -2.202 -20.233 -9.841 739 HZ3 TRP 94 HZ3 TRP 94 0.633 -17.296 -11.079 740 HH2 TRP 94 HH2 TRP 94 -0.440 -19.468 -11.372 741 H ARG 95 H ARG 95 -0.742 -17.656 -4.568 742 HA ARG 95 HA ARG 95 2.148 -17.108 -4.731 743 1HB ARG 95 1HB ARG 95 2.282 -19.160 -3.174 744 2HB ARG 95 2HB ARG 95 1.742 -17.633 -2.491 745 1HG ARG 95 1HG ARG 95 0.372 -19.437 -1.670 746 2HG ARG 95 2HG ARG 95 -0.589 -18.380 -2.707 747 1HD ARG 95 1HD ARG 95 -0.762 -19.944 -4.374 748 2HD ARG 95 2HD ARG 95 0.748 -20.739 -3.931 749 HE ARG 95 HE ARG 95 -0.426 -22.100 -2.515 750 1HH1 ARG 95 1HH1 ARG 95 -2.431 -19.378 -3.380 751 2HH1 ARG 95 2HH1 ARG 95 -3.851 -20.026 -2.630 752 1HH2 ARG 95 1HH2 ARG 95 -2.292 -22.954 -1.528 753 2HH2 ARG 95 2HH2 ARG 95 -3.772 -22.055 -1.578 754 HA PRO 96 HA PRO 96 2.563 -20.165 -7.877 755 1HB PRO 96 1HB PRO 96 4.993 -21.234 -7.311 756 2HB PRO 96 2HB PRO 96 4.791 -19.615 -7.992 757 1HG PRO 96 1HG PRO 96 5.270 -20.429 -5.150 758 2HG PRO 96 2HG PRO 96 6.001 -19.103 -6.072 759 1HD PRO 96 1HD PRO 96 3.980 -18.710 -4.316 760 2HD PRO 96 2HD PRO 96 4.177 -17.723 -5.779 761 H LEU 97 H LEU 97 2.723 -22.466 -8.295 762 HA LEU 97 HA LEU 97 1.626 -24.023 -6.093 763 1HB LEU 97 1HB LEU 97 1.329 -25.762 -7.923 764 2HB LEU 97 2HB LEU 97 0.382 -24.293 -8.060 765 HG LEU 97 HG LEU 97 2.981 -24.311 -9.480 766 1HD1 LEU 97 1HD1 LEU 97 0.710 -26.139 -10.143 767 2HD1 LEU 97 2HD1 LEU 97 2.446 -26.447 -10.184 768 3HD1 LEU 97 3HD1 LEU 97 1.700 -25.442 -11.425 769 1HD2 LEU 97 1HD2 LEU 97 1.951 -22.814 -10.863 770 2HD2 LEU 97 2HD2 LEU 97 1.023 -22.543 -9.388 771 3HD2 LEU 97 3HD2 LEU 97 0.363 -23.557 -10.671 772 H ALA 98 H ALA 98 3.786 -23.926 -5.015 773 HA ALA 98 HA ALA 98 5.096 -26.409 -5.234 774 1HB ALA 98 1HB ALA 98 6.969 -26.038 -6.438 775 2HB ALA 98 2HB ALA 98 7.096 -24.356 -5.925 776 3HB ALA 98 3HB ALA 98 5.973 -24.803 -7.208 777 H ASP 99 H ASP 99 5.394 -23.028 -4.241 778 HA ASP 99 HA ASP 99 6.016 -23.896 -1.539 779 1HB ASP 99 1HB ASP 99 8.144 -23.356 -3.108 780 2HB ASP 99 2HB ASP 99 7.792 -21.735 -2.519 781 HD2 ASP 99 HD2 ASP 99 9.673 -24.136 -0.163 782 H GLU 100 H GLU 100 5.567 -22.338 0.048 783 HA GLU 100 HA GLU 100 3.815 -20.188 -0.887 784 1HB GLU 100 1HB GLU 100 4.161 -21.513 1.802 785 2HB GLU 100 2HB GLU 100 3.167 -20.082 1.564 786 1HG GLU 100 1HG GLU 100 1.519 -21.226 0.538 787 2HG GLU 100 2HG GLU 100 2.632 -22.351 -0.238 788 HE2 GLU 100 HE2 GLU 100 1.093 -23.302 3.269 789 H ASN 101 H ASN 101 6.605 -19.830 -1.190 790 HA ASN 101 HA ASN 101 7.362 -17.977 0.940 791 1HB ASN 101 1HB ASN 101 8.997 -19.678 0.104 792 2HB ASN 101 2HB ASN 101 8.983 -18.861 -1.456 793 1HD2 ASN 101 1HD2 ASN 101 10.560 -17.481 -1.761 794 2HD2 ASN 101 2HD2 ASN 101 11.414 -16.614 -0.535 795 H PHE 102 H PHE 102 7.333 -17.988 -2.629 796 HA PHE 102 HA PHE 102 7.505 -15.136 -2.777 797 1HB PHE 102 1HB PHE 102 6.702 -17.044 -4.978 798 2HB PHE 102 2HB PHE 102 7.353 -15.419 -5.161 799 HD1 PHE 102 HD1 PHE 102 8.114 -18.883 -4.982 800 HD2 PHE 102 HD2 PHE 102 9.729 -15.007 -4.289 801 HE1 PHE 102 HE1 PHE 102 10.388 -19.815 -5.095 802 HE2 PHE 102 HE2 PHE 102 12.006 -15.931 -4.401 803 HZ PHE 102 HZ PHE 102 12.338 -18.338 -4.804 804 H HIS 103 H HIS 103 5.926 -13.660 -2.901 805 HA HIS 103 HA HIS 103 3.178 -14.556 -3.404 806 1HB HIS 103 1HB HIS 103 2.446 -12.947 -1.570 807 2HB HIS 103 2HB HIS 103 3.200 -14.446 -1.038 808 HD1 HIS 103 HD1 HIS 103 4.902 -14.130 0.719 809 HD2 HIS 103 HD2 HIS 103 4.526 -10.758 -1.680 810 HE1 HIS 103 HE1 HIS 103 6.472 -12.429 1.701 811 HE2 HIS 103 HE2 HIS 103 6.291 -10.427 0.182 812 H LEU 104 H LEU 104 1.961 -13.176 -4.596 813 HA LEU 104 HA LEU 104 2.883 -10.440 -5.016 814 1HB LEU 104 1HB LEU 104 3.948 -11.912 -6.750 815 2HB LEU 104 2HB LEU 104 2.339 -12.292 -7.333 816 HG LEU 104 HG LEU 104 3.087 -9.419 -7.158 817 1HD1 LEU 104 1HD1 LEU 104 4.930 -11.018 -8.280 818 2HD1 LEU 104 2HD1 LEU 104 4.576 -9.387 -8.850 819 3HD1 LEU 104 3HD1 LEU 104 3.856 -10.779 -9.658 820 1HD2 LEU 104 1HD2 LEU 104 1.818 -10.614 -9.535 821 2HD2 LEU 104 2HD2 LEU 104 1.413 -9.146 -8.646 822 3HD2 LEU 104 3HD2 LEU 104 0.897 -10.718 -8.033 823 H GLY 105 H GLY 105 1.189 -9.151 -4.771 824 1HA GLY 105 1HA GLY 105 -1.346 -9.809 -6.027 825 2HA GLY 105 2HA GLY 105 -1.377 -9.737 -4.273 826 H LEU 106 H LEU 106 -3.006 -8.061 -5.582 827 HA LEU 106 HA LEU 106 -1.835 -5.465 -4.956 828 1HB LEU 106 1HB LEU 106 -3.372 -5.818 -7.514 829 2HB LEU 106 2HB LEU 106 -2.422 -4.437 -7.000 830 HG LEU 106 HG LEU 106 -0.451 -6.217 -7.089 831 1HD1 LEU 106 1HD1 LEU 106 -1.889 -7.209 -9.462 832 2HD1 LEU 106 2HD1 LEU 106 -2.427 -7.844 -7.907 833 3HD1 LEU 106 3HD1 LEU 106 -0.743 -8.027 -8.400 834 1HD2 LEU 106 1HD2 LEU 106 -0.366 -5.556 -9.650 835 2HD2 LEU 106 2HD2 LEU 106 -0.089 -4.371 -8.374 836 3HD2 LEU 106 3HD2 LEU 106 -1.666 -4.468 -9.159 837 H GLY 107 H GLY 107 -3.504 -3.741 -4.837 838 1HA GLY 107 1HA GLY 107 -6.264 -4.314 -4.849 839 2HA GLY 107 2HA GLY 107 -5.649 -4.515 -3.216 840 H PHE 108 H PHE 108 -7.285 -2.742 -2.906 841 HA PHE 108 HA PHE 108 -6.059 -0.119 -3.457 842 1HB PHE 108 1HB PHE 108 -8.971 -0.851 -3.104 843 2HB PHE 108 2HB PHE 108 -8.375 0.803 -3.196 844 HD1 PHE 108 HD1 PHE 108 -8.776 -2.346 -5.068 845 HD2 PHE 108 HD2 PHE 108 -7.821 1.796 -5.272 846 HE1 PHE 108 HE1 PHE 108 -8.926 -2.436 -7.521 847 HE2 PHE 108 HE2 PHE 108 -7.971 1.713 -7.727 848 HZ PHE 108 HZ PHE 108 -8.523 -0.405 -8.855 849 H THR 109 H THR 109 -5.854 1.351 -1.800 850 HA THR 109 HA THR 109 -6.454 0.328 0.898 851 HB THR 109 HB THR 109 -4.494 1.468 1.718 852 HG1 THR 109 HG1 THR 109 -4.306 3.268 0.521 853 1HG2 THR 109 1HG2 THR 109 -3.683 0.079 -0.820 854 2HG2 THR 109 2HG2 THR 109 -4.105 -0.744 0.682 855 3HG2 THR 109 3HG2 THR 109 -2.703 0.326 0.625 856 H ALA 110 H ALA 110 -8.146 1.375 1.705 857 HA ALA 110 HA ALA 110 -8.356 4.278 1.226 858 1HB ALA 110 1HB ALA 110 -10.155 2.773 0.238 859 2HB ALA 110 2HB ALA 110 -10.702 4.128 1.226 860 3HB ALA 110 3HB ALA 110 -10.681 2.496 1.898 861 H GLY 111 H GLY 111 -7.989 5.480 2.963 862 1HA GLY 111 1HA GLY 111 -8.687 4.363 5.608 863 2HA GLY 111 2HA GLY 111 -7.193 5.248 5.337 864 H VAL 112 H VAL 112 -8.517 6.253 7.306 865 HA VAL 112 HA VAL 112 -9.692 8.707 6.221 866 HB VAL 112 HB VAL 112 -11.409 8.691 8.042 867 1HG1 VAL 112 1HG1 VAL 112 -12.865 6.952 6.907 868 2HG1 VAL 112 2HG1 VAL 112 -11.468 6.587 5.894 869 3HG1 VAL 112 3HG1 VAL 112 -12.179 8.201 5.867 870 1HG2 VAL 112 1HG2 VAL 112 -10.837 5.747 8.267 871 2HG2 VAL 112 2HG2 VAL 112 -11.910 6.735 9.260 872 3HG2 VAL 112 3HG2 VAL 112 -10.162 6.934 9.384 873 H THR 113 H THR 113 -9.415 10.540 7.511 874 HA THR 113 HA THR 113 -7.592 10.187 9.801 875 HB THR 113 HB THR 113 -7.658 12.555 7.926 876 HG1 THR 113 HG1 THR 113 -6.925 10.572 6.935 877 1HG2 THR 113 1HG2 THR 113 -5.194 12.555 8.955 878 2HG2 THR 113 2HG2 THR 113 -6.082 11.880 10.320 879 3HG2 THR 113 3HG2 THR 113 -6.541 13.450 9.660 880 H ALA 114 H ALA 114 -8.241 11.005 11.685 881 HA ALA 114 HA ALA 114 -10.213 13.172 11.713 882 1HB ALA 114 1HB ALA 114 -11.078 10.646 12.047 883 2HB ALA 114 2HB ALA 114 -11.826 12.045 12.818 884 3HB ALA 114 3HB ALA 114 -10.673 11.055 13.713 885 H ARG 115 H ARG 115 -9.787 14.685 13.203 886 HA ARG 115 HA ARG 115 -7.396 14.571 14.719 887 1HB ARG 115 1HB ARG 115 -9.717 16.504 14.831 888 2HB ARG 115 2HB ARG 115 -8.196 16.731 15.684 889 1HG ARG 115 1HG ARG 115 -8.272 16.356 12.713 890 2HG ARG 115 2HG ARG 115 -8.529 17.937 13.453 891 1HD ARG 115 1HD ARG 115 -6.370 17.905 14.458 892 2HD ARG 115 2HD ARG 115 -6.127 16.214 14.022 893 HE ARG 115 HE ARG 115 -5.422 16.897 11.964 894 1HH1 ARG 115 1HH1 ARG 115 -7.226 19.500 13.430 895 2HH1 ARG 115 2HH1 ARG 115 -6.863 20.629 12.168 896 1HH2 ARG 115 1HH2 ARG 115 -4.944 18.381 10.304 897 2HH2 ARG 115 2HH2 ARG 115 -5.568 19.994 10.394 898 H ASP 116 H ASP 116 -7.424 15.162 17.125 899 HA ASP 116 HA ASP 116 -9.244 13.290 18.477 900 1HB ASP 116 1HB ASP 116 -6.559 13.284 18.560 901 2HB ASP 116 2HB ASP 116 -6.876 14.381 19.901 902 HD2 ASP 116 HD2 ASP 116 -7.286 10.599 20.530 903 H ASN 117 H ASN 117 -8.096 16.593 18.445 904 HA ASN 117 HA ASN 117 -9.265 17.393 20.906 905 1HB ASN 117 1HB ASN 117 -8.359 18.943 18.478 906 2HB ASN 117 2HB ASN 117 -9.009 19.721 19.918 907 1HD2 ASN 117 1HD2 ASN 117 -7.465 20.522 21.124 908 2HD2 ASN 117 2HD2 ASN 117 -5.922 19.805 21.423 909 H TRP 118 H TRP 118 -10.428 17.190 17.609 910 HA TRP 118 HA TRP 118 -13.145 17.616 18.565 911 1HB TRP 118 1HB TRP 118 -13.647 19.235 16.761 912 2HB TRP 118 2HB TRP 118 -12.472 19.860 17.914 913 HD1 TRP 118 HD1 TRP 118 -12.183 17.871 14.577 914 HE1 TRP 118 HE1 TRP 118 -10.334 18.976 13.167 915 HE3 TRP 118 HE3 TRP 118 -10.834 21.611 17.792 916 HZ2 TRP 118 HZ2 TRP 118 -8.542 21.146 13.389 917 HZ3 TRP 118 HZ3 TRP 118 -9.044 23.157 17.118 918 HH2 TRP 118 HH2 TRP 118 -7.922 22.928 14.961 919 H ASN 119 H ASN 119 -14.605 17.522 16.374 920 HA ASN 119 HA ASN 119 -13.656 15.706 14.386 921 1HB ASN 119 1HB ASN 119 -15.251 13.859 14.975 922 2HB ASN 119 2HB ASN 119 -13.910 14.045 16.102 923 1HD2 ASN 119 1HD2 ASN 119 -14.343 15.269 18.073 924 2HD2 ASN 119 2HD2 ASN 119 -15.914 15.168 18.784 925 H TYR 120 H TYR 120 -14.659 16.366 12.615 926 HA TYR 120 HA TYR 120 -17.532 16.900 12.704 927 1HB TYR 120 1HB TYR 120 -15.645 18.968 12.649 928 2HB TYR 120 2HB TYR 120 -16.213 18.830 10.989 929 HD1 TYR 120 HD1 TYR 120 -18.028 18.345 14.213 930 HD2 TYR 120 HD2 TYR 120 -17.645 20.624 10.641 931 HE1 TYR 120 HE1 TYR 120 -20.051 19.609 14.809 932 HE2 TYR 120 HE2 TYR 120 -19.667 21.894 11.226 933 HH TYR 120 HH TYR 120 -20.982 21.977 14.228 934 H ILE 121 H ILE 121 -14.973 17.405 10.281 935 HA ILE 121 HA ILE 121 -16.288 15.380 8.593 936 HB ILE 121 HB ILE 121 -15.007 17.901 7.542 937 1HG1 ILE 121 1HG1 ILE 121 -17.729 18.026 6.995 938 2HG1 ILE 121 2HG1 ILE 121 -17.665 17.447 8.657 939 1HG2 ILE 121 1HG2 ILE 121 -16.516 17.145 5.544 940 2HG2 ILE 121 2HG2 ILE 121 -16.398 15.565 6.318 941 3HG2 ILE 121 3HG2 ILE 121 -14.937 16.405 5.801 942 1HD1 ILE 121 1HD1 ILE 121 -16.626 20.014 7.526 943 2HD1 ILE 121 2HD1 ILE 121 -16.065 19.391 9.077 944 3HD1 ILE 121 3HD1 ILE 121 -17.773 19.763 8.841 945 HA PRO 122 HA PRO 122 -11.992 13.872 9.261 946 1HB PRO 122 1HB PRO 122 -13.284 11.628 7.782 947 2HB PRO 122 2HB PRO 122 -12.249 11.584 9.213 948 1HG PRO 122 1HG PRO 122 -14.876 11.233 9.435 949 2HG PRO 122 2HG PRO 122 -13.977 12.166 10.646 950 1HD PRO 122 1HD PRO 122 -15.770 13.123 8.461 951 2HD PRO 122 2HD PRO 122 -15.527 13.779 10.093 952 H LEU 123 H LEU 123 -10.552 12.652 7.577 953 HA LEU 123 HA LEU 123 -11.011 13.797 4.904 954 1HB LEU 123 1HB LEU 123 -9.354 15.151 6.055 955 2HB LEU 123 2HB LEU 123 -8.417 13.721 6.444 956 HG LEU 123 HG LEU 123 -7.884 13.377 4.102 957 1HD1 LEU 123 1HD1 LEU 123 -9.877 15.559 3.716 958 2HD1 LEU 123 2HD1 LEU 123 -9.667 14.052 2.824 959 3HD1 LEU 123 3HD1 LEU 123 -8.547 15.390 2.571 960 1HD2 LEU 123 1HD2 LEU 123 -7.299 15.946 5.444 961 2HD2 LEU 123 2HD2 LEU 123 -6.880 15.825 3.736 962 3HD2 LEU 123 3HD2 LEU 123 -6.206 14.678 4.893 963 HA PRO 124 HA PRO 124 -10.356 9.273 4.411 964 1HB PRO 124 1HB PRO 124 -11.916 9.054 2.199 965 2HB PRO 124 2HB PRO 124 -12.568 9.017 3.841 966 1HG PRO 124 1HG PRO 124 -12.462 11.291 1.897 967 2HG PRO 124 2HG PRO 124 -13.792 10.787 2.955 968 1HD PRO 124 1HD PRO 124 -12.159 12.856 3.563 969 2HD PRO 124 2HD PRO 124 -12.873 11.810 4.807 970 H VAL 125 H VAL 125 -9.152 8.123 2.873 971 HA VAL 125 HA VAL 125 -8.215 9.507 0.492 972 HB VAL 125 HB VAL 125 -6.221 8.451 2.497 973 1HG1 VAL 125 1HG1 VAL 125 -4.581 8.988 1.023 974 2HG1 VAL 125 2HG1 VAL 125 -5.492 10.330 0.328 975 3HG1 VAL 125 3HG1 VAL 125 -5.870 8.671 -0.138 976 1HG2 VAL 125 1HG2 VAL 125 -7.141 10.378 3.512 977 2HG2 VAL 125 2HG2 VAL 125 -7.172 11.258 1.984 978 3HG2 VAL 125 3HG2 VAL 125 -5.632 10.897 2.762 979 H LEU 126 H LEU 126 -8.236 8.106 -1.131 980 HA LEU 126 HA LEU 126 -7.638 5.280 -0.573 981 1HB LEU 126 1HB LEU 126 -9.327 4.788 -2.436 982 2HB LEU 126 2HB LEU 126 -9.949 5.209 -0.852 983 HG LEU 126 HG LEU 126 -9.608 7.426 -2.797 984 1HD1 LEU 126 1HD1 LEU 126 -10.685 6.226 -4.381 985 2HD1 LEU 126 2HD1 LEU 126 -12.099 6.696 -3.438 986 3HD1 LEU 126 3HD1 LEU 126 -11.381 5.101 -3.215 987 1HD2 LEU 126 1HD2 LEU 126 -11.134 8.466 -1.500 988 2HD2 LEU 126 2HD2 LEU 126 -10.610 7.277 -0.308 989 3HD2 LEU 126 3HD2 LEU 126 -12.078 6.998 -1.244 990 H LEU 127 H LEU 127 -6.061 4.481 -1.793 991 HA LEU 127 HA LEU 127 -5.662 5.453 -4.507 992 1HB LEU 127 1HB LEU 127 -3.458 5.523 -2.443 993 2HB LEU 127 2HB LEU 127 -3.270 5.869 -4.152 994 HG LEU 127 HG LEU 127 -5.032 7.483 -2.311 995 1HD1 LEU 127 1HD1 LEU 127 -2.447 7.421 -1.896 996 2HD1 LEU 127 2HD1 LEU 127 -3.322 8.952 -1.896 997 3HD1 LEU 127 3HD1 LEU 127 -2.404 8.460 -3.320 998 1HD2 LEU 127 1HD2 LEU 127 -5.379 8.913 -4.066 999 2HD2 LEU 127 2HD2 LEU 127 -5.272 7.378 -4.927 1000 3HD2 LEU 127 3HD2 LEU 127 -3.881 8.460 -4.877 1001 HA PRO 128 HA PRO 128 -4.696 1.202 -5.194 1002 1HB PRO 128 1HB PRO 128 -3.184 1.378 -7.437 1003 2HB PRO 128 2HB PRO 128 -4.931 1.643 -7.439 1004 1HG PRO 128 1HG PRO 128 -2.711 3.652 -7.405 1005 2HG PRO 128 2HG PRO 128 -4.212 3.658 -8.351 1006 1HD PRO 128 1HD PRO 128 -3.903 5.123 -6.093 1007 2HD PRO 128 2HD PRO 128 -5.469 4.447 -6.588 1008 H LEU 129 H LEU 129 -3.176 -0.260 -4.600 1009 HA LEU 129 HA LEU 129 -0.365 0.449 -4.562 1010 1HB LEU 129 1HB LEU 129 -1.792 0.998 -2.308 1011 2HB LEU 129 2HB LEU 129 -1.261 -0.640 -1.977 1012 HG LEU 129 HG LEU 129 0.757 1.362 -2.888 1013 1HD1 LEU 129 1HD1 LEU 129 -0.489 1.234 -0.157 1014 2HD1 LEU 129 2HD1 LEU 129 -0.275 2.640 -1.199 1015 3HD1 LEU 129 3HD1 LEU 129 1.126 1.885 -0.439 1016 1HD2 LEU 129 1HD2 LEU 129 1.253 -0.544 -0.697 1017 2HD2 LEU 129 2HD2 LEU 129 2.258 -0.114 -2.081 1018 3HD2 LEU 129 3HD2 LEU 129 0.927 -1.255 -2.277 1019 H ALA 130 H ALA 130 1.019 -1.341 -4.400 1020 HA ALA 130 HA ALA 130 -0.317 -3.965 -4.543 1021 1HB ALA 130 1HB ALA 130 2.157 -3.234 -6.092 1022 2HB ALA 130 2HB ALA 130 0.527 -3.085 -6.748 1023 3HB ALA 130 3HB ALA 130 1.144 -4.666 -6.272 1024 H SER 131 H SER 131 1.581 -5.728 -4.428 1025 HA SER 131 HA SER 131 3.728 -5.108 -2.647 1026 1HB SER 131 1HB SER 131 2.954 -6.459 -0.737 1027 2HB SER 131 2HB SER 131 1.885 -5.086 -1.024 1028 HG SER 131 HG SER 131 0.321 -6.436 -1.355 1029 H VAL 132 H VAL 132 5.311 -6.412 -3.263 1030 HA VAL 132 HA VAL 132 4.735 -9.223 -3.819 1031 HB VAL 132 HB VAL 132 4.659 -8.098 -6.007 1032 1HG1 VAL 132 1HG1 VAL 132 7.561 -7.506 -5.948 1033 2HG1 VAL 132 2HG1 VAL 132 6.491 -6.391 -5.097 1034 3HG1 VAL 132 3HG1 VAL 132 6.255 -6.701 -6.817 1035 1HG2 VAL 132 1HG2 VAL 132 6.885 -9.401 -6.854 1036 2HG2 VAL 132 2HG2 VAL 132 5.343 -10.181 -6.506 1037 3HG2 VAL 132 3HG2 VAL 132 6.618 -10.165 -5.287 1038 H GLY 133 H GLY 133 6.283 -10.577 -3.094 1039 1HA GLY 133 1HA GLY 133 8.996 -10.258 -3.000 1040 2HA GLY 133 2HA GLY 133 8.427 -9.483 -1.529 1041 H TYR 134 H TYR 134 9.709 -11.129 -0.440 1042 HA TYR 134 HA TYR 134 8.085 -13.490 0.098 1043 1HB TYR 134 1HB TYR 134 10.198 -14.912 0.045 1044 2HB TYR 134 2HB TYR 134 9.548 -14.424 -1.516 1045 HD1 TYR 134 HD1 TYR 134 12.448 -14.584 0.486 1046 HD2 TYR 134 HD2 TYR 134 10.580 -12.244 -2.537 1047 HE1 TYR 134 HE1 TYR 134 14.633 -13.627 -0.115 1048 HE2 TYR 134 HE2 TYR 134 12.759 -11.280 -3.146 1049 HH TYR 134 HH TYR 134 15.641 -12.560 -2.287 1050 H GLY 135 H GLY 135 8.362 -14.349 2.162 1051 1HA GLY 135 1HA GLY 135 8.805 -14.263 4.412 1052 2HA GLY 135 2HA GLY 135 10.425 -13.767 3.945 1053 HA PRO 136 HA PRO 136 8.793 -10.222 6.343 1054 1HB PRO 136 1HB PRO 136 11.237 -9.332 7.135 1055 2HB PRO 136 2HB PRO 136 10.358 -10.614 7.975 1056 1HG PRO 136 1HG PRO 136 12.579 -10.833 5.980 1057 2HG PRO 136 2HG PRO 136 12.341 -11.729 7.491 1058 1HD PRO 136 1HD PRO 136 11.733 -12.778 5.075 1059 2HD PRO 136 2HD PRO 136 10.812 -13.174 6.539 1060 H VAL 137 H VAL 137 11.003 -10.479 3.699 1061 HA VAL 137 HA VAL 137 11.074 -7.594 3.273 1062 HB VAL 137 HB VAL 137 12.317 -9.743 1.556 1063 1HG1 VAL 137 1HG1 VAL 137 12.429 -7.893 0.236 1064 2HG1 VAL 137 2HG1 VAL 137 13.878 -7.622 1.204 1065 3HG1 VAL 137 3HG1 VAL 137 12.382 -6.778 1.601 1066 1HG2 VAL 137 1HG2 VAL 137 13.557 -10.137 3.403 1067 2HG2 VAL 137 2HG2 VAL 137 13.167 -8.578 4.130 1068 3HG2 VAL 137 3HG2 VAL 137 14.406 -8.683 2.878 1069 H THR 138 H THR 138 9.379 -6.715 2.287 1070 HA THR 138 HA THR 138 8.346 -8.004 -0.135 1071 HB THR 138 HB THR 138 6.454 -6.714 1.810 1072 HG1 THR 138 HG1 THR 138 7.248 -9.436 1.765 1073 1HG2 THR 138 1HG2 THR 138 4.997 -8.593 0.728 1074 2HG2 THR 138 2HG2 THR 138 6.199 -8.491 -0.558 1075 3HG2 THR 138 3HG2 THR 138 5.267 -7.063 -0.107 1076 H PHE 139 H PHE 139 8.345 -6.630 -1.782 1077 HA PHE 139 HA PHE 139 8.678 -3.783 -1.259 1078 1HB PHE 139 1HB PHE 139 8.947 -5.460 -3.753 1079 2HB PHE 139 2HB PHE 139 9.046 -3.703 -3.774 1080 HD1 PHE 139 HD1 PHE 139 10.840 -6.727 -3.354 1081 HD2 PHE 139 HD2 PHE 139 10.804 -2.622 -2.235 1082 HE1 PHE 139 HE1 PHE 139 13.233 -6.861 -2.797 1083 HE2 PHE 139 HE2 PHE 139 13.196 -2.748 -1.676 1084 HZ PHE 139 HZ PHE 139 14.414 -4.870 -1.958 1085 H GLN 140 H GLN 140 7.025 -2.423 -1.299 1086 HA GLN 140 HA GLN 140 4.550 -3.250 -2.649 1087 1HB GLN 140 1HB GLN 140 5.079 -1.354 -0.369 1088 2HB GLN 140 2HB GLN 140 3.542 -1.380 -1.222 1089 1HG GLN 140 1HG GLN 140 3.578 -3.915 -0.676 1090 2HG GLN 140 2HG GLN 140 4.757 -3.449 0.549 1091 1HE2 GLN 140 1HE2 GLN 140 2.094 -4.550 0.892 1092 2HE2 GLN 140 2HE2 GLN 140 1.211 -3.404 1.835 1093 H MET 141 H MET 141 3.577 -1.974 -4.168 1094 HA MET 141 HA MET 141 5.145 0.337 -5.097 1095 1HB MET 141 1HB MET 141 3.491 -1.708 -6.538 1096 2HB MET 141 2HB MET 141 3.759 -0.127 -7.260 1097 1HG MET 141 1HG MET 141 5.489 -1.272 -8.179 1098 2HG MET 141 2HG MET 141 6.273 -0.674 -6.719 1099 1HE MET 141 1HE MET 141 7.372 -4.059 -8.157 1100 2HE MET 141 2HE MET 141 6.230 -2.987 -8.969 1101 3HE MET 141 3HE MET 141 5.705 -4.575 -8.408 1102 H THR 142 H THR 142 4.247 2.297 -5.076 1103 HA THR 142 HA THR 142 1.355 2.481 -4.539 1104 HB THR 142 HB THR 142 3.372 4.618 -3.879 1105 HG1 THR 142 HG1 THR 142 2.580 2.391 -2.323 1106 1HG2 THR 142 1HG2 THR 142 0.793 4.957 -3.859 1107 2HG2 THR 142 2HG2 THR 142 1.783 5.569 -2.534 1108 3HG2 THR 142 3HG2 THR 142 0.885 4.063 -2.342 1109 H TYR 143 H TYR 143 0.110 3.539 -5.948 1110 HA TYR 143 HA TYR 143 1.443 5.014 -8.119 1111 1HB TYR 143 1HB TYR 143 -0.837 3.148 -8.039 1112 2HB TYR 143 2HB TYR 143 -1.088 4.573 -9.041 1113 HD1 TYR 143 HD1 TYR 143 -0.166 1.299 -9.224 1114 HD2 TYR 143 HD2 TYR 143 1.242 5.124 -10.445 1115 HE1 TYR 143 HE1 TYR 143 1.118 0.242 -11.037 1116 HE2 TYR 143 HE2 TYR 143 2.528 4.078 -12.261 1117 HH TYR 143 HH TYR 143 2.031 1.297 -13.502 1118 H ILE 144 H ILE 144 1.189 7.142 -8.164 1119 HA ILE 144 HA ILE 144 -1.226 8.303 -6.943 1120 HB ILE 144 HB ILE 144 1.513 9.561 -6.806 1121 1HG1 ILE 144 1HG1 ILE 144 0.020 8.218 -4.548 1122 2HG1 ILE 144 2HG1 ILE 144 1.278 7.415 -5.482 1123 1HG2 ILE 144 1HG2 ILE 144 -0.556 11.013 -6.754 1124 2HG2 ILE 144 2HG2 ILE 144 0.538 11.172 -5.379 1125 3HG2 ILE 144 3HG2 ILE 144 -0.950 10.237 -5.219 1126 1HD1 ILE 144 1HD1 ILE 144 1.906 8.486 -3.243 1127 2HD1 ILE 144 2HD1 ILE 144 1.804 10.018 -4.109 1128 3HD1 ILE 144 3HD1 ILE 144 2.949 8.784 -4.633 1129 HA PRO 145 HA PRO 145 -1.538 10.296 -10.910 1130 1HB PRO 145 1HB PRO 145 -3.522 12.033 -10.347 1131 2HB PRO 145 2HB PRO 145 -3.810 10.297 -10.512 1132 1HG PRO 145 1HG PRO 145 -3.490 11.937 -8.028 1133 2HG PRO 145 2HG PRO 145 -4.663 10.654 -8.377 1134 1HD PRO 145 1HD PRO 145 -2.408 10.250 -6.905 1135 2HD PRO 145 2HD PRO 145 -3.165 8.982 -7.889 1136 H GLY 146 H GLY 146 -0.429 11.914 -11.831 1137 1HA GLY 146 1HA GLY 146 0.983 13.802 -10.216 1138 2HA GLY 146 2HA GLY 146 0.990 13.726 -11.971 1139 H THR 147 H THR 147 -0.040 15.277 -13.061 1140 HA THR 147 HA THR 147 -2.029 16.900 -11.619 1141 HB THR 147 HB THR 147 -0.137 18.079 -13.642 1142 HG1 THR 147 HG1 THR 147 0.248 17.963 -10.834 1143 1HG2 THR 147 1HG2 THR 147 -1.497 19.811 -13.303 1144 2HG2 THR 147 2HG2 THR 147 -0.648 19.980 -11.767 1145 3HG2 THR 147 3HG2 THR 147 -2.182 19.113 -11.836 1146 H TYR 148 H TYR 148 -0.762 15.954 -14.795 1147 HA TYR 148 HA TYR 148 -3.389 15.503 -15.818 1148 1HB TYR 148 1HB TYR 148 -3.335 17.189 -17.606 1149 2HB TYR 148 2HB TYR 148 -3.349 17.943 -16.016 1150 HD1 TYR 148 HD1 TYR 148 -1.352 19.076 -15.160 1151 HD2 TYR 148 HD2 TYR 148 -1.425 17.384 -19.063 1152 HE1 TYR 148 HE1 TYR 148 0.659 20.365 -15.749 1153 HE2 TYR 148 HE2 TYR 148 0.585 18.667 -19.663 1154 HH TYR 148 HH TYR 148 1.671 20.893 -18.815 1155 H ASN 149 H ASN 149 -0.876 14.094 -15.519 1156 HA ASN 149 HA ASN 149 -0.722 12.964 -18.150 1157 1HB ASN 149 1HB ASN 149 1.760 13.287 -18.356 1158 2HB ASN 149 2HB ASN 149 0.819 14.763 -18.550 1159 1HD2 ASN 149 1HD2 ASN 149 3.478 13.467 -17.131 1160 2HD2 ASN 149 2HD2 ASN 149 3.706 14.603 -15.850 1161 H ASN 150 H ASN 150 -0.875 10.885 -17.642 1162 HA ASN 150 HA ASN 150 0.635 9.881 -15.324 1163 1HB ASN 150 1HB ASN 150 -2.058 9.564 -16.004 1164 2HB ASN 150 2HB ASN 150 -1.314 8.017 -16.401 1165 1HD2 ASN 150 1HD2 ASN 150 -2.533 7.081 -14.711 1166 2HD2 ASN 150 2HD2 ASN 150 -2.042 7.253 -13.063 1167 H GLY 151 H GLY 151 1.192 7.451 -15.599 1168 1HA GLY 151 1HA GLY 151 2.082 5.715 -16.896 1169 2HA GLY 151 2HA GLY 151 1.901 6.721 -18.325 1170 H ASN 152 H ASN 152 3.509 7.676 -15.342 1171 HA ASN 152 HA ASN 152 6.146 7.170 -16.359 1172 1HB ASN 152 1HB ASN 152 5.167 9.379 -17.441 1173 2HB ASN 152 2HB ASN 152 5.623 10.075 -15.888 1174 1HD2 ASN 152 1HD2 ASN 152 7.690 10.578 -15.526 1175 2HD2 ASN 152 2HD2 ASN 152 8.995 10.234 -16.606 1176 H VAL 153 H VAL 153 4.269 9.148 -14.075 1177 HA VAL 153 HA VAL 153 6.313 9.144 -12.081 1178 HB VAL 153 HB VAL 153 4.605 10.092 -10.588 1179 1HG1 VAL 153 1HG1 VAL 153 4.233 11.469 -13.214 1180 2HG1 VAL 153 2HG1 VAL 153 5.835 11.380 -12.480 1181 3HG1 VAL 153 3HG1 VAL 153 4.510 12.158 -11.614 1182 1HG2 VAL 153 1HG2 VAL 153 2.640 8.903 -11.193 1183 2HG2 VAL 153 2HG2 VAL 153 2.744 9.450 -12.866 1184 3HG2 VAL 153 3HG2 VAL 153 2.346 10.597 -11.588 1185 H TYR 154 H TYR 154 6.821 7.572 -10.716 1186 HA TYR 154 HA TYR 154 4.746 5.688 -9.856 1187 1HB TYR 154 1HB TYR 154 6.524 3.854 -10.052 1188 2HB TYR 154 2HB TYR 154 5.780 4.412 -11.546 1189 HD1 TYR 154 HD1 TYR 154 7.109 5.204 -13.303 1190 HD2 TYR 154 HD2 TYR 154 8.799 4.844 -9.415 1191 HE1 TYR 154 HE1 TYR 154 9.333 5.691 -14.231 1192 HE2 TYR 154 HE2 TYR 154 11.027 5.330 -10.332 1193 HH TYR 154 HH TYR 154 11.507 6.573 -13.436 1194 H PHE 155 H PHE 155 4.885 5.062 -7.757 1195 HA PHE 155 HA PHE 155 7.202 6.052 -6.228 1196 1HB PHE 155 1HB PHE 155 4.387 6.569 -5.897 1197 2HB PHE 155 2HB PHE 155 5.018 5.761 -4.466 1198 HD1 PHE 155 HD1 PHE 155 7.012 6.763 -3.297 1199 HD2 PHE 155 HD2 PHE 155 4.813 8.833 -6.294 1200 HE1 PHE 155 HE1 PHE 155 7.945 8.896 -2.501 1201 HE2 PHE 155 HE2 PHE 155 5.743 10.970 -5.505 1202 HZ PHE 155 HZ PHE 155 7.312 11.004 -3.607 1203 H ALA 156 H ALA 156 7.925 4.795 -4.470 1204 HA ALA 156 HA ALA 156 6.925 2.023 -4.431 1205 1HB ALA 156 1HB ALA 156 9.449 1.564 -3.796 1206 2HB ALA 156 2HB ALA 156 9.702 3.042 -4.725 1207 3HB ALA 156 3HB ALA 156 8.920 1.650 -5.476 1208 H TRP 157 H TRP 157 7.657 0.837 -2.417 1209 HA TRP 157 HA TRP 157 8.246 2.410 -0.089 1210 1HB TRP 157 1HB TRP 157 5.619 2.447 -0.737 1211 2HB TRP 157 2HB TRP 157 5.672 0.989 0.248 1212 HD1 TRP 157 HD1 TRP 157 7.288 1.589 2.676 1213 HE1 TRP 157 HE1 TRP 157 6.766 3.512 4.304 1214 HE3 TRP 157 HE3 TRP 157 4.504 4.549 -0.427 1215 HZ2 TRP 157 HZ2 TRP 157 5.361 5.960 4.278 1216 HZ3 TRP 157 HZ3 TRP 157 3.607 6.665 0.452 1217 HH2 TRP 157 HH2 TRP 157 4.027 7.354 2.758 1218 H MET 158 H MET 158 9.070 1.182 1.540 1219 HA MET 158 HA MET 158 9.442 -1.647 0.957 1220 1HB MET 158 1HB MET 158 11.178 0.210 1.864 1221 2HB MET 158 2HB MET 158 10.634 -0.461 3.395 1222 1HG MET 158 1HG MET 158 11.461 -2.336 1.246 1223 2HG MET 158 2HG MET 158 12.707 -1.443 2.114 1224 1HE MET 158 1HE MET 158 12.113 -5.319 3.279 1225 2HE MET 158 2HE MET 158 12.348 -4.434 1.772 1226 3HE MET 158 3HE MET 158 10.720 -4.852 2.304 1227 H ARG 159 H ARG 159 8.630 -3.299 2.138 1228 HA ARG 159 HA ARG 159 6.958 -2.600 4.462 1229 1HB ARG 159 1HB ARG 159 5.682 -3.262 2.392 1230 2HB ARG 159 2HB ARG 159 6.421 -4.852 2.522 1231 1HG ARG 159 1HG ARG 159 5.424 -4.629 4.998 1232 2HG ARG 159 2HG ARG 159 4.271 -3.620 4.121 1233 1HD ARG 159 1HD ARG 159 4.626 -5.891 2.532 1234 2HD ARG 159 2HD ARG 159 4.521 -6.493 4.186 1235 HE ARG 159 HE ARG 159 2.448 -4.771 4.035 1236 1HH1 ARG 159 1HH1 ARG 159 3.469 -7.438 2.030 1237 2HH1 ARG 159 2HH1 ARG 159 1.862 -7.838 1.526 1238 1HH2 ARG 159 1HH2 ARG 159 0.333 -5.294 3.372 1239 2HH2 ARG 159 2HH2 ARG 159 0.081 -6.621 2.287 1240 H PHE 160 H PHE 160 7.129 -3.850 6.265 1241 HA PHE 160 HA PHE 160 8.756 -6.279 6.149 1242 1HB PHE 160 1HB PHE 160 9.981 -4.007 6.877 1243 2HB PHE 160 2HB PHE 160 9.295 -4.458 8.435 1244 HD1 PHE 160 HD1 PHE 160 9.990 -6.517 9.549 1245 HD2 PHE 160 HD2 PHE 160 11.756 -5.268 5.884 1246 HE1 PHE 160 HE1 PHE 160 11.849 -8.086 9.915 1247 HE2 PHE 160 HE2 PHE 160 13.618 -6.835 6.242 1248 HZ PHE 160 HZ PHE 160 13.667 -8.246 8.260 1249 H GLN 161 H GLN 161 7.878 -7.879 7.288 1250 HA GLN 161 HA GLN 161 5.731 -7.211 9.179 1251 1HB GLN 161 1HB GLN 161 6.303 -9.678 7.546 1252 2HB GLN 161 2HB GLN 161 5.148 -9.682 8.872 1253 1HG GLN 161 1HG GLN 161 3.588 -8.617 7.681 1254 2HG GLN 161 2HG GLN 161 4.754 -7.510 6.956 1255 1HE2 GLN 161 1HE2 GLN 161 4.450 -11.041 6.886 1256 2HE2 GLN 161 2HE2 GLN 161 4.387 -11.174 5.165 1257 H PHE 162 H PHE 162 6.250 -7.289 11.254 1258 HA PHE 162 HA PHE 162 8.010 -9.439 12.195 1259 1HB PHE 162 1HB PHE 162 8.977 -6.922 11.942 1260 2HB PHE 162 2HB PHE 162 8.319 -6.839 13.573 1261 HD1 PHE 162 HD1 PHE 162 9.586 -7.580 15.354 1262 HD2 PHE 162 HD2 PHE 162 10.519 -8.942 11.432 1263 HE1 PHE 162 HE1 PHE 162 11.598 -8.696 16.225 1264 HE2 PHE 162 HE2 PHE 162 12.533 -10.061 12.295 1265 HZ PHE 162 HZ PHE 162 13.075 -9.939 14.695 1266 H LEU 163 H LEU 163 8.019 -9.282 14.764 1267 HA LEU 163 HA LEU 163 5.211 -8.964 15.600 1268 1HB LEU 163 1HB LEU 163 7.167 -11.157 16.041 1269 2HB LEU 163 2HB LEU 163 6.079 -10.774 17.362 1270 HG LEU 163 HG LEU 163 5.266 -11.595 14.573 1271 1HD1 LEU 163 1HD1 LEU 163 6.203 -13.378 16.049 1272 2HD1 LEU 163 2HD1 LEU 163 4.528 -13.636 15.560 1273 3HD1 LEU 163 3HD1 LEU 163 4.893 -13.049 17.183 1274 1HD2 LEU 163 1HD2 LEU 163 3.018 -11.784 16.015 1275 2HD2 LEU 163 2HD2 LEU 163 3.459 -10.339 15.104 1276 3HD2 LEU 163 3HD2 LEU 163 3.775 -10.419 16.838 1277 H GLU 164 H GLU 164 4.944 -8.647 17.974 1278 HA GLU 164 HA GLU 164 7.064 -6.871 18.978 1279 1HB GLU 164 1HB GLU 164 4.799 -5.880 18.553 1280 2HB GLU 164 2HB GLU 164 4.160 -6.932 19.808 1281 1HG GLU 164 1HG GLU 164 4.558 -5.237 21.189 1282 2HG GLU 164 2HG GLU 164 6.250 -5.723 21.083 1283 HE2 GLU 164 HE2 GLU 164 6.820 -2.503 20.023 1284 H HIS 165 H HIS 165 8.308 -8.493 19.957 1285 HA HIS 165 HA HIS 165 7.339 -10.471 21.687 1286 1HB HIS 165 1HB HIS 165 9.701 -10.502 22.574 1287 2HB HIS 165 2HB HIS 165 9.559 -10.682 20.829 1288 HD1 HIS 165 HD1 HIS 165 9.986 -7.731 23.209 1289 HD2 HIS 165 HD2 HIS 165 11.401 -9.169 19.577 1290 HE1 HIS 165 HE1 HIS 165 11.685 -6.046 22.435 1291 HE2 HIS 165 HE2 HIS 165 12.460 -6.891 20.192 1292 H HIS 166 H HIS 166 7.306 -10.611 23.958 1293 HA HIS 166 HA HIS 166 6.255 -8.388 25.296 1294 1HB HIS 166 1HB HIS 166 6.437 -9.746 27.332 1295 2HB HIS 166 2HB HIS 166 5.804 -10.695 25.992 1296 HD1 HIS 166 HD1 HIS 166 8.282 -10.803 28.594 1297 HD2 HIS 166 HD2 HIS 166 7.964 -12.330 24.744 1298 HE1 HIS 166 HE1 HIS 166 9.979 -12.654 28.463 1299 HE2 HIS 166 HE2 HIS 166 9.707 -13.619 26.152 1300 H HIS 167 H HIS 167 7.394 -6.572 25.579 1301 HA HIS 167 HA HIS 167 10.204 -6.478 25.926 1302 1HB HIS 167 1HB HIS 167 8.289 -4.642 25.288 1303 2HB HIS 167 2HB HIS 167 8.661 -4.182 26.946 1304 HD1 HIS 167 HD1 HIS 167 10.085 -4.235 23.508 1305 HD2 HIS 167 HD2 HIS 167 11.267 -3.178 27.349 1306 HE1 HIS 167 HE1 HIS 167 12.209 -2.918 23.219 1307 HE2 HIS 167 HE2 HIS 167 12.858 -2.217 25.551 1308 H HIS 168 H HIS 168 7.504 -6.063 28.203 1309 HA HIS 168 HA HIS 168 9.092 -7.137 30.352 1310 1HB HIS 168 1HB HIS 168 8.791 -4.255 30.016 1311 2HB HIS 168 2HB HIS 168 8.197 -4.811 31.577 1312 HD1 HIS 168 HD1 HIS 168 11.194 -3.706 29.987 1313 HD2 HIS 168 HD2 HIS 168 10.292 -6.524 32.905 1314 HE1 HIS 168 HE1 HIS 168 13.358 -4.143 31.192 1315 HE2 HIS 168 HE2 HIS 168 12.769 -5.789 33.006 1316 H HIS 169 H HIS 169 6.187 -5.144 29.781 1317 HA HIS 169 HA HIS 169 4.544 -7.265 30.917 1318 1HB HIS 169 1HB HIS 169 5.230 -4.871 32.352 1319 2HB HIS 169 2HB HIS 169 3.502 -4.875 32.015 1320 HD1 HIS 169 HD1 HIS 169 4.503 -5.160 34.893 1321 HD2 HIS 169 HD2 HIS 169 3.668 -8.379 32.403 1322 HE1 HIS 169 HE1 HIS 169 4.041 -7.096 36.430 1323 HE2 HIS 169 HE2 HIS 169 3.624 -9.054 34.899 1324 H HIS 170 H HIS 170 2.129 -6.048 31.015 1325 HA HIS 170 HA HIS 170 1.675 -5.382 28.197 1326 1HB HIS 170 1HB HIS 170 0.464 -7.299 29.475 1327 2HB HIS 170 2HB HIS 170 -0.507 -6.003 30.165 1328 HD1 HIS 170 HD1 HIS 170 -2.594 -6.984 28.932 1329 HD2 HIS 170 HD2 HIS 170 0.433 -5.635 26.427 1330 HE1 HIS 170 HE1 HIS 170 -3.632 -6.831 26.647 1331 HE2 HIS 170 HE2 HIS 170 -1.805 -5.930 25.164 Start of MODEL 10 1 1H MET 1 1H MET 1 -29.468 -10.501 13.051 2 2H MET 1 2H MET 1 -29.553 -11.388 11.584 3 H MET 1 H MET 1 -29.106 -10.856 13.278 4 3H MET 1 3H MET 1 -28.921 -12.125 12.999 5 HA MET 1 HA MET 1 -31.685 -11.397 12.362 6 1HB MET 1 1HB MET 1 -30.215 -13.901 13.197 7 2HB MET 1 2HB MET 1 -31.969 -13.793 13.135 8 1HG MET 1 1HG MET 1 -31.359 -12.916 10.669 9 2HG MET 1 2HG MET 1 -30.004 -14.006 10.957 10 1HE MET 1 1HE MET 1 -32.825 -14.294 8.766 11 2HE MET 1 2HE MET 1 -32.455 -16.014 8.646 12 3HE MET 1 3HE MET 1 -31.147 -14.831 8.676 13 H ASN 2 H ASN 2 -29.410 -12.100 14.973 14 HA ASN 2 HA ASN 2 -31.330 -10.944 16.866 15 1HB ASN 2 1HB ASN 2 -31.012 -13.622 16.786 16 2HB ASN 2 2HB ASN 2 -29.700 -13.203 17.883 17 1HD2 ASN 2 1HD2 ASN 2 -32.960 -13.859 17.618 18 2HD2 ASN 2 2HD2 ASN 2 -33.469 -13.308 19.174 19 H ALA 3 H ALA 3 -30.374 -9.202 17.666 20 HA ALA 3 HA ALA 3 -27.646 -8.625 17.547 21 1HB ALA 3 1HB ALA 3 -29.845 -7.186 18.125 22 2HB ALA 3 2HB ALA 3 -28.201 -6.633 18.445 23 3HB ALA 3 3HB ALA 3 -29.155 -7.358 19.739 24 H ASP 4 H ASP 4 -29.402 -10.565 19.785 25 HA ASP 4 HA ASP 4 -27.521 -10.362 21.942 26 1HB ASP 4 1HB ASP 4 -30.087 -11.149 21.859 27 2HB ASP 4 2HB ASP 4 -29.311 -12.726 21.740 28 HD2 ASP 4 HD2 ASP 4 -29.176 -10.787 25.168 29 H GLU 5 H GLU 5 -28.384 -12.990 19.693 30 HA GLU 5 HA GLU 5 -26.184 -14.626 20.402 31 1HB GLU 5 1HB GLU 5 -28.266 -15.469 19.341 32 2HB GLU 5 2HB GLU 5 -27.805 -14.659 17.849 33 1HG GLU 5 1HG GLU 5 -25.586 -16.128 18.339 34 2HG GLU 5 2HG GLU 5 -26.839 -17.169 19.018 35 HE2 GLU 5 HE2 GLU 5 -26.522 -16.880 15.127 36 H TRP 6 H TRP 6 -26.581 -11.976 18.205 37 HA TRP 6 HA TRP 6 -24.290 -12.544 16.589 38 1HB TRP 6 1HB TRP 6 -26.224 -10.310 16.864 39 2HB TRP 6 2HB TRP 6 -24.649 -9.910 16.189 40 HD1 TRP 6 HD1 TRP 6 -26.566 -13.187 15.493 41 HE1 TRP 6 HE1 TRP 6 -27.051 -13.311 12.969 42 HE3 TRP 6 HE3 TRP 6 -24.839 -8.579 14.104 43 HZ2 TRP 6 HZ2 TRP 6 -26.742 -11.675 10.690 44 HZ3 TRP 6 HZ3 TRP 6 -24.969 -7.936 11.733 45 HH2 TRP 6 HH2 TRP 6 -25.902 -9.453 10.063 46 H MET 7 H MET 7 -24.869 -10.827 19.569 47 HA MET 7 HA MET 7 -22.377 -9.428 19.601 48 1HB MET 7 1HB MET 7 -24.724 -9.282 21.046 49 2HB MET 7 2HB MET 7 -23.589 -9.945 22.213 50 1HG MET 7 1HG MET 7 -22.580 -7.665 20.669 51 2HG MET 7 2HG MET 7 -23.947 -7.308 21.723 52 1HE MET 7 1HE MET 7 -22.600 -7.217 25.161 53 2HE MET 7 2HE MET 7 -23.800 -8.318 24.484 54 3HE MET 7 3HE MET 7 -23.751 -6.635 23.957 55 H THR 8 H THR 8 -23.494 -12.549 20.711 56 HA THR 8 HA THR 8 -21.422 -13.185 22.481 57 HB THR 8 HB THR 8 -22.053 -15.515 22.129 58 HG1 THR 8 HG1 THR 8 -23.595 -15.998 20.497 59 1HG2 THR 8 1HG2 THR 8 -23.602 -14.049 23.424 60 2HG2 THR 8 2HG2 THR 8 -24.357 -15.462 22.685 61 3HG2 THR 8 3HG2 THR 8 -24.559 -13.870 21.955 62 H THR 9 H THR 9 -21.741 -13.966 19.017 63 HA THR 9 HA THR 9 -19.244 -15.203 18.732 64 HB THR 9 HB THR 9 -21.010 -15.410 17.058 65 HG1 THR 9 HG1 THR 9 -18.696 -14.155 16.004 66 1HG2 THR 9 1HG2 THR 9 -20.460 -12.517 16.444 67 2HG2 THR 9 2HG2 THR 9 -21.966 -13.206 17.052 68 3HG2 THR 9 3HG2 THR 9 -21.403 -13.609 15.430 69 H PHE 10 H PHE 10 -20.173 -11.837 18.727 70 HA PHE 10 HA PHE 10 -17.797 -10.799 17.584 71 1HB PHE 10 1HB PHE 10 -19.965 -9.559 17.784 72 2HB PHE 10 2HB PHE 10 -19.668 -9.410 19.512 73 HD1 PHE 10 HD1 PHE 10 -17.786 -8.826 16.338 74 HD2 PHE 10 HD2 PHE 10 -18.852 -7.389 20.198 75 HE1 PHE 10 HE1 PHE 10 -16.485 -6.778 15.930 76 HE2 PHE 10 HE2 PHE 10 -17.554 -5.337 19.798 77 HZ PHE 10 HZ PHE 10 -16.369 -5.030 17.660 78 H ARG 11 H ARG 11 -18.845 -11.269 20.943 79 HA ARG 11 HA ARG 11 -16.611 -10.140 22.193 80 1HB ARG 11 1HB ARG 11 -18.937 -11.166 23.084 81 2HB ARG 11 2HB ARG 11 -17.860 -12.493 23.491 82 1HG ARG 11 1HG ARG 11 -16.944 -9.798 24.260 83 2HG ARG 11 2HG ARG 11 -18.351 -10.426 25.121 84 1HD ARG 11 1HD ARG 11 -17.155 -12.319 25.886 85 2HD ARG 11 2HD ARG 11 -15.819 -12.012 24.779 86 HE ARG 11 HE ARG 11 -15.936 -9.790 26.372 87 1HH1 ARG 11 1HH1 ARG 11 -15.574 -13.217 26.922 88 2HH1 ARG 11 2HH1 ARG 11 -14.633 -13.014 28.361 89 1HH2 ARG 11 1HH2 ARG 11 -14.697 -9.520 28.264 90 2HH2 ARG 11 2HH2 ARG 11 -14.135 -10.916 29.123 91 H GLU 12 H GLU 12 -17.242 -13.487 21.196 92 HA GLU 12 HA GLU 12 -14.881 -14.611 22.211 93 1HB GLU 12 1HB GLU 12 -17.075 -15.639 21.061 94 2HB GLU 12 2HB GLU 12 -15.988 -15.703 19.680 95 1HG GLU 12 1HG GLU 12 -14.468 -17.110 20.828 96 2HG GLU 12 2HG GLU 12 -15.294 -16.857 22.364 97 HE2 GLU 12 HE2 GLU 12 -17.466 -19.015 19.857 98 H ASN 13 H ASN 13 -15.538 -12.833 19.279 99 HA ASN 13 HA ASN 13 -13.192 -13.547 17.866 100 1HB ASN 13 1HB ASN 13 -15.451 -12.129 17.260 101 2HB ASN 13 2HB ASN 13 -14.250 -10.845 17.365 102 1HD2 ASN 13 1HD2 ASN 13 -14.393 -14.164 16.103 103 2HD2 ASN 13 2HD2 ASN 13 -13.691 -13.789 14.569 104 H ILE 14 H ILE 14 -13.918 -11.047 20.225 105 HA ILE 14 HA ILE 14 -11.500 -9.587 19.881 106 HB ILE 14 HB ILE 14 -13.217 -9.668 22.361 107 1HG1 ILE 14 1HG1 ILE 14 -14.640 -9.199 20.444 108 2HG1 ILE 14 2HG1 ILE 14 -14.405 -7.727 21.382 109 1HG2 ILE 14 1HG2 ILE 14 -10.820 -8.492 22.050 110 2HG2 ILE 14 2HG2 ILE 14 -12.091 -7.855 23.093 111 3HG2 ILE 14 3HG2 ILE 14 -11.871 -7.201 21.469 112 1HD1 ILE 14 1HD1 ILE 14 -12.874 -6.866 19.780 113 2HD1 ILE 14 2HD1 ILE 14 -14.301 -7.432 18.912 114 3HD1 ILE 14 3HD1 ILE 14 -12.827 -8.401 18.915 115 H ALA 15 H ALA 15 -12.437 -12.351 21.800 116 HA ALA 15 HA ALA 15 -10.171 -12.294 23.541 117 1HB ALA 15 1HB ALA 15 -12.419 -14.147 23.019 118 2HB ALA 15 2HB ALA 15 -11.812 -13.499 24.542 119 3HB ALA 15 3HB ALA 15 -10.967 -14.830 23.750 120 H GLN 16 H GLN 16 -10.999 -14.077 20.591 121 HA GLN 16 HA GLN 16 -8.687 -15.687 20.519 122 1HB GLN 16 1HB GLN 16 -10.972 -15.637 19.095 123 2HB GLN 16 2HB GLN 16 -9.896 -14.859 17.943 124 1HG GLN 16 1HG GLN 16 -8.432 -17.024 18.785 125 2HG GLN 16 2HG GLN 16 -10.081 -17.647 18.743 126 1HE2 GLN 16 1HE2 GLN 16 -11.099 -16.154 16.643 127 2HE2 GLN 16 2HE2 GLN 16 -10.318 -16.635 15.180 128 H THR 17 H THR 17 -9.417 -12.520 19.115 129 HA THR 17 HA THR 17 -7.078 -12.211 17.609 130 HB THR 17 HB THR 17 -7.548 -9.763 17.783 131 HG1 THR 17 HG1 THR 17 -9.725 -10.566 19.406 132 1HG2 THR 17 1HG2 THR 17 -10.235 -10.387 17.271 133 2HG2 THR 17 2HG2 THR 17 -9.275 -11.746 16.683 134 3HG2 THR 17 3HG2 THR 17 -8.938 -10.113 16.107 135 H TRP 18 H TRP 18 -7.811 -11.008 20.885 136 HA TRP 18 HA TRP 18 -5.226 -9.990 21.376 137 1HB TRP 18 1HB TRP 18 -7.546 -10.724 23.138 138 2HB TRP 18 2HB TRP 18 -6.010 -10.235 23.843 139 HD1 TRP 18 HD1 TRP 18 -8.518 -8.809 21.235 140 HE1 TRP 18 HE1 TRP 18 -8.606 -6.255 21.547 141 HE3 TRP 18 HE3 TRP 18 -5.027 -8.321 24.938 142 HZ2 TRP 18 HZ2 TRP 18 -7.360 -4.294 23.150 143 HZ3 TRP 18 HZ3 TRP 18 -4.533 -6.072 25.805 144 HH2 TRP 18 HH2 TRP 18 -5.677 -4.101 24.928 145 H GLN 19 H GLN 19 -6.648 -13.156 21.769 146 HA GLN 19 HA GLN 19 -4.660 -14.257 23.457 147 1HB GLN 19 1HB GLN 19 -6.858 -15.314 21.764 148 2HB GLN 19 2HB GLN 19 -5.576 -16.439 22.190 149 1HG GLN 19 1HG GLN 19 -6.024 -15.467 24.607 150 2HG GLN 19 2HG GLN 19 -7.606 -15.129 23.908 151 1HE2 GLN 19 1HE2 GLN 19 -8.709 -16.615 25.120 152 2HE2 GLN 19 2HE2 GLN 19 -8.513 -18.321 24.937 153 H GLN 20 H GLN 20 -5.210 -14.817 19.974 154 HA GLN 20 HA GLN 20 -2.303 -15.219 19.688 155 1HB GLN 20 1HB GLN 20 -3.912 -17.239 19.392 156 2HB GLN 20 2HB GLN 20 -4.307 -16.490 17.851 157 1HG GLN 20 1HG GLN 20 -2.218 -16.867 16.974 158 2HG GLN 20 2HG GLN 20 -1.451 -16.955 18.560 159 1HE2 GLN 20 1HE2 GLN 20 -1.664 -18.769 16.105 160 2HE2 GLN 20 2HE2 GLN 20 -2.052 -20.312 16.778 161 HA PRO 21 HA PRO 21 -3.481 -11.630 17.021 162 1HB PRO 21 1HB PRO 21 -1.223 -10.208 17.495 163 2HB PRO 21 2HB PRO 21 -2.626 -10.159 18.569 164 1HG PRO 21 1HG PRO 21 -0.088 -11.724 18.839 165 2HG PRO 21 2HG PRO 21 -0.981 -10.818 20.075 166 1HD PRO 21 1HD PRO 21 -1.154 -13.512 19.824 167 2HD PRO 21 2HD PRO 21 -2.507 -12.514 20.395 168 H GLU 22 H GLU 22 -2.058 -10.552 15.282 169 HA GLU 22 HA GLU 22 -0.513 -12.673 13.957 170 1HB GLU 22 1HB GLU 22 -2.407 -10.631 13.019 171 2HB GLU 22 2HB GLU 22 -0.964 -10.782 12.025 172 1HG GLU 22 1HG GLU 22 -2.071 -12.408 10.986 173 2HG GLU 22 2HG GLU 22 -1.669 -13.391 12.394 174 HE2 GLU 22 HE2 GLU 22 -5.000 -12.689 13.655 175 H HIS 23 H HIS 23 1.100 -11.617 12.283 176 HA HIS 23 HA HIS 23 3.148 -10.415 13.801 177 1HB HIS 23 1HB HIS 23 4.272 -10.116 11.565 178 2HB HIS 23 2HB HIS 23 3.758 -11.762 11.922 179 HD1 HIS 23 HD1 HIS 23 1.747 -12.697 10.549 180 HD2 HIS 23 HD2 HIS 23 3.028 -8.919 9.387 181 HE1 HIS 23 HE1 HIS 23 0.672 -12.281 8.314 182 HE2 HIS 23 HE2 HIS 23 1.528 -10.025 7.593 183 H TYR 24 H TYR 24 4.210 -8.346 13.326 184 HA TYR 24 HA TYR 24 2.205 -6.250 12.873 185 1HB TYR 24 1HB TYR 24 4.880 -6.169 14.283 186 2HB TYR 24 2HB TYR 24 3.856 -4.760 14.023 187 HD1 TYR 24 HD1 TYR 24 1.716 -4.543 15.217 188 HD2 TYR 24 HD2 TYR 24 4.350 -7.800 15.967 189 HE1 TYR 24 HE1 TYR 24 0.504 -5.036 17.298 190 HE2 TYR 24 HE2 TYR 24 3.144 -8.302 18.051 191 HH TYR 24 HH TYR 24 1.414 -6.423 19.674 192 H ASP 25 H ASP 25 2.180 -5.629 10.805 193 HA ASP 25 HA ASP 25 4.561 -5.663 9.178 194 1HB ASP 25 1HB ASP 25 1.792 -4.617 8.547 195 2HB ASP 25 2HB ASP 25 3.086 -4.878 7.382 196 HD2 ASP 25 HD2 ASP 25 2.654 -8.365 7.553 197 H LEU 26 H LEU 26 5.954 -4.048 8.942 198 HA LEU 26 HA LEU 26 5.099 -1.339 9.724 199 1HB LEU 26 1HB LEU 26 7.542 -0.949 10.200 200 2HB LEU 26 2HB LEU 26 6.715 -2.038 11.296 201 HG LEU 26 HG LEU 26 8.125 -3.276 8.998 202 1HD1 LEU 26 1HD1 LEU 26 9.461 -1.680 11.108 203 2HD1 LEU 26 2HD1 LEU 26 9.951 -1.998 9.444 204 3HD1 LEU 26 3HD1 LEU 26 10.174 -3.234 10.681 205 1HD2 LEU 26 1HD2 LEU 26 7.055 -4.780 10.443 206 2HD2 LEU 26 2HD2 LEU 26 7.609 -3.925 11.883 207 3HD2 LEU 26 3HD2 LEU 26 8.755 -4.845 10.908 208 H TYR 27 H TYR 27 5.642 0.381 8.424 209 HA TYR 27 HA TYR 27 7.041 -0.230 5.910 210 1HB TYR 27 1HB TYR 27 4.469 1.340 6.187 211 2HB TYR 27 2HB TYR 27 5.412 1.208 4.706 212 HD1 TYR 27 HD1 TYR 27 3.158 -0.534 7.004 213 HD2 TYR 27 HD2 TYR 27 5.447 -0.865 3.432 214 HE1 TYR 27 HE1 TYR 27 1.934 -2.584 6.417 215 HE2 TYR 27 HE2 TYR 27 4.228 -2.917 2.835 216 HH TYR 27 HH TYR 27 1.816 -3.874 3.459 217 H ILE 28 H ILE 28 8.811 0.980 5.871 218 HA ILE 28 HA ILE 28 8.661 3.726 6.933 219 HB ILE 28 HB ILE 28 11.160 3.538 7.206 220 1HG1 ILE 28 1HG1 ILE 28 10.928 0.586 7.309 221 2HG1 ILE 28 2HG1 ILE 28 10.965 1.303 5.701 222 1HG2 ILE 28 1HG2 ILE 28 9.403 3.245 9.019 223 2HG2 ILE 28 2HG2 ILE 28 11.003 2.582 9.349 224 3HG2 ILE 28 3HG2 ILE 28 9.688 1.512 8.865 225 1HD1 ILE 28 1HD1 ILE 28 13.120 1.990 5.908 226 2HD1 ILE 28 2HD1 ILE 28 13.161 0.571 6.954 227 3HD1 ILE 28 3HD1 ILE 28 13.010 2.181 7.658 228 HA PRO 29 HA PRO 29 9.620 5.126 2.844 229 1HB PRO 29 1HB PRO 29 10.570 7.592 3.398 230 2HB PRO 29 2HB PRO 29 8.859 7.180 3.562 231 1HG PRO 29 1HG PRO 29 10.975 7.358 5.673 232 2HG PRO 29 2HG PRO 29 9.303 7.948 5.713 233 1HD PRO 29 1HD PRO 29 10.081 5.623 6.887 234 2HD PRO 29 2HD PRO 29 8.452 5.875 6.229 235 H ALA 30 H ALA 30 11.590 6.690 1.942 236 HA ALA 30 HA ALA 30 14.175 6.057 2.965 237 1HB ALA 30 1HB ALA 30 13.232 3.921 1.753 238 2HB ALA 30 2HB ALA 30 14.917 4.404 1.563 239 3HB ALA 30 3HB ALA 30 13.742 4.790 0.306 240 H ILE 31 H ILE 31 14.255 8.352 2.749 241 HA ILE 31 HA ILE 31 14.934 9.196 0.019 242 HB ILE 31 HB ILE 31 13.906 11.441 0.542 243 1HG1 ILE 31 1HG1 ILE 31 12.111 10.084 2.493 244 2HG1 ILE 31 2HG1 ILE 31 13.693 10.600 3.069 245 1HG2 ILE 31 1HG2 ILE 31 11.703 9.451 0.538 246 2HG2 ILE 31 2HG2 ILE 31 12.894 9.368 -0.760 247 3HG2 ILE 31 3HG2 ILE 31 11.970 10.849 -0.504 248 1HD1 ILE 31 1HD1 ILE 31 11.835 12.464 1.634 249 2HD1 ILE 31 2HD1 ILE 31 13.229 12.856 2.643 250 3HD1 ILE 31 3HD1 ILE 31 11.761 12.208 3.378 251 H THR 32 H THR 32 16.548 10.749 -0.140 252 HA THR 32 HA THR 32 18.452 11.846 0.443 253 HB THR 32 HB THR 32 17.398 12.258 3.217 254 HG1 THR 32 HG1 THR 32 15.580 12.722 2.149 255 1HG2 THR 32 1HG2 THR 32 18.982 13.879 1.270 256 2HG2 THR 32 2HG2 THR 32 19.375 13.432 2.930 257 3HG2 THR 32 3HG2 THR 32 18.127 14.637 2.613 258 H TRP 33 H TRP 33 20.096 10.438 0.498 259 HA TRP 33 HA TRP 33 20.817 9.295 3.084 260 1HB TRP 33 1HB TRP 33 19.524 7.690 1.319 261 2HB TRP 33 2HB TRP 33 21.192 7.436 0.816 262 HD1 TRP 33 HD1 TRP 33 22.800 6.139 2.490 263 HE1 TRP 33 HE1 TRP 33 22.337 4.691 4.567 264 HE3 TRP 33 HE3 TRP 33 17.938 7.474 3.346 265 HZ2 TRP 33 HZ2 TRP 33 20.194 4.181 6.334 266 HZ3 TRP 33 HZ3 TRP 33 16.754 6.460 5.249 267 HH2 TRP 33 HH2 TRP 33 17.860 4.847 6.712 268 H HIS 34 H HIS 34 21.864 11.472 1.516 269 HA HIS 34 HA HIS 34 24.549 10.408 0.934 270 1HB HIS 34 1HB HIS 34 22.852 11.704 -0.854 271 2HB HIS 34 2HB HIS 34 23.982 12.957 -0.352 272 HD1 HIS 34 HD1 HIS 34 26.431 10.908 -0.057 273 HD2 HIS 34 HD2 HIS 34 23.978 11.404 -3.374 274 HE1 HIS 34 HE1 HIS 34 27.776 10.088 -2.016 275 HE2 HIS 34 HE2 HIS 34 26.239 10.314 -3.999 276 H ALA 35 H ALA 35 25.977 12.695 0.726 277 HA ALA 35 HA ALA 35 25.485 14.653 2.687 278 1HB ALA 35 1HB ALA 35 27.544 13.736 4.126 279 2HB ALA 35 2HB ALA 35 26.863 12.198 3.595 280 3HB ALA 35 3HB ALA 35 25.865 13.341 4.495 281 H ARG 36 H ARG 36 26.907 16.325 2.507 282 HA ARG 36 HA ARG 36 29.404 15.874 1.035 283 1HB ARG 36 1HB ARG 36 27.326 16.799 -0.333 284 2HB ARG 36 2HB ARG 36 27.822 18.321 0.395 285 1HG ARG 36 1HG ARG 36 29.101 18.472 -1.443 286 2HG ARG 36 2HG ARG 36 30.197 17.445 -0.517 287 1HD ARG 36 1HD ARG 36 29.698 15.575 -1.738 288 2HD ARG 36 2HD ARG 36 28.075 16.136 -2.135 289 HE ARG 36 HE ARG 36 30.387 16.458 -3.713 290 1HH1 ARG 36 1HH1 ARG 36 27.542 18.203 -2.693 291 2HH1 ARG 36 2HH1 ARG 36 27.492 19.200 -4.107 292 1HH2 ARG 36 1HH2 ARG 36 30.324 17.769 -5.574 293 2HH2 ARG 36 2HH2 ARG 36 29.072 18.953 -5.744 294 H PHE 37 H PHE 37 27.477 18.406 2.649 295 HA PHE 37 HA PHE 37 29.966 19.427 3.839 296 1HB PHE 37 1HB PHE 37 28.567 21.494 4.294 297 2HB PHE 37 2HB PHE 37 28.905 21.156 2.601 298 HD1 PHE 37 HD1 PHE 37 26.316 20.715 5.225 299 HD2 PHE 37 HD2 PHE 37 27.169 20.999 1.066 300 HE1 PHE 37 HE1 PHE 37 23.904 20.776 4.740 301 HE2 PHE 37 HE2 PHE 37 24.760 21.062 0.572 302 HZ PHE 37 HZ PHE 37 23.124 20.952 2.410 303 H ALA 38 H ALA 38 29.790 20.285 6.061 304 HA ALA 38 HA ALA 38 28.548 18.339 7.768 305 1HB ALA 38 1HB ALA 38 30.438 20.587 8.106 306 2HB ALA 38 2HB ALA 38 30.504 18.943 8.737 307 3HB ALA 38 3HB ALA 38 29.474 20.144 9.515 308 H TYR 39 H TYR 39 26.664 18.470 8.814 309 HA TYR 39 HA TYR 39 25.095 20.924 8.518 310 1HB TYR 39 1HB TYR 39 23.166 19.502 9.150 311 2HB TYR 39 2HB TYR 39 24.014 18.897 7.732 312 HD1 TYR 39 HD1 TYR 39 23.302 18.313 11.287 313 HD2 TYR 39 HD2 TYR 39 25.203 16.798 7.795 314 HE1 TYR 39 HE1 TYR 39 23.543 16.121 12.376 315 HE2 TYR 39 HE2 TYR 39 25.448 14.602 8.874 316 HH TYR 39 HH TYR 39 25.566 13.860 11.534 317 H ASP 40 H ASP 40 24.624 22.210 10.186 318 HA ASP 40 HA ASP 40 25.890 21.931 12.673 319 1HB ASP 40 1HB ASP 40 24.705 23.991 11.400 320 2HB ASP 40 2HB ASP 40 23.440 23.597 12.561 321 HD2 ASP 40 HD2 ASP 40 25.184 25.068 15.107 322 H LYS 41 H LYS 41 25.375 20.834 14.450 323 HA LYS 41 HA LYS 41 22.990 19.228 14.504 324 1HB LYS 41 1HB LYS 41 25.318 19.564 16.384 325 2HB LYS 41 2HB LYS 41 23.928 18.571 16.800 326 1HG LYS 41 1HG LYS 41 24.329 17.206 14.793 327 2HG LYS 41 2HG LYS 41 25.761 18.177 14.444 328 1HD LYS 41 1HD LYS 41 26.979 17.221 16.107 329 2HD LYS 41 2HD LYS 41 25.576 17.008 17.156 330 1HE LYS 41 1HE LYS 41 24.826 15.143 15.740 331 2HE LYS 41 2HE LYS 41 26.260 15.345 14.734 332 1HZ LYS 41 1HZ LYS 41 26.662 14.979 17.605 333 2HZ LYS 41 2HZ LYS 41 27.604 14.446 16.306 334 3HZ LYS 41 3HZ LYS 41 26.180 13.627 16.709 335 H GLU 42 H GLU 42 21.448 19.218 16.250 336 HA GLU 42 HA GLU 42 21.035 21.903 17.391 337 1HB GLU 42 1HB GLU 42 19.121 19.839 16.356 338 2HB GLU 42 2HB GLU 42 18.587 21.014 17.549 339 1HG GLU 42 1HG GLU 42 19.998 22.034 15.152 340 2HG GLU 42 2HG GLU 42 18.355 21.428 14.947 341 HE2 GLU 42 HE2 GLU 42 18.821 24.970 16.433 342 H LYS 43 H LYS 43 20.618 18.434 18.018 343 HA LYS 43 HA LYS 43 21.304 18.830 20.795 344 1HB LYS 43 1HB LYS 43 19.248 17.710 21.639 345 2HB LYS 43 2HB LYS 43 18.943 19.292 20.935 346 1HG LYS 43 1HG LYS 43 18.696 17.039 19.070 347 2HG LYS 43 2HG LYS 43 17.517 17.063 20.383 348 1HD LYS 43 1HD LYS 43 16.959 19.399 19.786 349 2HD LYS 43 2HD LYS 43 18.074 19.289 18.422 350 1HE LYS 43 1HE LYS 43 16.721 17.817 17.265 351 2HE LYS 43 2HE LYS 43 15.904 17.260 18.724 352 1HZ LYS 43 1HZ LYS 43 14.287 18.586 17.906 353 2HZ LYS 43 2HZ LYS 43 15.356 19.589 17.061 354 3HZ LYS 43 3HZ LYS 43 15.150 19.787 18.728 355 H THR 44 H THR 44 23.047 17.521 19.854 356 HA THR 44 HA THR 44 22.421 14.674 20.117 357 HB THR 44 HB THR 44 24.285 15.570 17.942 358 HG1 THR 44 HG1 THR 44 22.498 15.412 16.512 359 1HG2 THR 44 1HG2 THR 44 22.497 13.204 17.787 360 2HG2 THR 44 2HG2 THR 44 23.941 13.124 18.796 361 3HG2 THR 44 3HG2 THR 44 24.087 13.471 17.073 362 H ASP 45 H ASP 45 23.587 14.100 21.832 363 HA ASP 45 HA ASP 45 26.435 14.239 21.768 364 1HB ASP 45 1HB ASP 45 24.911 16.204 23.398 365 2HB ASP 45 2HB ASP 45 26.314 15.455 24.154 366 HD2 ASP 45 HD2 ASP 45 28.364 16.896 21.559 367 H ARG 46 H ARG 46 24.085 14.248 24.445 368 HA ARG 46 HA ARG 46 25.010 11.535 25.130 369 1HB ARG 46 1HB ARG 46 25.069 13.852 26.689 370 2HB ARG 46 2HB ARG 46 23.699 12.940 27.308 371 1HG ARG 46 1HG ARG 46 25.123 11.740 28.503 372 2HG ARG 46 2HG ARG 46 25.747 11.068 26.995 373 1HD ARG 46 1HD ARG 46 26.738 13.720 27.939 374 2HD ARG 46 2HD ARG 46 27.350 12.250 28.698 375 HE ARG 46 HE ARG 46 27.946 13.219 26.059 376 1HH1 ARG 46 1HH1 ARG 46 27.802 10.394 28.103 377 2HH1 ARG 46 2HH1 ARG 46 28.949 9.500 27.162 378 1HH2 ARG 46 1HH2 ARG 46 29.455 12.046 24.820 379 2HH2 ARG 46 2HH2 ARG 46 29.888 10.438 25.298 380 H TYR 47 H TYR 47 22.214 13.716 25.153 381 HA TYR 47 HA TYR 47 20.329 11.713 25.866 382 1HB TYR 47 1HB TYR 47 20.248 14.537 25.012 383 2HB TYR 47 2HB TYR 47 18.817 13.595 24.609 384 HD1 TYR 47 HD1 TYR 47 17.185 13.167 26.232 385 HD2 TYR 47 HD2 TYR 47 21.023 14.539 27.449 386 HE1 TYR 47 HE1 TYR 47 16.350 13.447 28.529 387 HE2 TYR 47 HE2 TYR 47 20.200 14.822 29.749 388 HH TYR 47 HH TYR 47 17.222 15.101 30.615 389 H ASN 48 H ASN 48 19.994 9.986 24.624 390 HA ASN 48 HA ASN 48 19.865 10.351 21.707 391 1HB ASN 48 1HB ASN 48 20.410 7.867 23.346 392 2HB ASN 48 2HB ASN 48 20.241 7.885 21.593 393 1HD2 ASN 48 1HD2 ASN 48 22.308 8.411 24.245 394 2HD2 ASN 48 2HD2 ASN 48 23.703 8.911 23.357 395 H GLU 49 H GLU 49 17.880 10.454 20.912 396 HA GLU 49 HA GLU 49 15.702 9.093 22.337 397 1HB GLU 49 1HB GLU 49 15.789 11.662 21.598 398 2HB GLU 49 2HB GLU 49 15.138 10.984 20.112 399 1HG GLU 49 1HG GLU 49 13.281 10.019 21.334 400 2HG GLU 49 2HG GLU 49 13.946 10.624 22.851 401 HE2 GLU 49 HE2 GLU 49 11.472 12.941 21.284 402 H ARG 50 H ARG 50 13.955 8.178 20.952 403 HA ARG 50 HA ARG 50 15.161 6.677 18.741 404 1HB ARG 50 1HB ARG 50 13.958 5.608 20.799 405 2HB ARG 50 2HB ARG 50 12.487 6.041 19.939 406 1HG ARG 50 1HG ARG 50 12.995 4.621 18.138 407 2HG ARG 50 2HG ARG 50 14.671 4.432 18.657 408 1HD ARG 50 1HD ARG 50 12.235 3.412 20.114 409 2HD ARG 50 2HD ARG 50 13.353 2.438 19.160 410 HE ARG 50 HE ARG 50 14.944 3.641 21.007 411 1HH1 ARG 50 1HH1 ARG 50 12.061 1.684 21.192 412 2HH1 ARG 50 2HH1 ARG 50 12.470 1.004 22.730 413 1HH2 ARG 50 1HH2 ARG 50 15.485 2.746 23.031 414 2HH2 ARG 50 2HH2 ARG 50 14.414 1.607 23.776 415 HA PRO 51 HA PRO 51 12.992 8.860 15.577 416 1HB PRO 51 1HB PRO 51 12.397 6.153 14.477 417 2HB PRO 51 2HB PRO 51 13.122 7.556 13.684 418 1HG PRO 51 1HG PRO 51 14.628 5.491 14.423 419 2HG PRO 51 2HG PRO 51 15.218 7.155 14.596 420 1HD PRO 51 1HD PRO 51 14.193 5.280 16.679 421 2HD PRO 51 2HD PRO 51 15.487 6.491 16.786 422 H TRP 52 H TRP 52 10.857 9.076 14.606 423 HA TRP 52 HA TRP 52 8.706 7.542 15.836 424 1HB TRP 52 1HB TRP 52 8.965 10.544 16.100 425 2HB TRP 52 2HB TRP 52 7.496 9.643 16.462 426 HD1 TRP 52 HD1 TRP 52 10.793 10.658 17.948 427 HE1 TRP 52 HE1 TRP 52 10.984 9.732 20.342 428 HE3 TRP 52 HE3 TRP 52 6.771 7.501 17.924 429 HZ2 TRP 52 HZ2 TRP 52 9.612 7.906 22.001 430 HZ3 TRP 52 HZ3 TRP 52 6.279 6.202 19.954 431 HH2 TRP 52 HH2 TRP 52 7.673 6.400 21.949 432 H GLY 53 H GLY 53 7.338 6.979 14.286 433 1HA GLY 53 1HA GLY 53 5.720 8.076 12.655 434 2HA GLY 53 2HA GLY 53 7.176 8.683 11.883 435 H GLY 54 H GLY 54 5.330 7.190 10.473 436 1HA GLY 54 1HA GLY 54 6.301 5.585 8.791 437 2HA GLY 54 2HA GLY 54 6.690 4.583 10.181 438 H GLY 55 H GLY 55 5.449 2.899 9.168 439 1HA GLY 55 1HA GLY 55 2.543 3.291 9.534 440 2HA GLY 55 2HA GLY 55 3.201 2.362 8.197 441 H PHE 56 H PHE 56 1.382 1.676 10.498 442 HA PHE 56 HA PHE 56 2.646 -0.859 11.117 443 1HB PHE 56 1HB PHE 56 1.871 1.124 13.259 444 2HB PHE 56 2HB PHE 56 2.114 -0.590 13.576 445 HD1 PHE 56 HD1 PHE 56 3.654 2.582 13.410 446 HD2 PHE 56 HD2 PHE 56 4.403 -1.571 12.855 447 HE1 PHE 56 HE1 PHE 56 6.064 2.982 13.697 448 HE2 PHE 56 HE2 PHE 56 6.815 -1.178 13.141 449 HZ PHE 56 HZ PHE 56 7.648 1.102 13.562 450 H GLY 57 H GLY 57 1.189 -2.469 11.156 451 1HA GLY 57 1HA GLY 57 -1.464 -2.221 12.108 452 2HA GLY 57 2HA GLY 57 -1.453 -2.082 10.357 453 H LEU 58 H LEU 58 -2.861 -4.054 10.761 454 HA LEU 58 HA LEU 58 -1.147 -6.440 10.629 455 1HB LEU 58 1HB LEU 58 -3.701 -6.069 12.174 456 2HB LEU 58 2HB LEU 58 -3.124 -7.659 11.711 457 HG LEU 58 HG LEU 58 -0.928 -6.935 12.914 458 1HD1 LEU 58 1HD1 LEU 58 -0.948 -5.158 14.299 459 2HD1 LEU 58 2HD1 LEU 58 -2.653 -5.356 14.706 460 3HD1 LEU 58 3HD1 LEU 58 -2.193 -4.577 13.193 461 1HD2 LEU 58 1HD2 LEU 58 -3.479 -7.644 14.355 462 2HD2 LEU 58 2HD2 LEU 58 -1.869 -7.740 15.070 463 3HD2 LEU 58 3HD2 LEU 58 -2.283 -8.756 13.689 464 H SER 59 H SER 59 -2.642 -8.367 9.823 465 HA SER 59 HA SER 59 -4.348 -7.390 7.638 466 1HB SER 59 1HB SER 59 -3.284 -9.431 6.347 467 2HB SER 59 2HB SER 59 -2.468 -7.868 6.377 468 HG SER 59 HG SER 59 -1.943 -9.960 8.219 469 H ARG 60 H ARG 60 -5.816 -9.018 6.777 470 HA ARG 60 HA ARG 60 -6.395 -11.174 8.700 471 1HB ARG 60 1HB ARG 60 -7.948 -8.974 8.455 472 2HB ARG 60 2HB ARG 60 -8.675 -9.997 7.224 473 1HG ARG 60 1HG ARG 60 -9.920 -10.707 8.954 474 2HG ARG 60 2HG ARG 60 -8.532 -11.756 9.246 475 1HD ARG 60 1HD ARG 60 -9.149 -10.717 11.316 476 2HD ARG 60 2HD ARG 60 -7.619 -10.027 10.778 477 HE ARG 60 HE ARG 60 -8.642 -7.993 10.642 478 1HH1 ARG 60 1HH1 ARG 60 -11.104 -10.465 10.650 479 2HH1 ARG 60 2HH1 ARG 60 -12.414 -9.337 10.738 480 1HH2 ARG 60 1HH2 ARG 60 -10.364 -6.506 10.757 481 2HH2 ARG 60 2HH2 ARG 60 -11.994 -7.089 10.798 482 H TRP 61 H TRP 61 -7.234 -13.093 7.860 483 HA TRP 61 HA TRP 61 -6.850 -13.406 4.962 484 1HB TRP 61 1HB TRP 61 -6.680 -15.879 5.567 485 2HB TRP 61 2HB TRP 61 -5.358 -14.846 6.099 486 HD1 TRP 61 HD1 TRP 61 -4.996 -14.559 8.699 487 HE1 TRP 61 HE1 TRP 61 -5.980 -15.759 10.752 488 HE3 TRP 61 HE3 TRP 61 -8.884 -16.989 6.435 489 HZ2 TRP 61 HZ2 TRP 61 -8.120 -17.505 11.335 490 HZ3 TRP 61 HZ3 TRP 61 -10.352 -18.404 7.812 491 HH2 TRP 61 HH2 TRP 61 -9.976 -18.656 10.211 492 H ASP 62 H ASP 62 -8.504 -13.981 3.692 493 HA ASP 62 HA ASP 62 -11.040 -14.714 5.001 494 1HB ASP 62 1HB ASP 62 -10.468 -12.626 3.193 495 2HB ASP 62 2HB ASP 62 -11.399 -13.814 2.286 496 HD2 ASP 62 HD2 ASP 62 -13.404 -11.469 4.488 497 H GLU 63 H GLU 63 -11.537 -16.780 4.770 498 HA GLU 63 HA GLU 63 -10.270 -18.596 3.092 499 1HB GLU 63 1HB GLU 63 -12.934 -18.668 4.490 500 2HB GLU 63 2HB GLU 63 -12.358 -20.024 3.530 501 1HG GLU 63 1HG GLU 63 -10.213 -19.483 5.145 502 2HG GLU 63 2HG GLU 63 -11.587 -19.154 6.198 503 HE2 GLU 63 HE2 GLU 63 -12.640 -22.573 5.752 504 H LYS 64 H LYS 64 -12.819 -16.375 2.397 505 HA LYS 64 HA LYS 64 -13.911 -17.730 0.146 506 1HB LYS 64 1HB LYS 64 -14.114 -14.998 1.311 507 2HB LYS 64 2HB LYS 64 -14.577 -15.196 -0.375 508 1HG LYS 64 1HG LYS 64 -16.061 -17.106 0.442 509 2HG LYS 64 2HG LYS 64 -15.790 -16.456 2.059 510 1HD LYS 64 1HD LYS 64 -16.672 -14.290 1.332 511 2HD LYS 64 2HD LYS 64 -16.946 -14.945 -0.284 512 1HE LYS 64 1HE LYS 64 -19.028 -15.267 0.563 513 2HE LYS 64 2HE LYS 64 -18.286 -16.766 1.120 514 1HZ LYS 64 1HZ LYS 64 -19.217 -16.018 3.044 515 2HZ LYS 64 2HZ LYS 64 -19.033 -14.383 2.650 516 3HZ LYS 64 3HZ LYS 64 -17.700 -15.281 3.176 517 H GLY 65 H GLY 65 -11.097 -15.789 0.645 518 1HA GLY 65 1HA GLY 65 -9.366 -16.091 -1.097 519 2HA GLY 65 2HA GLY 65 -10.632 -15.778 -2.275 520 H ASN 66 H ASN 66 -10.154 -14.038 0.752 521 HA ASN 66 HA ASN 66 -9.249 -11.697 -0.776 522 1HB ASN 66 1HB ASN 66 -11.796 -11.870 0.110 523 2HB ASN 66 2HB ASN 66 -11.028 -11.168 1.531 524 1HD2 ASN 66 1HD2 ASN 66 -12.367 -9.323 1.089 525 2HD2 ASN 66 2HD2 ASN 66 -11.865 -8.159 -0.084 526 H TRP 67 H TRP 67 -8.125 -10.090 0.492 527 HA TRP 67 HA TRP 67 -7.099 -11.061 3.066 528 1HB TRP 67 1HB TRP 67 -5.501 -11.587 1.187 529 2HB TRP 67 2HB TRP 67 -5.334 -9.853 0.931 530 HD1 TRP 67 HD1 TRP 67 -3.842 -8.499 2.640 531 HE1 TRP 67 HE1 TRP 67 -2.208 -9.217 4.495 532 HE3 TRP 67 HE3 TRP 67 -5.139 -13.431 3.000 533 HZ2 TRP 67 HZ2 TRP 67 -1.556 -11.564 5.922 534 HZ3 TRP 67 HZ3 TRP 67 -3.961 -14.844 4.635 535 HH2 TRP 67 HH2 TRP 67 -2.208 -13.928 6.065 536 H HIS 68 H HIS 68 -8.154 -9.560 4.290 537 HA HIS 68 HA HIS 68 -8.399 -6.822 3.600 538 1HB HIS 68 1HB HIS 68 -9.014 -8.512 5.946 539 2HB HIS 68 2HB HIS 68 -8.734 -6.810 6.294 540 HD1 HIS 68 HD1 HIS 68 -10.388 -5.095 5.158 541 HD2 HIS 68 HD2 HIS 68 -11.433 -9.097 4.759 542 HE1 HIS 68 HE1 HIS 68 -12.793 -5.092 4.423 543 HE2 HIS 68 HE2 HIS 68 -13.381 -7.522 4.114 544 H GLY 69 H GLY 69 -6.986 -5.211 3.772 545 1HA GLY 69 1HA GLY 69 -4.562 -5.677 5.396 546 2HA GLY 69 2HA GLY 69 -4.601 -4.706 3.931 547 H LEU 70 H LEU 70 -4.709 -4.650 7.281 548 HA LEU 70 HA LEU 70 -5.854 -1.938 7.307 549 1HB LEU 70 1HB LEU 70 -6.616 -4.040 8.819 550 2HB LEU 70 2HB LEU 70 -5.385 -3.352 9.861 551 HG LEU 70 HG LEU 70 -7.455 -1.517 8.762 552 1HD1 LEU 70 1HD1 LEU 70 -8.750 -3.459 9.493 553 2HD1 LEU 70 2HD1 LEU 70 -9.001 -2.074 10.555 554 3HD1 LEU 70 3HD1 LEU 70 -7.953 -3.397 11.065 555 1HD2 LEU 70 1HD2 LEU 70 -6.082 -0.288 10.074 556 2HD2 LEU 70 2HD2 LEU 70 -5.596 -1.673 11.052 557 3HD2 LEU 70 3HD2 LEU 70 -7.149 -0.888 11.345 558 H TYR 71 H TYR 71 -4.375 -0.387 7.317 559 HA TYR 71 HA TYR 71 -1.954 -0.766 8.945 560 1HB TYR 71 1HB TYR 71 -1.971 0.689 6.301 561 2HB TYR 71 2HB TYR 71 -0.574 0.238 7.273 562 HD1 TYR 71 HD1 TYR 71 -0.285 -2.345 7.675 563 HD2 TYR 71 HD2 TYR 71 -2.568 -0.649 4.510 564 HE1 TYR 71 HE1 TYR 71 -0.079 -4.444 6.410 565 HE2 TYR 71 HE2 TYR 71 -2.368 -2.743 3.237 566 HH TYR 71 HH TYR 71 -0.259 -4.905 3.570 567 H ALA 72 H ALA 72 -1.222 1.009 10.058 568 HA ALA 72 HA ALA 72 -2.788 3.487 9.797 569 1HB ALA 72 1HB ALA 72 -1.860 2.767 12.507 570 2HB ALA 72 2HB ALA 72 -3.193 1.815 11.853 571 3HB ALA 72 3HB ALA 72 -3.344 3.567 11.988 572 H MET 73 H MET 73 -1.400 4.964 9.072 573 HA MET 73 HA MET 73 1.393 4.877 9.913 574 1HB MET 73 1HB MET 73 -0.101 6.167 7.679 575 2HB MET 73 2HB MET 73 1.402 6.910 8.209 576 1HG MET 73 1HG MET 73 1.974 5.488 6.434 577 2HG MET 73 2HG MET 73 2.484 4.655 7.901 578 1HE MET 73 1HE MET 73 -0.392 5.358 5.700 579 2HE MET 73 2HE MET 73 -1.456 3.956 5.820 580 3HE MET 73 3HE MET 73 -0.139 3.967 4.646 581 H ALA 74 H ALA 74 2.378 7.203 10.127 582 HA ALA 74 HA ALA 74 0.836 9.290 11.207 583 1HB ALA 74 1HB ALA 74 0.803 8.980 13.447 584 2HB ALA 74 2HB ALA 74 2.342 8.119 13.461 585 3HB ALA 74 3HB ALA 74 0.866 7.279 12.987 586 H PHE 75 H PHE 75 2.043 11.121 11.379 587 HA PHE 75 HA PHE 75 4.970 10.814 11.247 588 1HB PHE 75 1HB PHE 75 4.895 12.959 9.849 589 2HB PHE 75 2HB PHE 75 4.380 11.470 9.063 590 HD1 PHE 75 HD1 PHE 75 1.850 10.988 9.041 591 HD2 PHE 75 HD2 PHE 75 3.523 14.821 9.827 592 HE1 PHE 75 HE1 PHE 75 -0.293 12.041 8.449 593 HE2 PHE 75 HE2 PHE 75 1.383 15.881 9.237 594 HZ PHE 75 HZ PHE 75 -0.530 14.491 8.548 595 H LYS 76 H LYS 76 6.193 12.184 12.462 596 HA LYS 76 HA LYS 76 4.742 13.796 14.423 597 1HB LYS 76 1HB LYS 76 6.636 12.018 14.895 598 2HB LYS 76 2HB LYS 76 7.698 13.372 14.537 599 1HG LYS 76 1HG LYS 76 6.596 14.684 16.295 600 2HG LYS 76 2HG LYS 76 5.574 13.294 16.671 601 1HD LYS 76 1HD LYS 76 7.180 12.833 18.181 602 2HD LYS 76 2HD LYS 76 8.030 12.162 16.788 603 1HE LYS 76 1HE LYS 76 8.363 15.057 17.201 604 2HE LYS 76 2HE LYS 76 9.062 14.031 18.454 605 1HZ LYS 76 1HZ LYS 76 9.840 14.354 15.670 606 2HZ LYS 76 2HZ LYS 76 9.927 12.782 16.285 607 3HZ LYS 76 3HZ LYS 76 10.791 14.028 17.031 608 H ASP 77 H ASP 77 4.637 15.931 14.260 609 HA ASP 77 HA ASP 77 5.746 17.380 12.141 610 1HB ASP 77 1HB ASP 77 3.888 17.878 14.129 611 2HB ASP 77 2HB ASP 77 5.188 19.005 14.506 612 HD2 ASP 77 HD2 ASP 77 4.709 20.636 11.386 613 H SER 78 H SER 78 7.432 18.879 12.030 614 HA SER 78 HA SER 78 9.797 18.163 13.386 615 1HB SER 78 1HB SER 78 9.025 20.383 11.530 616 2HB SER 78 2HB SER 78 10.578 20.452 12.362 617 HG SER 78 HG SER 78 11.259 19.142 10.879 618 H TRP 79 H TRP 79 7.242 20.294 14.230 619 HA TRP 79 HA TRP 79 8.623 20.999 16.682 620 1HB TRP 79 1HB TRP 79 8.948 22.788 14.745 621 2HB TRP 79 2HB TRP 79 7.340 23.288 15.258 622 HD1 TRP 79 HD1 TRP 79 7.640 22.971 18.384 623 HE1 TRP 79 HE1 TRP 79 9.166 24.573 19.697 624 HE3 TRP 79 HE3 TRP 79 10.642 24.549 14.559 625 HZ2 TRP 79 HZ2 TRP 79 11.355 26.281 19.180 626 HZ3 TRP 79 HZ3 TRP 79 12.428 26.167 15.052 627 HH2 TRP 79 HH2 TRP 79 12.775 27.015 17.315 628 H ASN 80 H ASN 80 6.397 19.325 16.050 629 HA ASN 80 HA ASN 80 4.476 20.434 17.891 630 1HB ASN 80 1HB ASN 80 4.005 21.040 15.282 631 2HB ASN 80 2HB ASN 80 3.146 19.509 15.421 632 1HD2 ASN 80 1HD2 ASN 80 2.254 22.345 15.118 633 2HD2 ASN 80 2HD2 ASN 80 1.109 22.582 16.390 634 H LYS 81 H LYS 81 2.367 18.677 17.368 635 HA LYS 81 HA LYS 81 3.483 16.233 18.425 636 1HB LYS 81 1HB LYS 81 1.183 15.555 18.781 637 2HB LYS 81 2HB LYS 81 1.406 17.205 19.345 638 1HG LYS 81 1HG LYS 81 0.550 17.818 16.949 639 2HG LYS 81 2HG LYS 81 -0.130 16.190 17.006 640 1HD LYS 81 1HD LYS 81 -1.876 17.255 17.968 641 2HD LYS 81 2HD LYS 81 -0.889 17.101 19.423 642 1HE LYS 81 1HE LYS 81 0.087 19.354 18.861 643 2HE LYS 81 2HE LYS 81 -1.150 19.494 17.613 644 1HZ LYS 81 1HZ LYS 81 -1.597 20.495 19.919 645 2HZ LYS 81 2HZ LYS 81 -1.902 18.903 20.402 646 3HZ LYS 81 3HZ LYS 81 -2.830 19.606 19.176 647 H TRP 82 H TRP 82 2.073 14.192 17.540 648 HA TRP 82 HA TRP 82 2.791 14.037 14.699 649 1HB TRP 82 1HB TRP 82 2.719 11.572 15.048 650 2HB TRP 82 2HB TRP 82 3.897 12.384 16.074 651 HD1 TRP 82 HD1 TRP 82 3.252 12.611 18.715 652 HE1 TRP 82 HE1 TRP 82 1.767 11.123 20.199 653 HE3 TRP 82 HE3 TRP 82 0.677 10.130 15.061 654 HZ2 TRP 82 HZ2 TRP 82 -0.233 9.158 19.866 655 HZ3 TRP 82 HZ3 TRP 82 -1.003 8.462 15.728 656 HH2 TRP 82 HH2 TRP 82 -1.448 7.987 18.081 657 H GLU 83 H GLU 83 1.326 13.543 13.147 658 HA GLU 83 HA GLU 83 -1.479 13.562 13.951 659 1HB GLU 83 1HB GLU 83 -0.232 13.824 11.210 660 2HB GLU 83 2HB GLU 83 -1.943 14.000 11.575 661 1HG GLU 83 1HG GLU 83 -0.238 15.726 13.186 662 2HG GLU 83 2HG GLU 83 -0.105 16.025 11.454 663 HE2 GLU 83 HE2 GLU 83 -3.625 16.711 13.173 664 HA PRO 84 HA PRO 84 -1.598 9.167 13.105 665 1HB PRO 84 1HB PRO 84 -4.079 8.693 13.975 666 2HB PRO 84 2HB PRO 84 -2.777 9.096 15.101 667 1HG PRO 84 1HG PRO 84 -4.955 10.837 14.020 668 2HG PRO 84 2HG PRO 84 -4.302 10.751 15.666 669 1HD PRO 84 1HD PRO 84 -3.595 12.654 13.792 670 2HD PRO 84 2HD PRO 84 -2.596 12.188 15.182 671 H ILE 85 H ILE 85 -2.638 7.734 11.654 672 HA ILE 85 HA ILE 85 -4.766 8.689 9.950 673 HB ILE 85 HB ILE 85 -3.409 8.187 7.854 674 1HG1 ILE 85 1HG1 ILE 85 -1.124 8.633 9.790 675 2HG1 ILE 85 2HG1 ILE 85 -1.499 7.116 8.978 676 1HG2 ILE 85 1HG2 ILE 85 -2.316 10.609 9.204 677 2HG2 ILE 85 2HG2 ILE 85 -4.055 10.480 8.942 678 3HG2 ILE 85 3HG2 ILE 85 -2.949 10.418 7.569 679 1HD1 ILE 85 1HD1 ILE 85 -0.780 7.894 6.924 680 2HD1 ILE 85 2HD1 ILE 85 0.372 8.618 8.046 681 3HD1 ILE 85 3HD1 ILE 85 -0.949 9.585 7.391 682 H ALA 86 H ALA 86 -6.062 7.017 9.596 683 HA ALA 86 HA ALA 86 -4.918 4.306 9.707 684 1HB ALA 86 1HB ALA 86 -6.458 4.464 11.452 685 2HB ALA 86 2HB ALA 86 -7.359 3.662 10.166 686 3HB ALA 86 3HB ALA 86 -7.609 5.379 10.478 687 H GLY 87 H GLY 87 -5.733 2.700 8.261 688 1HA GLY 87 1HA GLY 87 -7.426 3.474 6.060 689 2HA GLY 87 2HA GLY 87 -5.738 3.287 5.610 690 H TYR 88 H TYR 88 -8.391 1.756 5.147 691 HA TYR 88 HA TYR 88 -7.163 -0.883 5.417 692 1HB TYR 88 1HB TYR 88 -9.216 -1.876 6.288 693 2HB TYR 88 2HB TYR 88 -8.634 -0.621 7.377 694 HD1 TYR 88 HD1 TYR 88 -11.300 -1.639 5.112 695 HD2 TYR 88 HD2 TYR 88 -9.835 1.514 7.563 696 HE1 TYR 88 HE1 TYR 88 -13.502 -0.547 5.012 697 HE2 TYR 88 HE2 TYR 88 -12.032 2.614 7.472 698 HH TYR 88 HH TYR 88 -14.494 1.626 5.299 699 H GLY 89 H GLY 89 -7.815 -2.386 3.866 700 1HA GLY 89 1HA GLY 89 -9.917 -1.765 1.993 701 2HA GLY 89 2HA GLY 89 -8.307 -1.568 1.321 702 H TRP 90 H TRP 90 -9.157 -3.262 -0.162 703 HA TRP 90 HA TRP 90 -8.805 -5.944 1.010 704 1HB TRP 90 1HB TRP 90 -10.231 -6.796 -0.816 705 2HB TRP 90 2HB TRP 90 -11.080 -5.628 0.191 706 HD1 TRP 90 HD1 TRP 90 -11.575 -3.200 -0.903 707 HE1 TRP 90 HE1 TRP 90 -11.794 -2.474 -3.362 708 HE3 TRP 90 HE3 TRP 90 -9.362 -7.230 -3.142 709 HZ2 TRP 90 HZ2 TRP 90 -11.119 -3.477 -5.914 710 HZ3 TRP 90 HZ3 TRP 90 -9.189 -7.268 -5.595 711 HH2 TRP 90 HH2 TRP 90 -10.050 -5.430 -6.952 712 H GLU 91 H GLU 91 -7.230 -7.201 0.215 713 HA GLU 91 HA GLU 91 -5.971 -6.429 -2.329 714 1HB GLU 91 1HB GLU 91 -4.774 -5.909 0.025 715 2HB GLU 91 2HB GLU 91 -4.218 -7.559 -0.222 716 1HG GLU 91 1HG GLU 91 -3.277 -6.941 -2.374 717 2HG GLU 91 2HG GLU 91 -3.875 -5.295 -2.176 718 HE2 GLU 91 HE2 GLU 91 -0.398 -5.492 -1.062 719 H SER 92 H SER 92 -4.994 -8.123 -3.507 720 HA SER 92 HA SER 92 -6.012 -10.783 -2.775 721 1HB SER 92 1HB SER 92 -5.037 -10.039 -5.521 722 2HB SER 92 2HB SER 92 -6.175 -11.304 -5.056 723 HG SER 92 HG SER 92 -7.481 -9.752 -5.782 724 H THR 93 H THR 93 -4.645 -12.403 -2.362 725 HA THR 93 HA THR 93 -1.790 -11.856 -2.461 726 HB THR 93 HB THR 93 -2.547 -12.791 -0.402 727 HG1 THR 93 HG1 THR 93 -1.307 -14.656 -0.313 728 1HG2 THR 93 1HG2 THR 93 -4.616 -13.800 -0.932 729 2HG2 THR 93 2HG2 THR 93 -3.563 -15.077 -0.322 730 3HG2 THR 93 3HG2 THR 93 -3.856 -14.927 -2.054 731 H TRP 94 H TRP 94 -0.285 -13.080 -3.581 732 HA TRP 94 HA TRP 94 -1.226 -15.206 -5.337 733 1HB TRP 94 1HB TRP 94 -1.114 -12.683 -6.356 734 2HB TRP 94 2HB TRP 94 0.511 -13.260 -6.715 735 HD1 TRP 94 HD1 TRP 94 -2.910 -15.093 -6.971 736 HE1 TRP 94 HE1 TRP 94 -3.101 -16.069 -9.344 737 HE3 TRP 94 HE3 TRP 94 1.473 -13.334 -8.929 738 HZ2 TRP 94 HZ2 TRP 94 -1.594 -16.090 -11.731 739 HZ3 TRP 94 HZ3 TRP 94 2.023 -13.877 -11.265 740 HH2 TRP 94 HH2 TRP 94 0.520 -15.227 -12.635 741 H ARG 95 H ARG 95 0.074 -16.809 -4.717 742 HA ARG 95 HA ARG 95 2.941 -16.233 -4.380 743 1HB ARG 95 1HB ARG 95 1.397 -17.259 -2.490 744 2HB ARG 95 2HB ARG 95 1.715 -18.754 -3.358 745 1HG ARG 95 1HG ARG 95 4.218 -17.741 -3.150 746 2HG ARG 95 2HG ARG 95 3.482 -17.138 -1.664 747 1HD ARG 95 1HD ARG 95 3.635 -20.005 -2.585 748 2HD ARG 95 2HD ARG 95 4.502 -19.277 -1.232 749 HE ARG 95 HE ARG 95 1.912 -18.849 -0.596 750 1HH1 ARG 95 1HH1 ARG 95 3.690 -21.703 -1.533 751 2HH1 ARG 95 2HH1 ARG 95 2.688 -22.779 -0.620 752 1HH2 ARG 95 1HH2 ARG 95 0.593 -20.264 0.604 753 2HH2 ARG 95 2HH2 ARG 95 0.929 -21.964 0.593 754 HA PRO 96 HA PRO 96 3.480 -18.447 -8.244 755 1HB PRO 96 1HB PRO 96 6.250 -18.696 -7.185 756 2HB PRO 96 2HB PRO 96 5.693 -18.104 -8.753 757 1HG PRO 96 1HG PRO 96 6.559 -16.408 -6.894 758 2HG PRO 96 2HG PRO 96 5.176 -16.000 -7.926 759 1HD PRO 96 1HD PRO 96 5.217 -16.896 -5.075 760 2HD PRO 96 2HD PRO 96 4.163 -15.709 -5.870 761 H LEU 97 H LEU 97 5.109 -20.499 -8.696 762 HA LEU 97 HA LEU 97 4.005 -22.594 -6.999 763 1HB LEU 97 1HB LEU 97 5.381 -22.577 -9.669 764 2HB LEU 97 2HB LEU 97 5.138 -24.070 -8.783 765 HG LEU 97 HG LEU 97 3.385 -23.834 -10.411 766 1HD1 LEU 97 1HD1 LEU 97 1.471 -24.091 -9.022 767 2HD1 LEU 97 2HD1 LEU 97 2.211 -23.154 -7.724 768 3HD1 LEU 97 3HD1 LEU 97 2.852 -24.743 -8.140 769 1HD2 LEU 97 1HD2 LEU 97 1.891 -21.957 -10.490 770 2HD2 LEU 97 2HD2 LEU 97 3.547 -21.362 -10.612 771 3HD2 LEU 97 3HD2 LEU 97 2.668 -21.221 -9.088 772 H ALA 98 H ALA 98 7.186 -21.594 -8.245 773 HA ALA 98 HA ALA 98 8.431 -22.454 -5.774 774 1HB ALA 98 1HB ALA 98 9.679 -24.191 -6.540 775 2HB ALA 98 2HB ALA 98 9.748 -23.560 -8.186 776 3HB ALA 98 3HB ALA 98 8.291 -24.374 -7.614 777 H ASP 99 H ASP 99 8.957 -20.266 -5.534 778 HA ASP 99 HA ASP 99 11.297 -19.446 -7.065 779 1HB ASP 99 1HB ASP 99 8.692 -17.964 -7.004 780 2HB ASP 99 2HB ASP 99 10.202 -17.066 -7.119 781 HD2 ASP 99 HD2 ASP 99 10.825 -18.446 -10.323 782 H GLU 100 H GLU 100 11.440 -20.374 -4.560 783 HA GLU 100 HA GLU 100 12.233 -19.908 -2.481 784 1HB GLU 100 1HB GLU 100 12.903 -17.460 -4.032 785 2HB GLU 100 2HB GLU 100 13.042 -17.373 -2.282 786 1HG GLU 100 1HG GLU 100 14.793 -18.825 -2.206 787 2HG GLU 100 2HG GLU 100 14.288 -19.684 -3.660 788 HE2 GLU 100 HE2 GLU 100 15.857 -16.254 -4.730 789 H ASN 101 H ASN 101 9.409 -19.563 -3.064 790 HA ASN 101 HA ASN 101 7.503 -18.854 -2.044 791 1HB ASN 101 1HB ASN 101 8.993 -19.563 -0.032 792 2HB ASN 101 2HB ASN 101 9.143 -17.833 0.257 793 1HD2 ASN 101 1HD2 ASN 101 6.660 -20.276 -0.404 794 2HD2 ASN 101 2HD2 ASN 101 5.493 -19.635 0.697 795 H PHE 102 H PHE 102 7.372 -17.207 -3.710 796 HA PHE 102 HA PHE 102 8.180 -14.515 -2.952 797 1HB PHE 102 1HB PHE 102 7.789 -15.876 -5.413 798 2HB PHE 102 2HB PHE 102 6.625 -14.556 -5.358 799 HD1 PHE 102 HD1 PHE 102 7.488 -12.221 -4.890 800 HD2 PHE 102 HD2 PHE 102 10.034 -15.478 -5.898 801 HE1 PHE 102 HE1 PHE 102 9.258 -10.636 -5.531 802 HE2 PHE 102 HE2 PHE 102 11.809 -13.900 -6.540 803 HZ PHE 102 HZ PHE 102 11.422 -11.474 -6.356 804 H HIS 103 H HIS 103 6.793 -12.843 -2.500 805 HA HIS 103 HA HIS 103 3.978 -13.598 -2.067 806 1HB HIS 103 1HB HIS 103 5.567 -12.967 -0.082 807 2HB HIS 103 2HB HIS 103 5.284 -11.317 -0.625 808 HD1 HIS 103 HD1 HIS 103 2.228 -12.877 -1.333 809 HD2 HIS 103 HD2 HIS 103 4.071 -11.679 2.194 810 HE1 HIS 103 HE1 HIS 103 0.377 -12.677 0.359 811 HE2 HIS 103 HE2 HIS 103 1.506 -11.866 2.461 812 H LEU 104 H LEU 104 2.530 -12.597 -3.289 813 HA LEU 104 HA LEU 104 3.215 -9.957 -4.406 814 1HB LEU 104 1HB LEU 104 2.926 -12.229 -5.873 815 2HB LEU 104 2HB LEU 104 1.288 -11.606 -5.906 816 HG LEU 104 HG LEU 104 3.545 -9.775 -6.594 817 1HD1 LEU 104 1HD1 LEU 104 3.952 -10.642 -8.633 818 2HD1 LEU 104 2HD1 LEU 104 2.305 -11.243 -8.827 819 3HD1 LEU 104 3HD1 LEU 104 3.464 -12.147 -7.854 820 1HD2 LEU 104 1HD2 LEU 104 1.081 -9.126 -6.326 821 2HD2 LEU 104 2HD2 LEU 104 0.828 -9.980 -7.848 822 3HD2 LEU 104 3HD2 LEU 104 1.919 -8.595 -7.784 823 H GLY 105 H GLY 105 1.668 -8.384 -4.345 824 1HA GLY 105 1HA GLY 105 -1.024 -9.107 -3.435 825 2HA GLY 105 2HA GLY 105 -0.097 -7.976 -2.460 826 H LEU 106 H LEU 106 -2.633 -7.746 -4.086 827 HA LEU 106 HA LEU 106 -2.044 -5.142 -5.171 828 1HB LEU 106 1HB LEU 106 -1.504 -6.725 -7.032 829 2HB LEU 106 2HB LEU 106 -3.176 -7.251 -7.006 830 HG LEU 106 HG LEU 106 -3.617 -4.648 -7.332 831 1HD1 LEU 106 1HD1 LEU 106 -1.906 -3.779 -8.942 832 2HD1 LEU 106 2HD1 LEU 106 -0.858 -5.107 -8.443 833 3HD1 LEU 106 3HD1 LEU 106 -1.363 -3.893 -7.268 834 1HD2 LEU 106 1HD2 LEU 106 -4.566 -6.030 -8.905 835 2HD2 LEU 106 2HD2 LEU 106 -3.035 -6.815 -9.297 836 3HD2 LEU 106 3HD2 LEU 106 -3.365 -5.183 -9.881 837 H GLY 107 H GLY 107 -3.683 -3.847 -4.662 838 1HA GLY 107 1HA GLY 107 -6.409 -4.499 -5.047 839 2HA GLY 107 2HA GLY 107 -5.991 -4.704 -3.353 840 H PHE 108 H PHE 108 -7.606 -3.004 -3.034 841 HA PHE 108 HA PHE 108 -6.480 -0.326 -3.530 842 1HB PHE 108 1HB PHE 108 -9.353 -1.240 -3.411 843 2HB PHE 108 2HB PHE 108 -8.893 0.455 -3.292 844 HD1 PHE 108 HD1 PHE 108 -9.118 1.653 -5.223 845 HD2 PHE 108 HD2 PHE 108 -8.045 -2.456 -5.473 846 HE1 PHE 108 HE1 PHE 108 -9.083 1.816 -7.679 847 HE2 PHE 108 HE2 PHE 108 -8.007 -2.302 -7.929 848 HZ PHE 108 HZ PHE 108 -8.527 -0.163 -9.034 849 H THR 109 H THR 109 -6.995 1.304 -1.886 850 HA THR 109 HA THR 109 -7.553 0.198 0.772 851 HB THR 109 HB THR 109 -5.221 2.022 0.155 852 HG1 THR 109 HG1 THR 109 -5.046 -0.269 -0.456 853 1HG2 THR 109 1HG2 THR 109 -4.548 1.762 2.420 854 2HG2 THR 109 2HG2 THR 109 -5.860 0.626 2.737 855 3HG2 THR 109 3HG2 THR 109 -6.221 2.321 2.413 856 H ALA 110 H ALA 110 -8.817 1.463 2.007 857 HA ALA 110 HA ALA 110 -9.088 4.302 1.362 858 1HB ALA 110 1HB ALA 110 -11.430 2.404 1.487 859 2HB ALA 110 2HB ALA 110 -10.824 3.224 0.048 860 3HB ALA 110 3HB ALA 110 -11.540 4.159 1.362 861 H GLY 111 H GLY 111 -9.523 5.584 3.102 862 1HA GLY 111 1HA GLY 111 -10.639 4.593 5.537 863 2HA GLY 111 2HA GLY 111 -8.895 4.769 5.658 864 H VAL 112 H VAL 112 -8.783 6.456 7.059 865 HA VAL 112 HA VAL 112 -9.840 9.020 6.075 866 HB VAL 112 HB VAL 112 -10.165 9.671 8.502 867 1HG1 VAL 112 1HG1 VAL 112 -11.979 9.035 6.864 868 2HG1 VAL 112 2HG1 VAL 112 -12.385 8.853 8.571 869 3HG1 VAL 112 3HG1 VAL 112 -11.969 7.436 7.607 870 1HG2 VAL 112 1HG2 VAL 112 -8.963 8.020 9.678 871 2HG2 VAL 112 2HG2 VAL 112 -9.778 6.708 8.827 872 3HG2 VAL 112 3HG2 VAL 112 -10.664 7.682 10.001 873 H THR 113 H THR 113 -8.457 10.705 6.169 874 HA THR 113 HA THR 113 -5.971 10.391 7.703 875 HB THR 113 HB THR 113 -5.421 9.792 5.419 876 HG1 THR 113 HG1 THR 113 -3.814 11.308 5.079 877 1HG2 THR 113 1HG2 THR 113 -5.911 12.417 4.242 878 2HG2 THR 113 2HG2 THR 113 -7.370 11.494 4.599 879 3HG2 THR 113 3HG2 THR 113 -6.121 10.805 3.561 880 H ALA 114 H ALA 114 -4.998 12.324 8.391 881 HA ALA 114 HA ALA 114 -6.842 14.600 8.460 882 1HB ALA 114 1HB ALA 114 -6.316 14.187 10.643 883 2HB ALA 114 2HB ALA 114 -5.037 15.334 10.243 884 3HB ALA 114 3HB ALA 114 -4.697 13.604 10.259 885 H ARG 115 H ARG 115 -6.496 16.247 7.138 886 HA ARG 115 HA ARG 115 -3.816 17.244 6.692 887 1HB ARG 115 1HB ARG 115 -5.359 15.790 4.626 888 2HB ARG 115 2HB ARG 115 -4.603 17.290 4.107 889 1HG ARG 115 1HG ARG 115 -2.891 15.453 5.648 890 2HG ARG 115 2HG ARG 115 -3.383 14.903 4.044 891 1HD ARG 115 1HD ARG 115 -2.621 17.173 3.198 892 2HD ARG 115 2HD ARG 115 -1.870 17.398 4.778 893 HE ARG 115 HE ARG 115 -1.056 14.935 3.667 894 1HH1 ARG 115 1HH1 ARG 115 -0.589 18.373 3.283 895 2HH1 ARG 115 2HH1 ARG 115 1.003 18.210 2.623 896 1HH2 ARG 115 1HH2 ARG 115 1.039 14.718 2.799 897 2HH2 ARG 115 2HH2 ARG 115 1.928 16.135 2.348 898 H ASP 116 H ASP 116 -4.439 19.151 7.651 899 HA ASP 116 HA ASP 116 -5.776 21.037 5.984 900 1HB ASP 116 1HB ASP 116 -7.264 19.768 8.223 901 2HB ASP 116 2HB ASP 116 -7.438 21.511 8.033 902 HD2 ASP 116 HD2 ASP 116 -9.683 19.407 5.837 903 H ASN 117 H ASN 117 -6.272 23.105 7.497 904 HA ASN 117 HA ASN 117 -3.828 23.493 9.097 905 1HB ASN 117 1HB ASN 117 -5.328 25.348 7.264 906 2HB ASN 117 2HB ASN 117 -4.261 25.978 8.515 907 1HD2 ASN 117 1HD2 ASN 117 -4.360 23.759 5.770 908 2HD2 ASN 117 2HD2 ASN 117 -2.714 23.990 5.298 909 H TRP 118 H TRP 118 -4.412 23.278 11.173 910 HA TRP 118 HA TRP 118 -5.425 23.666 13.171 911 1HB TRP 118 1HB TRP 118 -5.073 26.110 12.081 912 2HB TRP 118 2HB TRP 118 -6.826 26.105 12.239 913 HD1 TRP 118 HD1 TRP 118 -3.705 25.558 14.474 914 HE1 TRP 118 HE1 TRP 118 -4.280 26.368 16.848 915 HE3 TRP 118 HE3 TRP 118 -8.622 26.756 13.754 916 HZ2 TRP 118 HZ2 TRP 118 -6.522 27.380 18.233 917 HZ3 TRP 118 HZ3 TRP 118 -9.911 27.639 15.655 918 HH2 TRP 118 HH2 TRP 118 -8.882 27.944 17.847 919 H ASN 119 H ASN 119 -6.804 22.098 11.184 920 HA ASN 119 HA ASN 119 -9.515 22.351 12.258 921 1HB ASN 119 1HB ASN 119 -8.736 22.391 9.367 922 2HB ASN 119 2HB ASN 119 -10.255 21.634 9.837 923 1HD2 ASN 119 1HD2 ASN 119 -11.687 23.062 9.063 924 2HD2 ASN 119 2HD2 ASN 119 -11.781 24.719 9.544 925 H TYR 120 H TYR 120 -9.792 20.511 13.332 926 HA TYR 120 HA TYR 120 -8.515 18.061 12.436 927 1HB TYR 120 1HB TYR 120 -9.025 19.054 14.922 928 2HB TYR 120 2HB TYR 120 -10.370 17.935 14.727 929 HD1 TYR 120 HD1 TYR 120 -6.773 17.791 13.712 930 HD2 TYR 120 HD2 TYR 120 -9.949 15.996 15.902 931 HE1 TYR 120 HE1 TYR 120 -5.295 15.921 14.313 932 HE2 TYR 120 HE2 TYR 120 -8.480 14.121 16.509 933 HH TYR 120 HH TYR 120 -5.422 13.630 15.033 934 H ILE 121 H ILE 121 -9.723 17.801 10.474 935 HA ILE 121 HA ILE 121 -12.328 16.532 10.949 936 HB ILE 121 HB ILE 121 -12.813 18.760 10.092 937 1HG1 ILE 121 1HG1 ILE 121 -13.304 17.135 7.662 938 2HG1 ILE 121 2HG1 ILE 121 -13.877 16.453 9.180 939 1HG2 ILE 121 1HG2 ILE 121 -11.866 19.721 8.242 940 2HG2 ILE 121 2HG2 ILE 121 -11.484 18.170 7.495 941 3HG2 ILE 121 3HG2 ILE 121 -10.509 18.767 8.838 942 1HD1 ILE 121 1HD1 ILE 121 -15.498 18.002 9.420 943 2HD1 ILE 121 2HD1 ILE 121 -15.344 18.077 7.664 944 3HD1 ILE 121 3HD1 ILE 121 -14.541 19.281 8.673 945 HA PRO 122 HA PRO 122 -9.615 13.486 8.823 946 1HB PRO 122 1HB PRO 122 -12.034 11.884 9.510 947 2HB PRO 122 2HB PRO 122 -10.325 11.480 9.703 948 1HG PRO 122 1HG PRO 122 -11.793 12.189 11.806 949 2HG PRO 122 2HG PRO 122 -10.112 12.732 11.645 950 1HD PRO 122 1HD PRO 122 -12.645 14.248 11.211 951 2HD PRO 122 2HD PRO 122 -11.095 14.804 11.872 952 H LEU 123 H LEU 123 -9.607 13.468 6.674 953 HA LEU 123 HA LEU 123 -12.166 13.577 5.236 954 1HB LEU 123 1HB LEU 123 -10.072 15.201 4.938 955 2HB LEU 123 2HB LEU 123 -9.572 13.937 3.831 956 HG LEU 123 HG LEU 123 -12.340 14.947 3.516 957 1HD1 LEU 123 1HD1 LEU 123 -11.867 17.029 2.796 958 2HD1 LEU 123 2HD1 LEU 123 -10.289 16.567 2.159 959 3HD1 LEU 123 3HD1 LEU 123 -10.490 16.864 3.885 960 1HD2 LEU 123 1HD2 LEU 123 -10.297 14.600 1.367 961 2HD2 LEU 123 2HD2 LEU 123 -12.042 14.348 1.312 962 3HD2 LEU 123 3HD2 LEU 123 -11.008 13.181 2.135 963 HA PRO 124 HA PRO 124 -11.569 9.379 3.934 964 1HB PRO 124 1HB PRO 124 -13.284 9.311 1.846 965 2HB PRO 124 2HB PRO 124 -13.836 9.362 3.524 966 1HG PRO 124 1HG PRO 124 -13.614 11.588 1.535 967 2HG PRO 124 2HG PRO 124 -14.923 11.237 2.679 968 1HD PRO 124 1HD PRO 124 -13.027 13.127 3.140 969 2HD PRO 124 2HD PRO 124 -13.813 12.212 4.442 970 H VAL 125 H VAL 125 -10.101 8.391 2.684 971 HA VAL 125 HA VAL 125 -9.419 9.558 0.081 972 HB VAL 125 HB VAL 125 -7.753 10.379 1.700 973 1HG1 VAL 125 1HG1 VAL 125 -7.107 7.462 2.121 974 2HG1 VAL 125 2HG1 VAL 125 -7.863 8.536 3.299 975 3HG1 VAL 125 3HG1 VAL 125 -6.204 8.830 2.775 976 1HG2 VAL 125 1HG2 VAL 125 -7.102 9.995 -0.623 977 2HG2 VAL 125 2HG2 VAL 125 -6.658 8.334 -0.231 978 3HG2 VAL 125 3HG2 VAL 125 -5.758 9.678 0.474 979 H LEU 126 H LEU 126 -9.000 8.098 -1.498 980 HA LEU 126 HA LEU 126 -8.657 5.283 -0.740 981 1HB LEU 126 1HB LEU 126 -11.045 5.721 -1.270 982 2HB LEU 126 2HB LEU 126 -10.564 6.254 -2.870 983 HG LEU 126 HG LEU 126 -9.852 3.500 -1.921 984 1HD1 LEU 126 1HD1 LEU 126 -12.522 4.524 -2.727 985 2HD1 LEU 126 2HD1 LEU 126 -12.093 3.247 -1.588 986 3HD1 LEU 126 3HD1 LEU 126 -12.017 2.943 -3.324 987 1HD2 LEU 126 1HD2 LEU 126 -9.994 4.976 -4.497 988 2HD2 LEU 126 2HD2 LEU 126 -10.340 3.246 -4.508 989 3HD2 LEU 126 3HD2 LEU 126 -8.787 3.831 -3.911 990 H LEU 127 H LEU 127 -6.898 4.496 -1.671 991 HA LEU 127 HA LEU 127 -6.267 5.209 -4.426 992 1HB LEU 127 1HB LEU 127 -3.814 5.460 -3.673 993 2HB LEU 127 2HB LEU 127 -4.907 6.813 -3.452 994 HG LEU 127 HG LEU 127 -5.216 5.787 -1.053 995 1HD1 LEU 127 1HD1 LEU 127 -2.384 5.034 -1.240 996 2HD1 LEU 127 2HD1 LEU 127 -3.512 3.914 -2.003 997 3HD1 LEU 127 3HD1 LEU 127 -3.692 4.321 -0.297 998 1HD2 LEU 127 1HD2 LEU 127 -2.574 7.090 -1.413 999 2HD2 LEU 127 2HD2 LEU 127 -3.880 7.463 -0.287 1000 3HD2 LEU 127 3HD2 LEU 127 -4.005 7.955 -1.976 1001 HA PRO 128 HA PRO 128 -5.232 0.918 -4.601 1002 1HB PRO 128 1HB PRO 128 -3.645 0.877 -6.790 1003 2HB PRO 128 2HB PRO 128 -5.391 1.137 -6.887 1004 1HG PRO 128 1HG PRO 128 -3.169 3.142 -6.972 1005 2HG PRO 128 2HG PRO 128 -4.631 3.050 -7.972 1006 1HD PRO 128 1HD PRO 128 -4.396 4.732 -5.851 1007 2HD PRO 128 2HD PRO 128 -5.946 4.032 -6.358 1008 H LEU 129 H LEU 129 -3.504 -0.580 -4.325 1009 HA LEU 129 HA LEU 129 -0.829 0.446 -3.876 1010 1HB LEU 129 1HB LEU 129 -0.635 -0.186 -1.610 1011 2HB LEU 129 2HB LEU 129 -2.105 0.760 -1.727 1012 HG LEU 129 HG LEU 129 -2.704 -0.983 -0.314 1013 1HD1 LEU 129 1HD1 LEU 129 -3.464 -2.205 -2.947 1014 2HD1 LEU 129 2HD1 LEU 129 -4.189 -0.708 -2.360 1015 3HD1 LEU 129 3HD1 LEU 129 -4.367 -2.196 -1.432 1016 1HD2 LEU 129 1HD2 LEU 129 -1.828 -3.078 -0.267 1017 2HD2 LEU 129 2HD2 LEU 129 -0.519 -2.258 -1.119 1018 3HD2 LEU 129 3HD2 LEU 129 -1.712 -3.192 -2.023 1019 H ALA 130 H ALA 130 0.640 -1.428 -3.125 1020 HA ALA 130 HA ALA 130 -0.145 -4.097 -3.674 1021 1HB ALA 130 1HB ALA 130 0.787 -4.510 -5.780 1022 2HB ALA 130 2HB ALA 130 1.653 -2.973 -5.798 1023 3HB ALA 130 3HB ALA 130 -0.101 -3.000 -5.984 1024 H SER 131 H SER 131 1.564 -5.610 -3.371 1025 HA SER 131 HA SER 131 4.144 -4.519 -2.527 1026 1HB SER 131 1HB SER 131 2.627 -4.755 -0.517 1027 2HB SER 131 2HB SER 131 2.623 -6.493 -0.814 1028 HG SER 131 HG SER 131 4.812 -4.836 -0.132 1029 H VAL 132 H VAL 132 5.732 -5.628 -3.441 1030 HA VAL 132 HA VAL 132 5.343 -8.492 -3.981 1031 HB VAL 132 HB VAL 132 6.632 -8.183 -6.115 1032 1HG1 VAL 132 1HG1 VAL 132 4.700 -8.082 -7.263 1033 2HG1 VAL 132 2HG1 VAL 132 4.225 -6.549 -6.531 1034 3HG1 VAL 132 3HG1 VAL 132 3.966 -8.060 -5.659 1035 1HG2 VAL 132 1HG2 VAL 132 7.192 -5.705 -5.191 1036 2HG2 VAL 132 2HG2 VAL 132 5.849 -5.351 -6.278 1037 3HG2 VAL 132 3HG2 VAL 132 7.286 -6.170 -6.890 1038 H GLY 133 H GLY 133 7.041 -9.770 -3.489 1039 1HA GLY 133 1HA GLY 133 9.730 -9.202 -3.595 1040 2HA GLY 133 2HA GLY 133 9.216 -8.651 -2.008 1041 H TYR 134 H TYR 134 10.641 -10.241 -1.108 1042 HA TYR 134 HA TYR 134 9.349 -12.860 -0.915 1043 1HB TYR 134 1HB TYR 134 11.493 -14.029 -1.122 1044 2HB TYR 134 2HB TYR 134 11.130 -13.119 -2.585 1045 HD1 TYR 134 HD1 TYR 134 13.664 -13.944 -0.373 1046 HD2 TYR 134 HD2 TYR 134 12.104 -10.599 -2.488 1047 HE1 TYR 134 HE1 TYR 134 15.851 -12.829 -0.212 1048 HE2 TYR 134 HE2 TYR 134 14.285 -9.475 -2.334 1049 HH TYR 134 HH TYR 134 16.808 -10.384 -2.051 1050 H GLY 135 H GLY 135 9.611 -13.897 1.055 1051 1HA GLY 135 1HA GLY 135 9.893 -14.021 3.328 1052 2HA GLY 135 2HA GLY 135 11.456 -13.268 3.046 1053 HA PRO 136 HA PRO 136 9.182 -10.286 5.683 1054 1HB PRO 136 1HB PRO 136 11.413 -9.236 6.827 1055 2HB PRO 136 2HB PRO 136 10.635 -10.711 7.410 1056 1HG PRO 136 1HG PRO 136 13.032 -10.405 5.642 1057 2HG PRO 136 2HG PRO 136 12.779 -11.515 7.002 1058 1HD PRO 136 1HD PRO 136 12.524 -12.297 4.426 1059 2HD PRO 136 2HD PRO 136 11.540 -12.989 5.731 1060 H VAL 137 H VAL 137 11.585 -9.958 3.234 1061 HA VAL 137 HA VAL 137 11.340 -7.046 3.175 1062 HB VAL 137 HB VAL 137 13.007 -8.791 1.362 1063 1HG1 VAL 137 1HG1 VAL 137 12.907 -5.841 1.924 1064 2HG1 VAL 137 2HG1 VAL 137 12.757 -6.673 0.376 1065 3HG1 VAL 137 3HG1 VAL 137 14.317 -6.612 1.197 1066 1HG2 VAL 137 1HG2 VAL 137 14.894 -8.316 2.809 1067 2HG2 VAL 137 2HG2 VAL 137 13.624 -9.127 3.723 1068 3HG2 VAL 137 3HG2 VAL 137 13.860 -7.388 3.893 1069 H THR 138 H THR 138 9.623 -6.273 2.136 1070 HA THR 138 HA THR 138 9.011 -7.332 -0.526 1071 HB THR 138 HB THR 138 6.776 -6.580 1.334 1072 HG1 THR 138 HG1 THR 138 6.711 -8.568 2.152 1073 1HG2 THR 138 1HG2 THR 138 6.432 -6.921 -1.154 1074 2HG2 THR 138 2HG2 THR 138 5.394 -7.842 -0.066 1075 3HG2 THR 138 3HG2 THR 138 6.762 -8.627 -0.853 1076 H PHE 139 H PHE 139 8.783 -5.783 -2.006 1077 HA PHE 139 HA PHE 139 8.958 -3.019 -1.189 1078 1HB PHE 139 1HB PHE 139 8.871 -4.334 -3.909 1079 2HB PHE 139 2HB PHE 139 9.021 -2.597 -3.668 1080 HD1 PHE 139 HD1 PHE 139 11.105 -1.619 -3.271 1081 HD2 PHE 139 HD2 PHE 139 10.665 -5.840 -2.956 1082 HE1 PHE 139 HE1 PHE 139 13.547 -1.855 -3.087 1083 HE2 PHE 139 HE2 PHE 139 13.106 -6.084 -2.771 1084 HZ PHE 139 HZ PHE 139 14.550 -4.090 -2.836 1085 H GLN 140 H GLN 140 7.261 -1.772 -0.799 1086 HA GLN 140 HA GLN 140 4.655 -2.541 -1.918 1087 1HB GLN 140 1HB GLN 140 5.266 -2.094 0.665 1088 2HB GLN 140 2HB GLN 140 4.822 -0.461 0.189 1089 1HG GLN 140 1HG GLN 140 2.998 -2.680 -0.553 1090 2HG GLN 140 2HG GLN 140 3.054 -2.170 1.133 1091 1HE2 GLN 140 1HE2 GLN 140 3.088 0.357 1.286 1092 2HE2 GLN 140 2HE2 GLN 140 1.846 1.142 0.376 1093 H MET 141 H MET 141 3.967 -1.422 -3.606 1094 HA MET 141 HA MET 141 4.903 1.350 -3.942 1095 1HB MET 141 1HB MET 141 4.451 1.046 -6.347 1096 2HB MET 141 2HB MET 141 5.634 -0.107 -5.744 1097 1HG MET 141 1HG MET 141 3.805 -1.786 -5.569 1098 2HG MET 141 2HG MET 141 2.736 -0.627 -6.357 1099 1HE MET 141 1HE MET 141 3.769 -0.444 -9.916 1100 2HE MET 141 2HE MET 141 3.073 0.384 -8.522 1101 3HE MET 141 3HE MET 141 2.348 -1.112 -9.112 1102 H THR 142 H THR 142 3.457 2.928 -3.784 1103 HA THR 142 HA THR 142 0.602 2.236 -4.029 1104 HB THR 142 HB THR 142 1.800 4.421 -2.318 1105 HG1 THR 142 HG1 THR 142 0.906 1.819 -1.653 1106 1HG2 THR 142 1HG2 THR 142 -0.681 4.477 -3.172 1107 2HG2 THR 142 2HG2 THR 142 -0.271 4.896 -1.509 1108 3HG2 THR 142 3HG2 THR 142 -0.910 3.295 -1.882 1109 H TYR 143 H TYR 143 -0.756 3.661 -5.106 1110 HA TYR 143 HA TYR 143 0.592 5.806 -6.611 1111 1HB TYR 143 1HB TYR 143 -0.234 3.628 -7.836 1112 2HB TYR 143 2HB TYR 143 -1.809 4.403 -7.717 1113 HD1 TYR 143 HD1 TYR 143 1.072 4.059 -9.694 1114 HD2 TYR 143 HD2 TYR 143 -1.865 6.913 -8.541 1115 HE1 TYR 143 HE1 TYR 143 1.582 5.385 -11.701 1116 HE2 TYR 143 HE2 TYR 143 -1.362 8.247 -10.545 1117 HH TYR 143 HH TYR 143 -0.391 7.837 -12.834 1118 H ILE 144 H ILE 144 -0.308 7.777 -6.539 1119 HA ILE 144 HA ILE 144 -2.967 8.022 -5.289 1120 HB ILE 144 HB ILE 144 -2.166 10.313 -4.553 1121 1HG1 ILE 144 1HG1 ILE 144 0.626 9.354 -4.588 1122 2HG1 ILE 144 2HG1 ILE 144 -0.025 9.811 -6.159 1123 1HG2 ILE 144 1HG2 ILE 144 -2.405 8.789 -2.833 1124 2HG2 ILE 144 2HG2 ILE 144 -0.710 9.251 -2.687 1125 3HG2 ILE 144 3HG2 ILE 144 -1.145 7.727 -3.460 1126 1HD1 ILE 144 1HD1 ILE 144 -0.494 11.704 -3.950 1127 2HD1 ILE 144 2HD1 ILE 144 -0.092 12.001 -5.641 1128 3HD1 ILE 144 3HD1 ILE 144 1.171 11.528 -4.505 1129 HA PRO 145 HA PRO 145 -3.596 9.831 -9.426 1130 1HB PRO 145 1HB PRO 145 -6.293 9.582 -9.411 1131 2HB PRO 145 2HB PRO 145 -5.213 8.238 -9.803 1132 1HG PRO 145 1HG PRO 145 -6.602 8.860 -7.225 1133 2HG PRO 145 2HG PRO 145 -6.410 7.298 -8.044 1134 1HD PRO 145 1HD PRO 145 -4.859 8.057 -5.953 1135 2HD PRO 145 2HD PRO 145 -4.266 7.007 -7.256 1136 H GLY 146 H GLY 146 -4.920 11.683 -10.180 1137 1HA GLY 146 1HA GLY 146 -6.524 13.417 -9.077 1138 2HA GLY 146 2HA GLY 146 -5.136 13.670 -8.032 1139 H THR 147 H THR 147 -3.209 14.553 -8.930 1140 HA THR 147 HA THR 147 -3.630 16.653 -10.731 1141 HB THR 147 HB THR 147 -0.972 16.439 -10.859 1142 HG1 THR 147 HG1 THR 147 -0.140 15.298 -9.200 1143 1HG2 THR 147 1HG2 THR 147 -0.783 17.919 -9.120 1144 2HG2 THR 147 2HG2 THR 147 -2.043 17.133 -8.169 1145 3HG2 THR 147 3HG2 THR 147 -2.478 18.115 -9.569 1146 H TYR 148 H TYR 148 -2.392 16.984 -12.786 1147 HA TYR 148 HA TYR 148 -3.150 15.090 -14.703 1148 1HB TYR 148 1HB TYR 148 -1.266 17.436 -14.779 1149 2HB TYR 148 2HB TYR 148 -1.518 16.418 -16.193 1150 HD1 TYR 148 HD1 TYR 148 -3.233 18.658 -13.791 1151 HD2 TYR 148 HD2 TYR 148 -3.433 16.682 -17.553 1152 HE1 TYR 148 HE1 TYR 148 -5.233 19.967 -14.365 1153 HE2 TYR 148 HE2 TYR 148 -5.432 17.986 -18.139 1154 HH TYR 148 HH TYR 148 -7.213 19.218 -17.046 1155 H ASN 149 H ASN 149 0.207 16.021 -13.936 1156 HA ASN 149 HA ASN 149 2.152 14.843 -13.945 1157 1HB ASN 149 1HB ASN 149 0.440 12.400 -13.463 1158 2HB ASN 149 2HB ASN 149 2.137 12.616 -13.043 1159 1HD2 ASN 149 1HD2 ASN 149 -0.133 11.925 -11.355 1160 2HD2 ASN 149 2HD2 ASN 149 -0.197 13.132 -10.120 1161 H ASN 150 H ASN 150 3.426 13.250 -15.156 1162 HA ASN 150 HA ASN 150 2.224 12.746 -17.795 1163 1HB ASN 150 1HB ASN 150 5.016 13.398 -16.912 1164 2HB ASN 150 2HB ASN 150 4.755 12.536 -18.426 1165 1HD2 ASN 150 1HD2 ASN 150 3.698 15.412 -16.655 1166 2HD2 ASN 150 2HD2 ASN 150 3.522 16.418 -18.048 1167 H GLY 151 H GLY 151 1.826 10.968 -15.587 1168 1HA GLY 151 1HA GLY 151 1.784 8.695 -15.242 1169 2HA GLY 151 2HA GLY 151 2.500 8.512 -16.836 1170 H ASN 152 H ASN 152 3.897 10.279 -14.124 1171 HA ASN 152 HA ASN 152 5.892 8.155 -13.782 1172 1HB ASN 152 1HB ASN 152 6.488 11.080 -14.263 1173 2HB ASN 152 2HB ASN 152 7.677 9.919 -13.679 1174 1HD2 ASN 152 1HD2 ASN 152 7.043 11.540 -16.271 1175 2HD2 ASN 152 2HD2 ASN 152 7.376 10.390 -17.516 1176 H VAL 153 H VAL 153 3.774 8.563 -12.086 1177 HA VAL 153 HA VAL 153 5.060 9.797 -9.736 1178 HB VAL 153 HB VAL 153 2.689 10.072 -8.856 1179 1HG1 VAL 153 1HG1 VAL 153 2.310 12.081 -10.508 1180 2HG1 VAL 153 2HG1 VAL 153 3.925 11.642 -11.064 1181 3HG1 VAL 153 3HG1 VAL 153 3.663 12.080 -9.377 1182 1HG2 VAL 153 1HG2 VAL 153 1.661 10.210 -11.607 1183 2HG2 VAL 153 2HG2 VAL 153 0.879 9.656 -10.127 1184 3HG2 VAL 153 3HG2 VAL 153 1.970 8.582 -11.002 1185 H TYR 154 H TYR 154 5.909 8.086 -8.686 1186 HA TYR 154 HA TYR 154 4.041 6.011 -7.796 1187 1HB TYR 154 1HB TYR 154 5.816 4.289 -8.120 1188 2HB TYR 154 2HB TYR 154 5.226 4.978 -9.628 1189 HD1 TYR 154 HD1 TYR 154 8.072 4.759 -7.331 1190 HD2 TYR 154 HD2 TYR 154 6.653 6.381 -10.999 1191 HE1 TYR 154 HE1 TYR 154 10.379 5.323 -7.967 1192 HE2 TYR 154 HE2 TYR 154 8.956 6.948 -11.646 1193 HH TYR 154 HH TYR 154 11.457 7.121 -9.581 1194 H PHE 155 H PHE 155 4.278 5.407 -5.705 1195 HA PHE 155 HA PHE 155 6.465 6.687 -4.204 1196 1HB PHE 155 1HB PHE 155 3.868 7.133 -3.795 1197 2HB PHE 155 2HB PHE 155 4.031 5.681 -2.811 1198 HD1 PHE 155 HD1 PHE 155 5.837 5.669 -1.013 1199 HD2 PHE 155 HD2 PHE 155 4.504 9.208 -2.964 1200 HE1 PHE 155 HE1 PHE 155 6.736 7.021 0.836 1201 HE2 PHE 155 HE2 PHE 155 5.401 10.567 -1.119 1202 HZ PHE 155 HZ PHE 155 6.518 9.473 0.784 1203 H ALA 156 H ALA 156 7.965 5.395 -3.392 1204 HA ALA 156 HA ALA 156 7.513 2.521 -3.330 1205 1HB ALA 156 1HB ALA 156 9.947 4.253 -3.093 1206 2HB ALA 156 2HB ALA 156 9.569 3.025 -4.302 1207 3HB ALA 156 3HB ALA 156 9.996 2.545 -2.659 1208 H TRP 157 H TRP 157 8.080 1.233 -1.465 1209 HA TRP 157 HA TRP 157 8.344 2.514 1.101 1210 1HB TRP 157 1HB TRP 157 5.754 2.121 0.174 1211 2HB TRP 157 2HB TRP 157 6.034 0.740 1.228 1212 HD1 TRP 157 HD1 TRP 157 7.859 2.315 3.389 1213 HE1 TRP 157 HE1 TRP 157 6.699 3.936 5.017 1214 HE3 TRP 157 HE3 TRP 157 3.562 3.174 0.755 1215 HZ2 TRP 157 HZ2 TRP 157 4.281 5.385 5.165 1216 HZ3 TRP 157 HZ3 TRP 157 1.876 4.689 1.710 1217 HH2 TRP 157 HH2 TRP 157 2.230 5.771 3.870 1218 H MET 158 H MET 158 9.299 1.195 2.565 1219 HA MET 158 HA MET 158 9.987 -1.492 1.652 1220 1HB MET 158 1HB MET 158 11.093 0.257 3.849 1221 2HB MET 158 2HB MET 158 11.608 -1.403 3.589 1222 1HG MET 158 1HG MET 158 11.705 0.339 1.223 1223 2HG MET 158 2HG MET 158 12.823 0.749 2.523 1224 1HE MET 158 1HE MET 158 14.280 0.436 0.291 1225 2HE MET 158 2HE MET 158 15.260 -1.026 0.175 1226 3HE MET 158 3HE MET 158 15.320 -0.038 1.635 1227 H ARG 159 H ARG 159 8.895 -3.190 2.363 1228 HA ARG 159 HA ARG 159 7.320 -2.941 4.824 1229 1HB ARG 159 1HB ARG 159 6.107 -3.615 2.799 1230 2HB ARG 159 2HB ARG 159 7.172 -5.000 2.615 1231 1HG ARG 159 1HG ARG 159 6.337 -5.577 5.030 1232 2HG ARG 159 2HG ARG 159 4.983 -4.539 4.576 1233 1HD ARG 159 1HD ARG 159 4.657 -5.923 2.551 1234 2HD ARG 159 2HD ARG 159 5.945 -6.990 3.106 1235 HE ARG 159 HE ARG 159 3.897 -6.674 5.066 1236 1HH1 ARG 159 1HH1 ARG 159 4.723 -8.365 2.127 1237 2HH1 ARG 159 2HH1 ARG 159 3.684 -9.709 2.461 1238 1HH2 ARG 159 1HH2 ARG 159 2.530 -8.442 5.508 1239 2HH2 ARG 159 2HH2 ARG 159 2.439 -9.753 4.379 1240 H PHE 160 H PHE 160 7.826 -4.031 6.615 1241 HA PHE 160 HA PHE 160 9.722 -6.271 6.413 1242 1HB PHE 160 1HB PHE 160 10.721 -4.035 7.227 1243 2HB PHE 160 2HB PHE 160 9.803 -4.319 8.702 1244 HD1 PHE 160 HD1 PHE 160 10.236 -6.452 9.990 1245 HD2 PHE 160 HD2 PHE 160 12.783 -5.069 6.874 1246 HE1 PHE 160 HE1 PHE 160 12.049 -7.880 10.843 1247 HE2 PHE 160 HE2 PHE 160 14.600 -6.495 7.721 1248 HZ PHE 160 HZ PHE 160 14.234 -7.903 9.708 1249 H GLN 161 H GLN 161 9.475 -7.923 7.924 1250 HA GLN 161 HA GLN 161 6.844 -7.987 9.201 1251 1HB GLN 161 1HB GLN 161 8.029 -9.835 7.647 1252 2HB GLN 161 2HB GLN 161 8.589 -10.385 9.221 1253 1HG GLN 161 1HG GLN 161 6.308 -10.580 10.000 1254 2HG GLN 161 2HG GLN 161 5.708 -9.937 8.472 1255 1HE2 GLN 161 1HE2 GLN 161 6.463 -11.190 6.513 1256 2HE2 GLN 161 2HE2 GLN 161 6.427 -12.912 6.637 1257 H PHE 162 H PHE 162 6.556 -8.036 11.353 1258 HA PHE 162 HA PHE 162 8.927 -8.373 13.064 1259 1HB PHE 162 1HB PHE 162 7.705 -5.958 12.671 1260 2HB PHE 162 2HB PHE 162 6.862 -6.548 14.099 1261 HD1 PHE 162 HD1 PHE 162 7.867 -6.457 16.208 1262 HD2 PHE 162 HD2 PHE 162 10.227 -5.844 12.720 1263 HE1 PHE 162 HE1 PHE 162 9.755 -5.744 17.616 1264 HE2 PHE 162 HE2 PHE 162 12.119 -5.132 14.122 1265 HZ PHE 162 HZ PHE 162 11.886 -5.082 16.573 1266 H LEU 163 H LEU 163 8.403 -8.961 15.308 1267 HA LEU 163 HA LEU 163 5.765 -10.033 15.821 1268 1HB LEU 163 1HB LEU 163 6.614 -12.306 16.316 1269 2HB LEU 163 2HB LEU 163 6.699 -11.884 14.616 1270 HG LEU 163 HG LEU 163 9.132 -11.423 16.261 1271 1HD1 LEU 163 1HD1 LEU 163 9.794 -13.813 15.782 1272 2HD1 LEU 163 2HD1 LEU 163 8.087 -14.131 15.479 1273 3HD1 LEU 163 3HD1 LEU 163 8.612 -13.579 17.070 1274 1HD2 LEU 163 1HD2 LEU 163 10.035 -12.481 14.044 1275 2HD2 LEU 163 2HD2 LEU 163 9.483 -10.805 14.077 1276 3HD2 LEU 163 3HD2 LEU 163 8.432 -12.069 13.435 1277 H GLU 164 H GLU 164 5.396 -10.510 18.013 1278 HA GLU 164 HA GLU 164 7.460 -9.449 19.823 1279 1HB GLU 164 1HB GLU 164 4.520 -9.179 19.717 1280 2HB GLU 164 2HB GLU 164 5.199 -9.412 21.322 1281 1HG GLU 164 1HG GLU 164 4.913 -7.042 20.705 1282 2HG GLU 164 2HG GLU 164 6.580 -7.471 21.088 1283 HE2 GLU 164 HE2 GLU 164 7.659 -6.666 17.920 1284 H HIS 165 H HIS 165 8.543 -11.422 20.103 1285 HA HIS 165 HA HIS 165 7.056 -13.395 21.707 1286 1HB HIS 165 1HB HIS 165 8.867 -13.775 19.382 1287 2HB HIS 165 2HB HIS 165 9.014 -14.932 20.700 1288 HD1 HIS 165 HD1 HIS 165 7.155 -16.645 20.977 1289 HD2 HIS 165 HD2 HIS 165 6.366 -13.824 18.029 1290 HE1 HIS 165 HE1 HIS 165 5.141 -17.507 19.743 1291 HE2 HIS 165 HE2 HIS 165 4.630 -15.741 18.020 1292 H HIS 166 H HIS 166 7.698 -12.959 23.735 1293 HA HIS 166 HA HIS 166 10.302 -13.626 24.582 1294 1HB HIS 166 1HB HIS 166 10.992 -11.377 25.427 1295 2HB HIS 166 2HB HIS 166 10.988 -11.504 23.671 1296 HD1 HIS 166 HD1 HIS 166 9.261 -10.092 22.384 1297 HD2 HIS 166 HD2 HIS 166 9.073 -9.637 26.509 1298 HE1 HIS 166 HE1 HIS 166 7.798 -8.083 22.773 1299 HE2 HIS 166 HE2 HIS 166 7.767 -7.777 25.273 1300 H HIS 167 H HIS 167 7.403 -11.732 25.304 1301 HA HIS 167 HA HIS 167 7.474 -12.813 28.045 1302 1HB HIS 167 1HB HIS 167 7.092 -10.110 27.066 1303 2HB HIS 167 2HB HIS 167 5.726 -10.627 28.047 1304 HD1 HIS 167 HD1 HIS 167 6.018 -10.455 30.510 1305 HD2 HIS 167 HD2 HIS 167 9.651 -10.391 28.495 1306 HE1 HIS 167 HE1 HIS 167 7.753 -9.991 32.269 1307 HE2 HIS 167 HE2 HIS 167 9.952 -10.040 31.040 1308 H HIS 168 H HIS 168 5.712 -13.868 28.803 1309 HA HIS 168 HA HIS 168 3.235 -13.805 27.251 1310 1HB HIS 168 1HB HIS 168 4.992 -15.837 26.831 1311 2HB HIS 168 2HB HIS 168 4.032 -16.503 28.147 1312 HD1 HIS 168 HD1 HIS 168 3.194 -18.269 26.345 1313 HD2 HIS 168 HD2 HIS 168 2.008 -14.339 25.699 1314 HE1 HIS 168 HE1 HIS 168 1.314 -18.399 24.680 1315 HE2 HIS 168 HE2 HIS 168 0.668 -16.004 24.241 1316 H HIS 169 H HIS 169 1.652 -13.354 28.618 1317 HA HIS 169 HA HIS 169 1.906 -14.220 31.417 1318 1HB HIS 169 1HB HIS 169 0.301 -11.974 30.186 1319 2HB HIS 169 2HB HIS 169 0.203 -12.441 31.881 1320 HD1 HIS 169 HD1 HIS 169 1.154 -9.618 30.926 1321 HD2 HIS 169 HD2 HIS 169 3.657 -12.774 31.946 1322 HE1 HIS 169 HE1 HIS 169 3.343 -8.560 31.563 1323 HE2 HIS 169 HE2 HIS 169 4.815 -10.483 32.261 1324 H HIS 170 H HIS 170 0.859 -16.068 31.762 1325 HA HIS 170 HA HIS 170 -1.678 -16.553 30.367 1326 1HB HIS 170 1HB HIS 170 0.467 -18.293 31.445 1327 2HB HIS 170 2HB HIS 170 -1.178 -18.902 31.594 1328 HD1 HIS 170 HD1 HIS 170 -1.835 -20.311 29.684 1329 HD2 HIS 170 HD2 HIS 170 0.892 -17.384 28.561 1330 HE1 HIS 170 HE1 HIS 170 -1.418 -20.687 27.234 1331 HE2 HIS 170 HE2 HIS 170 0.166 -18.848 26.557 Start of MODEL 11 1 1H MET 1 1H MET 1 -30.472 -18.961 29.761 2 2H MET 1 2H MET 1 -30.326 -18.520 28.109 3 H MET 1 H MET 1 -30.659 -18.674 29.445 4 3H MET 1 3H MET 1 -28.935 -18.976 29.004 5 HA MET 1 HA MET 1 -30.084 -21.157 29.356 6 1HB MET 1 1HB MET 1 -31.624 -20.107 26.972 7 2HB MET 1 2HB MET 1 -31.754 -21.717 27.665 8 1HG MET 1 1HG MET 1 -32.379 -19.229 29.223 9 2HG MET 1 2HG MET 1 -33.580 -20.075 28.248 10 1HE MET 1 1HE MET 1 -31.760 -19.543 31.192 11 2HE MET 1 2HE MET 1 -31.724 -21.002 32.182 12 3HE MET 1 3HE MET 1 -33.171 -19.995 32.150 13 H ASN 2 H ASN 2 -28.998 -19.127 26.724 14 HA ASN 2 HA ASN 2 -26.918 -20.987 26.063 15 1HB ASN 2 1HB ASN 2 -29.322 -20.712 24.321 16 2HB ASN 2 2HB ASN 2 -27.750 -20.834 23.537 17 1HD2 ASN 2 1HD2 ASN 2 -26.360 -22.593 24.870 18 2HD2 ASN 2 2HD2 ASN 2 -27.151 -24.126 24.961 19 H ALA 3 H ALA 3 -28.742 -18.140 24.981 20 HA ALA 3 HA ALA 3 -26.740 -16.930 23.464 21 1HB ALA 3 1HB ALA 3 -29.062 -16.194 23.418 22 2HB ALA 3 2HB ALA 3 -27.984 -14.847 23.785 23 3HB ALA 3 3HB ALA 3 -28.919 -15.605 25.074 24 H ASP 4 H ASP 4 -27.026 -17.274 26.879 25 HA ASP 4 HA ASP 4 -25.338 -15.058 27.572 26 1HB ASP 4 1HB ASP 4 -27.121 -16.343 29.020 27 2HB ASP 4 2HB ASP 4 -25.762 -17.399 29.392 28 HD2 ASP 4 HD2 ASP 4 -25.972 -13.917 31.144 29 H GLU 5 H GLU 5 -24.910 -18.594 27.720 30 HA GLU 5 HA GLU 5 -22.122 -18.454 28.221 31 1HB GLU 5 1HB GLU 5 -23.781 -20.736 27.131 32 2HB GLU 5 2HB GLU 5 -22.132 -20.874 27.726 33 1HG GLU 5 1HG GLU 5 -23.031 -21.379 29.689 34 2HG GLU 5 2HG GLU 5 -23.449 -19.670 29.817 35 HE2 GLU 5 HE2 GLU 5 -26.750 -20.536 29.925 36 H TRP 6 H TRP 6 -24.049 -18.374 25.341 37 HA TRP 6 HA TRP 6 -22.019 -19.150 23.507 38 1HB TRP 6 1HB TRP 6 -24.730 -17.958 23.333 39 2HB TRP 6 2HB TRP 6 -23.661 -17.671 21.964 40 HD1 TRP 6 HD1 TRP 6 -23.717 -20.976 23.938 41 HE1 TRP 6 HE1 TRP 6 -24.464 -22.855 22.346 42 HE3 TRP 6 HE3 TRP 6 -24.897 -18.150 19.843 43 HZ2 TRP 6 HZ2 TRP 6 -25.427 -23.106 19.704 44 HZ3 TRP 6 HZ3 TRP 6 -25.724 -19.288 17.825 45 HH2 TRP 6 HH2 TRP 6 -25.983 -21.715 17.758 46 H MET 7 H MET 7 -23.298 -15.979 24.494 47 HA MET 7 HA MET 7 -21.611 -14.415 22.898 48 1HB MET 7 1HB MET 7 -23.693 -13.747 24.292 49 2HB MET 7 2HB MET 7 -22.549 -13.525 25.609 50 1HG MET 7 1HG MET 7 -21.606 -11.685 24.673 51 2HG MET 7 2HG MET 7 -21.931 -12.218 23.024 52 1HE MET 7 1HE MET 7 -23.603 -11.556 21.640 53 2HE MET 7 2HE MET 7 -23.144 -9.890 21.991 54 3HE MET 7 3HE MET 7 -24.848 -10.345 21.952 55 H THR 8 H THR 8 -21.138 -15.856 26.063 56 HA THR 8 HA THR 8 -18.840 -14.461 26.844 57 HB THR 8 HB THR 8 -19.464 -17.352 27.466 58 HG1 THR 8 HG1 THR 8 -21.250 -16.406 28.151 59 1HG2 THR 8 1HG2 THR 8 -17.301 -16.730 28.288 60 2HG2 THR 8 2HG2 THR 8 -18.429 -16.826 29.642 61 3HG2 THR 8 3HG2 THR 8 -17.952 -15.254 29.000 62 H THR 9 H THR 9 -19.286 -17.146 24.653 63 HA THR 9 HA THR 9 -16.498 -17.805 24.480 64 HB THR 9 HB THR 9 -18.743 -18.539 22.593 65 HG1 THR 9 HG1 THR 9 -19.350 -19.418 24.463 66 1HG2 THR 9 1HG2 THR 9 -17.419 -20.409 21.939 67 2HG2 THR 9 2HG2 THR 9 -16.166 -19.996 23.110 68 3HG2 THR 9 3HG2 THR 9 -16.456 -18.946 21.723 69 H PHE 10 H PHE 10 -18.771 -15.867 22.613 70 HA PHE 10 HA PHE 10 -16.931 -15.318 20.490 71 1HB PHE 10 1HB PHE 10 -19.615 -14.232 21.286 72 2HB PHE 10 2HB PHE 10 -18.674 -13.447 20.022 73 HD1 PHE 10 HD1 PHE 10 -17.628 -15.313 18.314 74 HD2 PHE 10 HD2 PHE 10 -21.245 -15.641 20.532 75 HE1 PHE 10 HE1 PHE 10 -18.485 -16.932 16.670 76 HE2 PHE 10 HE2 PHE 10 -22.109 -17.260 18.893 77 HZ PHE 10 HZ PHE 10 -20.728 -17.907 16.959 78 H ARG 11 H ARG 11 -17.898 -13.702 23.461 79 HA ARG 11 HA ARG 11 -16.647 -11.227 22.978 80 1HB ARG 11 1HB ARG 11 -17.948 -12.559 25.191 81 2HB ARG 11 2HB ARG 11 -16.531 -11.678 25.744 82 1HG ARG 11 1HG ARG 11 -17.696 -9.848 24.106 83 2HG ARG 11 2HG ARG 11 -19.103 -10.688 24.760 84 1HD ARG 11 1HD ARG 11 -17.120 -10.106 26.800 85 2HD ARG 11 2HD ARG 11 -17.680 -8.649 25.981 86 HE ARG 11 HE ARG 11 -19.739 -8.922 26.955 87 1HH1 ARG 11 1HH1 ARG 11 -17.878 -11.846 27.373 88 2HH1 ARG 11 2HH1 ARG 11 -19.009 -12.556 28.476 89 1HH2 ARG 11 1HH2 ARG 11 -21.227 -9.855 28.404 90 2HH2 ARG 11 2HH2 ARG 11 -20.911 -11.427 29.060 91 H GLU 12 H GLU 12 -15.489 -14.191 24.534 92 HA GLU 12 HA GLU 12 -12.940 -13.127 25.229 93 1HB GLU 12 1HB GLU 12 -14.201 -15.825 25.214 94 2HB GLU 12 2HB GLU 12 -12.446 -15.744 25.266 95 1HG GLU 12 1HG GLU 12 -13.851 -13.996 27.166 96 2HG GLU 12 2HG GLU 12 -14.034 -15.727 27.439 97 HE2 GLU 12 HE2 GLU 12 -11.004 -15.688 29.019 98 H ASN 13 H ASN 13 -14.218 -14.851 22.450 99 HA ASN 13 HA ASN 13 -11.712 -15.402 21.231 100 1HB ASN 13 1HB ASN 13 -14.233 -16.251 20.767 101 2HB ASN 13 2HB ASN 13 -14.083 -15.048 19.490 102 1HD2 ASN 13 1HD2 ASN 13 -12.775 -18.011 20.801 103 2HD2 ASN 13 2HD2 ASN 13 -11.968 -18.518 19.360 104 H ILE 14 H ILE 14 -14.159 -12.882 20.655 105 HA ILE 14 HA ILE 14 -12.682 -11.524 18.661 106 HB ILE 14 HB ILE 14 -15.107 -11.237 18.932 107 1HG1 ILE 14 1HG1 ILE 14 -15.134 -8.712 18.784 108 2HG1 ILE 14 2HG1 ILE 14 -13.422 -8.742 19.195 109 1HG2 ILE 14 1HG2 ILE 14 -16.129 -10.270 20.752 110 2HG2 ILE 14 2HG2 ILE 14 -14.668 -9.423 21.259 111 3HG2 ILE 14 3HG2 ILE 14 -14.816 -11.160 21.525 112 1HD1 ILE 14 1HD1 ILE 14 -12.967 -10.059 17.192 113 2HD1 ILE 14 2HD1 ILE 14 -13.750 -8.527 16.802 114 3HD1 ILE 14 3HD1 ILE 14 -14.682 -10.024 16.782 115 H ALA 15 H ALA 15 -12.873 -11.182 22.166 116 HA ALA 15 HA ALA 15 -11.314 -8.792 22.279 117 1HB ALA 15 1HB ALA 15 -12.202 -10.786 24.339 118 2HB ALA 15 2HB ALA 15 -12.743 -9.124 24.104 119 3HB ALA 15 3HB ALA 15 -11.131 -9.445 24.743 120 H GLN 16 H GLN 16 -10.613 -12.215 22.330 121 HA GLN 16 HA GLN 16 -7.923 -11.958 23.256 122 1HB GLN 16 1HB GLN 16 -9.188 -14.047 23.507 123 2HB GLN 16 2HB GLN 16 -9.258 -14.220 21.759 124 1HG GLN 16 1HG GLN 16 -7.517 -15.603 22.227 125 2HG GLN 16 2HG GLN 16 -6.644 -14.094 21.969 126 1HE2 GLN 16 1HE2 GLN 16 -8.097 -16.098 24.487 127 2HE2 GLN 16 2HE2 GLN 16 -6.975 -15.667 25.728 128 H THR 17 H THR 17 -9.259 -12.796 20.053 129 HA THR 17 HA THR 17 -6.831 -12.646 18.667 130 HB THR 17 HB THR 17 -9.384 -11.905 17.302 131 HG1 THR 17 HG1 THR 17 -10.349 -13.616 17.985 132 1HG2 THR 17 1HG2 THR 17 -8.474 -12.796 15.471 133 2HG2 THR 17 2HG2 THR 17 -7.786 -14.162 16.352 134 3HG2 THR 17 3HG2 THR 17 -6.951 -12.607 16.341 135 H TRP 18 H TRP 18 -9.191 -10.181 19.493 136 HA TRP 18 HA TRP 18 -8.045 -8.149 17.841 137 1HB TRP 18 1HB TRP 18 -10.405 -8.086 18.550 138 2HB TRP 18 2HB TRP 18 -9.893 -7.890 20.223 139 HD1 TRP 18 HD1 TRP 18 -10.307 -5.472 20.926 140 HE1 TRP 18 HE1 TRP 18 -9.986 -3.152 19.858 141 HE3 TRP 18 HE3 TRP 18 -8.634 -6.924 16.318 142 HZ2 TRP 18 HZ2 TRP 18 -9.136 -2.080 17.388 143 HZ3 TRP 18 HZ3 TRP 18 -8.089 -5.189 14.660 144 HH2 TRP 18 HH2 TRP 18 -8.336 -2.817 15.186 145 H GLN 19 H GLN 19 -7.552 -9.274 21.107 146 HA GLN 19 HA GLN 19 -6.046 -6.998 21.970 147 1HB GLN 19 1HB GLN 19 -6.720 -9.674 23.076 148 2HB GLN 19 2HB GLN 19 -5.293 -8.874 23.724 149 1HG GLN 19 1HG GLN 19 -6.506 -7.162 24.658 150 2HG GLN 19 2HG GLN 19 -7.853 -7.365 23.539 151 1HE2 GLN 19 1HE2 GLN 19 -9.002 -7.172 25.656 152 2HE2 GLN 19 2HE2 GLN 19 -9.304 -8.632 26.528 153 H GLN 20 H GLN 20 -4.885 -10.354 21.854 154 HA GLN 20 HA GLN 20 -2.187 -9.586 21.509 155 1HB GLN 20 1HB GLN 20 -1.749 -11.967 21.172 156 2HB GLN 20 2HB GLN 20 -2.830 -11.715 22.536 157 1HG GLN 20 1HG GLN 20 -4.082 -13.297 21.604 158 2HG GLN 20 2HG GLN 20 -4.586 -12.041 20.474 159 1HE2 GLN 20 1HE2 GLN 20 -4.982 -13.891 19.067 160 2HE2 GLN 20 2HE2 GLN 20 -3.674 -14.524 18.133 161 HA PRO 21 HA PRO 21 -2.576 -8.575 17.121 162 1HB PRO 21 1HB PRO 21 0.378 -8.450 17.397 163 2HB PRO 21 2HB PRO 21 -0.743 -7.253 16.737 164 1HG PRO 21 1HG PRO 21 0.377 -6.898 19.129 165 2HG PRO 21 2HG PRO 21 -1.309 -6.434 18.830 166 1HD PRO 21 1HD PRO 21 -0.223 -8.825 20.261 167 2HD PRO 21 2HD PRO 21 -1.641 -7.827 20.646 168 H GLU 22 H GLU 22 -2.750 -10.045 15.562 169 HA GLU 22 HA GLU 22 -1.505 -12.614 15.778 170 1HB GLU 22 1HB GLU 22 -3.797 -11.822 14.656 171 2HB GLU 22 2HB GLU 22 -2.775 -11.757 13.227 172 1HG GLU 22 1HG GLU 22 -3.746 -13.888 13.212 173 2HG GLU 22 2HG GLU 22 -2.091 -14.129 13.771 174 HE2 GLU 22 HE2 GLU 22 -3.169 -15.443 16.746 175 H HIS 23 H HIS 23 -0.897 -9.677 13.989 176 HA HIS 23 HA HIS 23 1.670 -10.763 13.132 177 1HB HIS 23 1HB HIS 23 -0.350 -10.825 11.337 178 2HB HIS 23 2HB HIS 23 0.261 -9.199 11.049 179 HD1 HIS 23 HD1 HIS 23 1.503 -9.469 8.904 180 HD2 HIS 23 HD2 HIS 23 2.474 -12.416 11.669 181 HE1 HIS 23 HE1 HIS 23 3.401 -10.758 7.874 182 HE2 HIS 23 HE2 HIS 23 3.918 -12.585 9.530 183 H TYR 24 H TYR 24 3.152 -9.070 12.360 184 HA TYR 24 HA TYR 24 2.455 -6.403 13.396 185 1HB TYR 24 1HB TYR 24 4.276 -8.125 14.575 186 2HB TYR 24 2HB TYR 24 5.295 -7.061 13.611 187 HD1 TYR 24 HD1 TYR 24 5.401 -4.665 14.098 188 HD2 TYR 24 HD2 TYR 24 3.050 -7.291 16.481 189 HE1 TYR 24 HE1 TYR 24 5.248 -2.936 15.840 190 HE2 TYR 24 HE2 TYR 24 2.891 -5.569 18.231 191 HH TYR 24 HH TYR 24 4.820 -3.099 18.561 192 H ASP 25 H ASP 25 2.443 -5.024 11.758 193 HA ASP 25 HA ASP 25 4.480 -5.331 9.649 194 1HB ASP 25 1HB ASP 25 1.759 -4.062 9.307 195 2HB ASP 25 2HB ASP 25 2.922 -4.455 8.044 196 HD2 ASP 25 HD2 ASP 25 0.304 -7.105 8.804 197 H LEU 26 H LEU 26 5.408 -3.437 8.789 198 HA LEU 26 HA LEU 26 4.852 -0.931 10.193 199 1HB LEU 26 1HB LEU 26 7.292 -2.541 10.412 200 2HB LEU 26 2HB LEU 26 7.589 -0.865 9.992 201 HG LEU 26 HG LEU 26 5.951 -0.421 12.026 202 1HD1 LEU 26 1HD1 LEU 26 6.909 -3.225 12.399 203 2HD1 LEU 26 2HD1 LEU 26 5.324 -2.524 12.732 204 3HD1 LEU 26 3HD1 LEU 26 6.684 -2.177 13.801 205 1HD2 LEU 26 1HD2 LEU 26 7.859 -0.058 13.399 206 2HD2 LEU 26 2HD2 LEU 26 8.347 0.264 11.735 207 3HD2 LEU 26 3HD2 LEU 26 8.804 -1.253 12.510 208 H TYR 27 H TYR 27 4.963 0.830 8.917 209 HA TYR 27 HA TYR 27 5.927 0.428 6.164 210 1HB TYR 27 1HB TYR 27 3.791 2.272 7.246 211 2HB TYR 27 2HB TYR 27 4.389 2.333 5.592 212 HD1 TYR 27 HD1 TYR 27 2.971 -0.127 8.023 213 HD2 TYR 27 HD2 TYR 27 3.238 1.151 3.974 214 HE1 TYR 27 HE1 TYR 27 1.340 -1.850 7.377 215 HE2 TYR 27 HE2 TYR 27 1.607 -0.567 3.317 216 HH TYR 27 HH TYR 27 0.815 -2.795 4.219 217 H ILE 28 H ILE 28 7.749 1.436 5.665 218 HA ILE 28 HA ILE 28 8.287 4.078 6.817 219 HB ILE 28 HB ILE 28 10.685 3.459 7.108 220 1HG1 ILE 28 1HG1 ILE 28 10.002 0.584 7.262 221 2HG1 ILE 28 2HG1 ILE 28 10.112 1.259 5.639 222 1HG2 ILE 28 1HG2 ILE 28 8.448 2.427 8.731 223 2HG2 ILE 28 2HG2 ILE 28 9.755 3.530 9.166 224 3HG2 ILE 28 3HG2 ILE 28 10.049 1.791 9.112 225 1HD1 ILE 28 1HD1 ILE 28 12.351 2.162 7.123 226 2HD1 ILE 28 2HD1 ILE 28 12.310 1.090 5.723 227 3HD1 ILE 28 3HD1 ILE 28 12.197 0.420 7.350 228 HA PRO 29 HA PRO 29 9.472 5.170 2.715 229 1HB PRO 29 1HB PRO 29 11.407 7.025 3.176 230 2HB PRO 29 2HB PRO 29 9.687 7.339 3.436 231 1HG PRO 29 1HG PRO 29 11.802 6.608 5.425 232 2HG PRO 29 2HG PRO 29 10.514 7.820 5.556 233 1HD PRO 29 1HD PRO 29 10.332 5.386 6.716 234 2HD PRO 29 2HD PRO 29 8.912 6.246 6.085 235 H ALA 30 H ALA 30 11.544 5.558 1.347 236 HA ALA 30 HA ALA 30 13.558 3.535 2.085 237 1HB ALA 30 1HB ALA 30 11.809 3.217 0.066 238 2HB ALA 30 2HB ALA 30 13.434 2.531 0.068 239 3HB ALA 30 3HB ALA 30 13.115 4.041 -0.785 240 H ILE 31 H ILE 31 15.199 4.811 2.775 241 HA ILE 31 HA ILE 31 16.606 6.355 0.783 242 HB ILE 31 HB ILE 31 16.774 8.381 2.245 243 1HG1 ILE 31 1HG1 ILE 31 14.447 8.407 3.677 244 2HG1 ILE 31 2HG1 ILE 31 14.953 6.732 3.874 245 1HG2 ILE 31 1HG2 ILE 31 14.925 9.401 1.289 246 2HG2 ILE 31 2HG2 ILE 31 13.914 7.968 1.468 247 3HG2 ILE 31 3HG2 ILE 31 15.182 8.005 0.243 248 1HD1 ILE 31 1HD1 ILE 31 17.100 8.665 4.281 249 2HD1 ILE 31 2HD1 ILE 31 16.608 7.284 5.262 250 3HD1 ILE 31 3HD1 ILE 31 15.762 8.823 5.418 251 H THR 32 H THR 32 18.692 5.924 1.023 252 HA THR 32 HA THR 32 19.895 5.798 3.656 253 HB THR 32 HB THR 32 19.139 3.499 3.366 254 HG1 THR 32 HG1 THR 32 21.055 3.543 4.395 255 1HG2 THR 32 1HG2 THR 32 20.291 2.123 1.567 256 2HG2 THR 32 2HG2 THR 32 20.584 3.657 0.748 257 3HG2 THR 32 3HG2 THR 32 18.932 3.131 1.072 258 H TRP 33 H TRP 33 20.158 7.572 1.442 259 HA TRP 33 HA TRP 33 23.008 7.554 1.182 260 1HB TRP 33 1HB TRP 33 21.355 6.480 -0.982 261 2HB TRP 33 2HB TRP 33 22.417 7.784 -1.506 262 HD1 TRP 33 HD1 TRP 33 24.873 7.003 0.476 263 HE1 TRP 33 HE1 TRP 33 26.313 4.957 -0.131 264 HE3 TRP 33 HE3 TRP 33 21.591 4.584 -2.609 265 HZ2 TRP 33 HZ2 TRP 33 26.087 2.627 -1.708 266 HZ3 TRP 33 HZ3 TRP 33 22.280 2.453 -3.626 267 HH2 TRP 33 HH2 TRP 33 24.482 1.495 -3.184 268 H HIS 34 H HIS 34 22.448 9.542 2.317 269 HA HIS 34 HA HIS 34 21.293 11.637 0.624 270 1HB HIS 34 1HB HIS 34 21.382 11.124 3.495 271 2HB HIS 34 2HB HIS 34 21.837 12.778 3.095 272 HD1 HIS 34 HD1 HIS 34 19.294 10.998 1.015 273 HD2 HIS 34 HD2 HIS 34 19.421 13.783 4.096 274 HE1 HIS 34 HE1 HIS 34 16.967 11.937 1.168 275 HE2 HIS 34 HE2 HIS 34 17.048 13.560 3.093 276 H ALA 35 H ALA 35 24.227 10.740 2.332 277 HA ALA 35 HA ALA 35 25.569 13.164 1.376 278 1HB ALA 35 1HB ALA 35 25.839 12.621 3.740 279 2HB ALA 35 2HB ALA 35 27.382 12.543 2.891 280 3HB ALA 35 3HB ALA 35 26.529 11.057 3.309 281 H ARG 36 H ARG 36 25.435 9.723 0.900 282 HA ARG 36 HA ARG 36 26.361 8.358 -0.663 283 1HB ARG 36 1HB ARG 36 26.056 10.796 -1.949 284 2HB ARG 36 2HB ARG 36 27.735 10.375 -2.261 285 1HG ARG 36 1HG ARG 36 25.635 8.309 -2.687 286 2HG ARG 36 2HG ARG 36 25.821 9.603 -3.873 287 1HD ARG 36 1HD ARG 36 27.756 8.772 -4.653 288 2HD ARG 36 2HD ARG 36 28.342 8.369 -3.040 289 HE ARG 36 HE ARG 36 26.438 6.502 -3.489 290 1HH1 ARG 36 1HH1 ARG 36 29.213 7.567 -5.319 291 2HH1 ARG 36 2HH1 ARG 36 29.478 6.022 -6.054 292 1HH2 ARG 36 1HH2 ARG 36 26.785 4.468 -4.455 293 2HH2 ARG 36 2HH2 ARG 36 28.100 4.263 -5.565 294 H PHE 37 H PHE 37 27.809 8.980 1.698 295 HA PHE 37 HA PHE 37 30.454 8.180 0.822 296 1HB PHE 37 1HB PHE 37 29.869 10.872 1.787 297 2HB PHE 37 2HB PHE 37 31.110 10.071 2.745 298 HD1 PHE 37 HD1 PHE 37 33.296 9.835 1.937 299 HD2 PHE 37 HD2 PHE 37 30.188 11.056 -0.700 300 HE1 PHE 37 HE1 PHE 37 34.971 10.365 0.215 301 HE2 PHE 37 HE2 PHE 37 31.856 11.588 -2.428 302 HZ PHE 37 HZ PHE 37 34.252 11.243 -1.971 303 H ALA 38 H ALA 38 29.525 6.255 1.855 304 HA ALA 38 HA ALA 38 28.898 6.171 4.608 305 1HB ALA 38 1HB ALA 38 28.598 4.436 2.573 306 2HB ALA 38 2HB ALA 38 28.488 3.978 4.273 307 3HB ALA 38 3HB ALA 38 29.991 3.722 3.385 308 H TYR 39 H TYR 39 30.228 6.507 6.251 309 HA TYR 39 HA TYR 39 33.097 6.036 5.899 310 1HB TYR 39 1HB TYR 39 33.233 7.291 8.115 311 2HB TYR 39 2HB TYR 39 32.690 8.216 6.720 312 HD1 TYR 39 HD1 TYR 39 30.446 9.077 6.598 313 HD2 TYR 39 HD2 TYR 39 31.647 6.650 9.878 314 HE1 TYR 39 HE1 TYR 39 28.416 9.736 7.820 315 HE2 TYR 39 HE2 TYR 39 29.620 7.300 11.109 316 HH TYR 39 HH TYR 39 26.985 8.636 9.739 317 H ASP 40 H ASP 40 33.862 4.141 6.541 318 HA ASP 40 HA ASP 40 32.421 2.348 8.197 319 1HB ASP 40 1HB ASP 40 35.098 2.384 6.900 320 2HB ASP 40 2HB ASP 40 34.871 1.272 8.248 321 HD2 ASP 40 HD2 ASP 40 32.375 0.611 5.239 322 H LYS 41 H LYS 41 33.078 1.497 10.262 323 HA LYS 41 HA LYS 41 34.435 3.515 11.927 324 1HB LYS 41 1HB LYS 41 32.247 1.560 12.653 325 2HB LYS 41 2HB LYS 41 33.094 2.571 13.816 326 1HG LYS 41 1HG LYS 41 32.196 4.553 12.889 327 2HG LYS 41 2HG LYS 41 31.588 3.695 11.472 328 1HD LYS 41 1HD LYS 41 29.643 3.698 12.608 329 2HD LYS 41 2HD LYS 41 30.357 2.327 13.459 330 1HE LYS 41 1HE LYS 41 30.657 3.499 15.365 331 2HE LYS 41 2HE LYS 41 31.067 4.986 14.509 332 1HZ LYS 41 1HZ LYS 41 28.897 4.920 15.818 333 2HZ LYS 41 2HZ LYS 41 28.295 3.964 14.559 334 3HZ LYS 41 3HZ LYS 41 28.838 5.535 14.243 335 H GLU 42 H GLU 42 33.748 0.015 11.831 336 HA GLU 42 HA GLU 42 36.435 -0.769 12.027 337 1HB GLU 42 1HB GLU 42 36.446 -1.634 14.354 338 2HB GLU 42 2HB GLU 42 36.385 0.121 14.271 339 1HG GLU 42 1HG GLU 42 33.751 -0.458 14.379 340 2HG GLU 42 2HG GLU 42 34.421 -1.795 15.313 341 HE2 GLU 42 HE2 GLU 42 35.865 0.773 17.496 342 H LYS 43 H LYS 43 35.323 -1.986 10.321 343 HA LYS 43 HA LYS 43 34.465 -3.909 9.464 344 1HB LYS 43 1HB LYS 43 36.150 -4.810 11.172 345 2HB LYS 43 2HB LYS 43 34.761 -5.124 12.203 346 1HG LYS 43 1HG LYS 43 33.844 -6.394 10.128 347 2HG LYS 43 2HG LYS 43 35.538 -6.415 9.629 348 1HD LYS 43 1HD LYS 43 36.177 -7.564 11.636 349 2HD LYS 43 2HD LYS 43 34.556 -7.387 12.310 350 1HE LYS 43 1HE LYS 43 34.774 -8.738 9.686 351 2HE LYS 43 2HE LYS 43 35.397 -9.614 11.084 352 1HZ LYS 43 1HZ LYS 43 32.933 -9.877 10.413 353 2HZ LYS 43 2HZ LYS 43 32.722 -8.390 11.191 354 3HZ LYS 43 3HZ LYS 43 33.325 -9.714 12.052 355 H THR 44 H THR 44 32.672 -1.955 10.646 356 HA THR 44 HA THR 44 30.321 -3.646 10.831 357 HB THR 44 HB THR 44 29.634 -2.039 12.844 358 HG1 THR 44 HG1 THR 44 31.263 -1.097 13.733 359 1HG2 THR 44 1HG2 THR 44 30.745 -4.705 12.720 360 2HG2 THR 44 2HG2 THR 44 29.423 -4.071 13.698 361 3HG2 THR 44 3HG2 THR 44 31.088 -3.907 14.256 362 H ASP 45 H ASP 45 28.342 -2.500 10.480 363 HA ASP 45 HA ASP 45 28.733 0.161 9.274 364 1HB ASP 45 1HB ASP 45 27.289 -2.248 8.294 365 2HB ASP 45 2HB ASP 45 26.555 -0.682 7.966 366 HD2 ASP 45 HD2 ASP 45 29.614 0.150 6.158 367 H ARG 46 H ARG 46 26.361 -1.978 10.831 368 HA ARG 46 HA ARG 46 24.594 -1.556 12.198 369 1HB ARG 46 1HB ARG 46 26.417 0.745 12.725 370 2HB ARG 46 2HB ARG 46 24.783 0.815 13.374 371 1HG ARG 46 1HG ARG 46 25.487 -1.660 14.153 372 2HG ARG 46 2HG ARG 46 27.065 -0.870 14.159 373 1HD ARG 46 1HD ARG 46 25.547 1.009 15.383 374 2HD ARG 46 2HD ARG 46 24.734 -0.465 15.908 375 HE ARG 46 HE ARG 46 27.506 -0.764 16.258 376 1HH1 ARG 46 1HH1 ARG 46 24.809 1.011 17.585 377 2HH1 ARG 46 2HH1 ARG 46 25.511 1.144 19.162 378 1HH2 ARG 46 1HH2 ARG 46 28.430 -0.591 18.333 379 2HH2 ARG 46 2HH2 ARG 46 27.566 0.234 19.587 380 H TYR 47 H TYR 47 22.662 -0.163 12.500 381 HA TYR 47 HA TYR 47 22.010 1.173 9.969 382 1HB TYR 47 1HB TYR 47 20.656 -0.793 11.312 383 2HB TYR 47 2HB TYR 47 19.815 0.654 11.857 384 HD1 TYR 47 HD1 TYR 47 21.274 -0.388 8.573 385 HD2 TYR 47 HD2 TYR 47 17.834 0.914 10.710 386 HE1 TYR 47 HE1 TYR 47 19.991 -0.353 6.476 387 HE2 TYR 47 HE2 TYR 47 16.541 0.952 8.619 388 HH TYR 47 HH TYR 47 17.156 1.214 6.079 389 H ASN 48 H ASN 48 21.545 3.285 9.880 390 HA ASN 48 HA ASN 48 21.891 4.872 12.271 391 1HB ASN 48 1HB ASN 48 21.264 5.771 9.451 392 2HB ASN 48 2HB ASN 48 21.822 6.791 10.774 393 1HD2 ASN 48 1HD2 ASN 48 23.957 6.829 11.302 394 2HD2 ASN 48 2HD2 ASN 48 25.181 6.028 10.383 395 H GLU 49 H GLU 49 20.318 5.645 13.514 396 HA GLU 49 HA GLU 49 17.564 5.122 12.837 397 1HB GLU 49 1HB GLU 49 19.059 5.985 15.244 398 2HB GLU 49 2HB GLU 49 17.393 6.533 15.130 399 1HG GLU 49 1HG GLU 49 17.245 4.548 16.316 400 2HG GLU 49 2HG GLU 49 16.818 4.082 14.670 401 HE2 GLU 49 HE2 GLU 49 20.490 3.008 15.730 402 H ARG 50 H ARG 50 16.166 6.500 11.952 403 HA ARG 50 HA ARG 50 16.763 9.376 12.042 404 1HB ARG 50 1HB ARG 50 15.786 7.877 9.606 405 2HB ARG 50 2HB ARG 50 16.065 9.609 9.711 406 1HG ARG 50 1HG ARG 50 18.400 8.057 10.469 407 2HG ARG 50 2HG ARG 50 17.858 7.721 8.824 408 1HD ARG 50 1HD ARG 50 19.525 9.573 9.009 409 2HD ARG 50 2HD ARG 50 18.012 10.024 8.224 410 HE ARG 50 HE ARG 50 17.621 10.689 10.831 411 1HH1 ARG 50 1HH1 ARG 50 20.071 11.466 8.470 412 2HH1 ARG 50 2HH1 ARG 50 20.414 13.020 9.153 413 1HH2 ARG 50 1HH2 ARG 50 18.070 12.733 11.730 414 2HH2 ARG 50 2HH2 ARG 50 19.277 13.740 11.004 415 HA PRO 51 HA PRO 51 12.469 8.714 13.537 416 1HB PRO 51 1HB PRO 51 12.462 10.909 15.148 417 2HB PRO 51 2HB PRO 51 13.100 9.340 15.653 418 1HG PRO 51 1HG PRO 51 14.567 11.750 14.652 419 2HG PRO 51 2HG PRO 51 14.975 10.669 15.998 420 1HD PRO 51 1HD PRO 51 16.166 10.482 13.580 421 2HD PRO 51 2HD PRO 51 15.865 9.061 14.602 422 H TRP 52 H TRP 52 11.268 9.222 11.767 423 HA TRP 52 HA TRP 52 10.798 12.079 11.275 424 1HB TRP 52 1HB TRP 52 12.262 10.617 9.531 425 2HB TRP 52 2HB TRP 52 10.644 10.306 8.909 426 HD1 TRP 52 HD1 TRP 52 9.247 13.030 9.075 427 HE1 TRP 52 HE1 TRP 52 10.065 15.060 7.721 428 HE3 TRP 52 HE3 TRP 52 14.070 11.556 8.239 429 HZ2 TRP 52 HZ2 TRP 52 12.442 15.921 6.464 430 HZ3 TRP 52 HZ3 TRP 52 15.551 13.041 6.951 431 HH2 TRP 52 HH2 TRP 52 14.752 15.177 6.082 432 H GLY 53 H GLY 53 9.648 8.766 10.696 433 1HA GLY 53 1HA GLY 53 7.111 9.107 11.742 434 2HA GLY 53 2HA GLY 53 6.987 9.546 10.045 435 H GLY 54 H GLY 54 5.426 7.581 10.520 436 1HA GLY 54 1HA GLY 54 6.072 5.492 8.914 437 2HA GLY 54 2HA GLY 54 6.721 5.002 10.472 438 H GLY 55 H GLY 55 5.010 3.277 9.717 439 1HA GLY 55 1HA GLY 55 2.627 3.832 11.325 440 2HA GLY 55 2HA GLY 55 2.385 3.330 9.658 441 H PHE 56 H PHE 56 1.369 1.898 11.821 442 HA PHE 56 HA PHE 56 2.642 -0.664 11.353 443 1HB PHE 56 1HB PHE 56 2.700 -1.181 13.814 444 2HB PHE 56 2HB PHE 56 3.886 0.009 13.288 445 HD1 PHE 56 HD1 PHE 56 1.253 -0.701 15.561 446 HD2 PHE 56 HD2 PHE 56 3.281 2.480 13.592 447 HE1 PHE 56 HE1 PHE 56 0.415 0.875 17.255 448 HE2 PHE 56 HE2 PHE 56 2.448 4.062 15.283 449 HZ PHE 56 HZ PHE 56 1.013 3.260 17.116 450 H GLY 57 H GLY 57 1.248 -2.389 11.555 451 1HA GLY 57 1HA GLY 57 -1.286 -2.155 12.881 452 2HA GLY 57 2HA GLY 57 -1.435 -2.060 11.134 453 H LEU 58 H LEU 58 -2.677 -3.993 11.176 454 HA LEU 58 HA LEU 58 -1.002 -6.400 11.382 455 1HB LEU 58 1HB LEU 58 -3.810 -6.034 12.417 456 2HB LEU 58 2HB LEU 58 -3.070 -7.607 12.185 457 HG LEU 58 HG LEU 58 -1.186 -6.546 13.733 458 1HD1 LEU 58 1HD1 LEU 58 -3.510 -5.301 15.076 459 2HD1 LEU 58 2HD1 LEU 58 -2.800 -4.426 13.719 460 3HD1 LEU 58 3HD1 LEU 58 -1.804 -4.856 15.108 461 1HD2 LEU 58 1HD2 LEU 58 -3.036 -8.477 14.017 462 2HD2 LEU 58 2HD2 LEU 58 -3.571 -7.356 15.268 463 3HD2 LEU 58 3HD2 LEU 58 -1.927 -7.993 15.300 464 H SER 59 H SER 59 -2.340 -8.326 10.361 465 HA SER 59 HA SER 59 -3.826 -7.437 8.007 466 1HB SER 59 1HB SER 59 -1.154 -8.768 7.978 467 2HB SER 59 2HB SER 59 -2.325 -9.229 6.742 468 HG SER 59 HG SER 59 -2.516 -6.920 6.313 469 H ARG 60 H ARG 60 -5.333 -8.882 7.293 470 HA ARG 60 HA ARG 60 -5.475 -11.456 8.723 471 1HB ARG 60 1HB ARG 60 -7.190 -9.623 9.328 472 2HB ARG 60 2HB ARG 60 -7.900 -9.962 7.756 473 1HG ARG 60 1HG ARG 60 -7.713 -12.461 8.757 474 2HG ARG 60 2HG ARG 60 -7.954 -11.532 10.238 475 1HD ARG 60 1HD ARG 60 -9.699 -11.044 7.860 476 2HD ARG 60 2HD ARG 60 -10.011 -12.423 8.913 477 HE ARG 60 HE ARG 60 -10.481 -9.650 9.501 478 1HH1 ARG 60 1HH1 ARG 60 -9.895 -12.804 10.875 479 2HH1 ARG 60 2HH1 ARG 60 -10.643 -12.421 12.388 480 1HH2 ARG 60 1HH2 ARG 60 -11.466 -9.144 11.491 481 2HH2 ARG 60 2HH2 ARG 60 -11.536 -10.344 12.739 482 H TRP 61 H TRP 61 -6.300 -13.239 7.581 483 HA TRP 61 HA TRP 61 -6.274 -12.906 4.653 484 1HB TRP 61 1HB TRP 61 -4.407 -14.265 5.632 485 2HB TRP 61 2HB TRP 61 -5.612 -15.414 6.207 486 HD1 TRP 61 HD1 TRP 61 -4.151 -14.046 2.910 487 HE1 TRP 61 HE1 TRP 61 -4.526 -15.809 1.072 488 HE3 TRP 61 HE3 TRP 61 -6.969 -17.392 5.557 489 HZ2 TRP 61 HZ2 TRP 61 -5.843 -18.290 0.783 490 HZ3 TRP 61 HZ3 TRP 61 -7.746 -19.434 4.426 491 HH2 TRP 61 HH2 TRP 61 -7.194 -19.873 2.088 492 H ASP 62 H ASP 62 -7.900 -13.776 3.443 493 HA ASP 62 HA ASP 62 -10.162 -14.912 4.948 494 1HB ASP 62 1HB ASP 62 -10.328 -12.666 3.604 495 2HB ASP 62 2HB ASP 62 -10.460 -13.734 2.209 496 HD2 ASP 62 HD2 ASP 62 -13.484 -13.554 4.755 497 H GLU 63 H GLU 63 -11.051 -16.817 4.344 498 HA GLU 63 HA GLU 63 -9.541 -18.684 2.930 499 1HB GLU 63 1HB GLU 63 -11.395 -19.109 4.617 500 2HB GLU 63 2HB GLU 63 -12.528 -18.846 3.299 501 1HG GLU 63 1HG GLU 63 -12.369 -21.070 3.074 502 2HG GLU 63 2HG GLU 63 -10.917 -20.666 2.160 503 HE2 GLU 63 HE2 GLU 63 -9.998 -21.644 5.869 504 H LYS 64 H LYS 64 -11.682 -16.263 1.759 505 HA LYS 64 HA LYS 64 -12.069 -17.596 -0.803 506 1HB LYS 64 1HB LYS 64 -13.273 -15.287 0.594 507 2HB LYS 64 2HB LYS 64 -13.154 -15.138 -1.154 508 1HG LYS 64 1HG LYS 64 -14.169 -17.628 -0.950 509 2HG LYS 64 2HG LYS 64 -14.863 -16.877 0.487 510 1HD LYS 64 1HD LYS 64 -15.008 -15.205 -1.911 511 2HD LYS 64 2HD LYS 64 -15.901 -16.722 -2.042 512 1HE LYS 64 1HE LYS 64 -17.540 -15.553 -1.035 513 2HE LYS 64 2HE LYS 64 -16.638 -15.929 0.433 514 1HZ LYS 64 1HZ LYS 64 -17.323 -13.465 -0.271 515 2HZ LYS 64 2HZ LYS 64 -15.803 -13.545 -1.007 516 3HZ LYS 64 3HZ LYS 64 -15.951 -13.809 0.657 517 H GLY 65 H GLY 65 -9.387 -16.667 0.131 518 1HA GLY 65 1HA GLY 65 -7.518 -15.798 -0.880 519 2HA GLY 65 2HA GLY 65 -8.477 -15.624 -2.341 520 H ASN 66 H ASN 66 -8.483 -14.130 0.901 521 HA ASN 66 HA ASN 66 -8.283 -11.509 -0.416 522 1HB ASN 66 1HB ASN 66 -10.613 -12.416 0.716 523 2HB ASN 66 2HB ASN 66 -9.886 -11.520 2.046 524 1HD2 ASN 66 1HD2 ASN 66 -12.237 -11.027 0.255 525 2HD2 ASN 66 2HD2 ASN 66 -11.995 -9.426 -0.347 526 H TRP 67 H TRP 67 -7.420 -9.811 0.928 527 HA TRP 67 HA TRP 67 -6.048 -10.694 3.359 528 1HB TRP 67 1HB TRP 67 -4.620 -10.735 1.124 529 2HB TRP 67 2HB TRP 67 -4.498 -9.008 1.444 530 HD1 TRP 67 HD1 TRP 67 -4.150 -12.115 3.766 531 HE1 TRP 67 HE1 TRP 67 -1.978 -11.841 5.118 532 HE3 TRP 67 HE3 TRP 67 -2.523 -7.684 1.801 533 HZ2 TRP 67 HZ2 TRP 67 0.145 -9.991 5.325 534 HZ3 TRP 67 HZ3 TRP 67 -0.413 -6.730 2.632 535 HH2 TRP 67 HH2 TRP 67 0.892 -7.861 4.358 536 H HIS 68 H HIS 68 -7.142 -9.403 4.743 537 HA HIS 68 HA HIS 68 -7.930 -6.740 4.165 538 1HB HIS 68 1HB HIS 68 -7.645 -8.139 6.833 539 2HB HIS 68 2HB HIS 68 -8.473 -6.608 6.572 540 HD1 HIS 68 HD1 HIS 68 -10.802 -6.691 5.475 541 HD2 HIS 68 HD2 HIS 68 -9.043 -10.422 5.983 542 HE1 HIS 68 HE1 HIS 68 -12.637 -8.361 5.064 543 HE2 HIS 68 HE2 HIS 68 -11.571 -10.608 5.474 544 H GLY 69 H GLY 69 -6.800 -4.911 4.241 545 1HA GLY 69 1HA GLY 69 -4.133 -4.995 5.493 546 2HA GLY 69 2HA GLY 69 -4.602 -3.917 4.186 547 H LEU 70 H LEU 70 -4.146 -4.204 7.496 548 HA LEU 70 HA LEU 70 -5.576 -1.670 7.958 549 1HB LEU 70 1HB LEU 70 -5.146 -3.891 9.956 550 2HB LEU 70 2HB LEU 70 -5.962 -2.371 10.266 551 HG LEU 70 HG LEU 70 -7.582 -3.122 8.380 552 1HD1 LEU 70 1HD1 LEU 70 -7.699 -5.770 8.731 553 2HD1 LEU 70 2HD1 LEU 70 -5.954 -5.540 8.854 554 3HD1 LEU 70 3HD1 LEU 70 -6.812 -5.012 7.407 555 1HD2 LEU 70 1HD2 LEU 70 -8.943 -4.347 10.023 556 2HD2 LEU 70 2HD2 LEU 70 -8.236 -2.881 10.701 557 3HD2 LEU 70 3HD2 LEU 70 -7.539 -4.455 11.085 558 H TYR 71 H TYR 71 -4.243 -0.047 8.378 559 HA TYR 71 HA TYR 71 -1.967 -0.426 10.131 560 1HB TYR 71 1HB TYR 71 -0.362 0.577 8.533 561 2HB TYR 71 2HB TYR 71 -0.975 -0.979 7.982 562 HD1 TYR 71 HD1 TYR 71 -1.768 -1.170 5.812 563 HD2 TYR 71 HD2 TYR 71 -1.637 2.677 7.624 564 HE1 TYR 71 HE1 TYR 71 -2.450 -0.151 3.681 565 HE2 TYR 71 HE2 TYR 71 -2.320 3.707 5.498 566 HH TYR 71 HH TYR 71 -2.133 2.255 2.606 567 H ALA 72 H ALA 72 -0.985 1.608 10.784 568 HA ALA 72 HA ALA 72 -2.552 4.003 10.177 569 1HB ALA 72 1HB ALA 72 -3.688 3.558 12.102 570 2HB ALA 72 2HB ALA 72 -2.318 4.438 12.778 571 3HB ALA 72 3HB ALA 72 -2.343 2.675 12.824 572 H MET 73 H MET 73 -1.070 5.345 9.386 573 HA MET 73 HA MET 73 1.643 5.323 10.461 574 1HB MET 73 1HB MET 73 0.554 6.926 8.144 575 2HB MET 73 2HB MET 73 2.245 6.665 8.547 576 1HG MET 73 1HG MET 73 2.238 4.944 7.163 577 2HG MET 73 2HG MET 73 1.166 4.112 8.288 578 1HE MET 73 1HE MET 73 0.890 4.626 4.260 579 2HE MET 73 2HE MET 73 1.923 5.672 5.235 580 3HE MET 73 3HE MET 73 0.454 6.317 4.504 581 H ALA 74 H ALA 74 2.706 7.534 10.677 582 HA ALA 74 HA ALA 74 0.981 9.708 11.465 583 1HB ALA 74 1HB ALA 74 2.793 8.922 13.661 584 2HB ALA 74 2HB ALA 74 1.367 7.913 13.420 585 3HB ALA 74 3HB ALA 74 1.184 9.641 13.717 586 H PHE 75 H PHE 75 1.994 11.647 11.335 587 HA PHE 75 HA PHE 75 4.857 11.586 10.659 588 1HB PHE 75 1HB PHE 75 2.667 13.519 9.891 589 2HB PHE 75 2HB PHE 75 4.373 13.832 9.594 590 HD1 PHE 75 HD1 PHE 75 5.219 13.276 7.537 591 HD2 PHE 75 HD2 PHE 75 1.843 11.151 9.019 592 HE1 PHE 75 HE1 PHE 75 5.078 12.029 5.420 593 HE2 PHE 75 HE2 PHE 75 1.697 9.900 6.905 594 HZ PHE 75 HZ PHE 75 3.316 10.338 5.103 595 H LYS 76 H LYS 76 6.031 12.033 12.415 596 HA LYS 76 HA LYS 76 5.100 14.139 14.239 597 1HB LYS 76 1HB LYS 76 5.597 11.869 15.179 598 2HB LYS 76 2HB LYS 76 7.277 12.096 14.709 599 1HG LYS 76 1HG LYS 76 6.122 14.256 16.336 600 2HG LYS 76 2HG LYS 76 6.284 12.694 17.142 601 1HD LYS 76 1HD LYS 76 8.690 12.784 16.044 602 2HD LYS 76 2HD LYS 76 8.382 14.522 16.087 603 1HE LYS 76 1HE LYS 76 9.564 13.739 18.094 604 2HE LYS 76 2HE LYS 76 7.984 14.421 18.476 605 1HZ LYS 76 1HZ LYS 76 8.312 11.516 18.079 606 2HZ LYS 76 2HZ LYS 76 7.107 12.343 18.931 607 3HZ LYS 76 3HZ LYS 76 8.668 12.226 19.573 608 H ASP 77 H ASP 77 5.804 16.003 13.300 609 HA ASP 77 HA ASP 77 8.675 16.208 12.689 610 1HB ASP 77 1HB ASP 77 6.286 17.743 11.679 611 2HB ASP 77 2HB ASP 77 7.930 18.341 11.474 612 HD2 ASP 77 HD2 ASP 77 6.865 16.205 8.648 613 H SER 78 H SER 78 9.886 17.929 13.499 614 HA SER 78 HA SER 78 8.840 19.053 15.978 615 1HB SER 78 1HB SER 78 11.636 19.559 15.056 616 2HB SER 78 2HB SER 78 11.024 19.274 16.686 617 HG SER 78 HG SER 78 12.268 17.518 15.664 618 H TRP 79 H TRP 79 9.838 20.031 12.782 619 HA TRP 79 HA TRP 79 9.368 22.846 13.504 620 1HB TRP 79 1HB TRP 79 11.597 21.962 12.403 621 2HB TRP 79 2HB TRP 79 10.651 22.056 10.921 622 HD1 TRP 79 HD1 TRP 79 11.400 24.188 9.720 623 HE1 TRP 79 HE1 TRP 79 11.767 26.646 10.385 624 HE3 TRP 79 HE3 TRP 79 10.605 23.794 14.755 625 HZ2 TRP 79 HZ2 TRP 79 11.726 28.211 12.733 626 HZ3 TRP 79 HZ3 TRP 79 10.787 25.819 16.140 627 HH2 TRP 79 HH2 TRP 79 11.337 27.982 15.148 628 H ASN 80 H ASN 80 7.215 21.033 13.047 629 HA ASN 80 HA ASN 80 5.844 22.498 10.975 630 1HB ASN 80 1HB ASN 80 6.667 19.656 10.618 631 2HB ASN 80 2HB ASN 80 5.068 20.125 10.048 632 1HD2 ASN 80 1HD2 ASN 80 7.850 19.462 8.846 633 2HD2 ASN 80 2HD2 ASN 80 8.031 20.668 7.624 634 H LYS 81 H LYS 81 5.074 19.257 12.172 635 HA LYS 81 HA LYS 81 3.529 19.913 14.376 636 1HB LYS 81 1HB LYS 81 2.298 20.842 12.044 637 2HB LYS 81 2HB LYS 81 1.436 19.361 12.443 638 1HG LYS 81 1HG LYS 81 0.464 20.261 14.253 639 2HG LYS 81 2HG LYS 81 1.911 21.160 14.712 640 1HD LYS 81 1HD LYS 81 0.719 22.956 14.069 641 2HD LYS 81 2HD LYS 81 1.188 22.460 12.441 642 1HE LYS 81 1HE LYS 81 -1.039 22.546 12.081 643 2HE LYS 81 2HE LYS 81 -0.991 20.927 12.775 644 1HZ LYS 81 1HZ LYS 81 -2.645 21.938 13.987 645 2HZ LYS 81 2HZ LYS 81 -1.879 23.446 14.008 646 3HZ LYS 81 3HZ LYS 81 -1.305 22.194 14.990 647 H TRP 82 H TRP 82 2.077 18.144 15.056 648 HA TRP 82 HA TRP 82 2.893 15.588 13.837 649 1HB TRP 82 1HB TRP 82 2.598 14.585 16.076 650 2HB TRP 82 2HB TRP 82 3.818 15.856 16.076 651 HD1 TRP 82 HD1 TRP 82 0.428 14.962 17.531 652 HE1 TRP 82 HE1 TRP 82 -0.208 16.707 19.313 653 HE3 TRP 82 HE3 TRP 82 4.137 18.378 16.684 654 HZ2 TRP 82 HZ2 TRP 82 0.736 19.202 20.237 655 HZ3 TRP 82 HZ3 TRP 82 4.199 20.417 18.061 656 HH2 TRP 82 HH2 TRP 82 2.532 20.819 19.800 657 H GLU 83 H GLU 83 1.317 14.483 12.886 658 HA GLU 83 HA GLU 83 -1.379 14.565 14.012 659 1HB GLU 83 1HB GLU 83 -0.653 15.292 11.181 660 2HB GLU 83 2HB GLU 83 -2.268 14.755 11.621 661 1HG GLU 83 1HG GLU 83 -1.247 16.892 13.322 662 2HG GLU 83 2HG GLU 83 -1.388 17.340 11.623 663 HE2 GLU 83 HE2 GLU 83 -4.638 17.046 13.762 664 HA PRO 84 HA PRO 84 -0.799 10.240 13.003 665 1HB PRO 84 1HB PRO 84 -2.900 9.267 14.333 666 2HB PRO 84 2HB PRO 84 -1.501 9.924 15.191 667 1HG PRO 84 1HG PRO 84 -4.159 11.185 14.654 668 2HG PRO 84 2HG PRO 84 -3.172 11.234 16.126 669 1HD PRO 84 1HD PRO 84 -3.269 13.241 14.226 670 2HD PRO 84 2HD PRO 84 -1.936 12.996 15.371 671 H ILE 85 H ILE 85 -2.038 8.508 11.944 672 HA ILE 85 HA ILE 85 -4.495 9.212 10.597 673 HB ILE 85 HB ILE 85 -3.616 8.790 8.328 674 1HG1 ILE 85 1HG1 ILE 85 -0.874 9.083 9.563 675 2HG1 ILE 85 2HG1 ILE 85 -1.583 7.527 9.139 676 1HG2 ILE 85 1HG2 ILE 85 -3.856 11.089 9.376 677 2HG2 ILE 85 2HG2 ILE 85 -2.806 10.969 7.964 678 3HG2 ILE 85 3HG2 ILE 85 -2.104 11.065 9.578 679 1HD1 ILE 85 1HD1 ILE 85 -0.904 7.752 7.051 680 2HD1 ILE 85 2HD1 ILE 85 -0.100 9.255 7.506 681 3HD1 ILE 85 3HD1 ILE 85 -1.755 9.289 6.900 682 H ALA 86 H ALA 86 -5.662 7.441 9.986 683 HA ALA 86 HA ALA 86 -4.351 4.818 10.050 684 1HB ALA 86 1HB ALA 86 -6.432 3.990 11.307 685 2HB ALA 86 2HB ALA 86 -6.677 5.684 11.731 686 3HB ALA 86 3HB ALA 86 -5.199 4.859 12.222 687 H GLY 87 H GLY 87 -5.182 3.319 8.644 688 1HA GLY 87 1HA GLY 87 -7.701 3.892 7.281 689 2HA GLY 87 2HA GLY 87 -6.253 3.868 6.287 690 H TYR 88 H TYR 88 -8.325 2.151 5.761 691 HA TYR 88 HA TYR 88 -7.035 -0.421 6.254 692 1HB TYR 88 1HB TYR 88 -10.015 -0.139 6.612 693 2HB TYR 88 2HB TYR 88 -8.997 -1.518 7.015 694 HD1 TYR 88 HD1 TYR 88 -10.510 1.479 8.224 695 HD2 TYR 88 HD2 TYR 88 -7.285 -1.211 8.899 696 HE1 TYR 88 HE1 TYR 88 -10.298 2.319 10.526 697 HE2 TYR 88 HE2 TYR 88 -7.064 -0.380 11.202 698 HH TYR 88 HH TYR 88 -7.890 2.187 12.319 699 H GLY 89 H GLY 89 -7.583 -2.051 4.719 700 1HA GLY 89 1HA GLY 89 -9.374 -1.479 2.549 701 2HA GLY 89 2HA GLY 89 -7.686 -1.298 2.094 702 H TRP 90 H TRP 90 -8.155 -3.031 0.568 703 HA TRP 90 HA TRP 90 -7.665 -5.634 1.801 704 1HB TRP 90 1HB TRP 90 -9.748 -5.310 -0.361 705 2HB TRP 90 2HB TRP 90 -9.379 -6.757 0.571 706 HD1 TRP 90 HD1 TRP 90 -9.721 -6.141 3.443 707 HE1 TRP 90 HE1 TRP 90 -11.868 -5.162 4.471 708 HE3 TRP 90 HE3 TRP 90 -11.765 -4.076 -0.764 709 HZ2 TRP 90 HZ2 TRP 90 -14.129 -3.706 3.612 710 HZ3 TRP 90 HZ3 TRP 90 -13.923 -2.908 -0.575 711 HH2 TRP 90 HH2 TRP 90 -15.079 -2.728 1.568 712 H GLU 91 H GLU 91 -6.606 -7.128 0.447 713 HA GLU 91 HA GLU 91 -5.823 -6.241 -2.217 714 1HB GLU 91 1HB GLU 91 -3.950 -6.587 0.096 715 2HB GLU 91 2HB GLU 91 -3.397 -6.941 -1.534 716 1HG GLU 91 1HG GLU 91 -3.522 -4.751 -2.204 717 2HG GLU 91 2HG GLU 91 -4.731 -4.337 -0.989 718 HE2 GLU 91 HE2 GLU 91 -2.280 -3.748 1.423 719 H SER 92 H SER 92 -5.216 -7.902 -3.596 720 HA SER 92 HA SER 92 -5.739 -10.606 -2.563 721 1HB SER 92 1HB SER 92 -6.279 -11.208 -4.895 722 2HB SER 92 2HB SER 92 -7.286 -9.880 -4.320 723 HG SER 92 HG SER 92 -5.898 -8.448 -5.431 724 H THR 93 H THR 93 -4.038 -11.883 -2.316 725 HA THR 93 HA THR 93 -1.565 -11.263 -3.757 726 HB THR 93 HB THR 93 -0.542 -12.880 -2.116 727 HG1 THR 93 HG1 THR 93 -1.769 -13.576 -0.421 728 1HG2 THR 93 1HG2 THR 93 -1.968 -10.861 -0.477 729 2HG2 THR 93 2HG2 THR 93 -0.893 -10.302 -1.759 730 3HG2 THR 93 3HG2 THR 93 -0.269 -11.334 -0.473 731 H TRP 94 H TRP 94 -0.543 -12.700 -5.090 732 HA TRP 94 HA TRP 94 -1.560 -15.397 -5.400 733 1HB TRP 94 1HB TRP 94 -1.897 -15.102 -7.863 734 2HB TRP 94 2HB TRP 94 -3.071 -14.240 -6.873 735 HD1 TRP 94 HD1 TRP 94 -2.814 -11.536 -6.758 736 HE1 TRP 94 HE1 TRP 94 -1.783 -9.877 -8.435 737 HE3 TRP 94 HE3 TRP 94 -0.075 -14.816 -9.565 738 HZ2 TRP 94 HZ2 TRP 94 -0.041 -9.951 -10.655 739 HZ3 TRP 94 HZ3 TRP 94 1.246 -13.941 -11.448 740 HH2 TRP 94 HH2 TRP 94 1.261 -11.558 -11.981 741 H ARG 95 H ARG 95 -0.097 -16.794 -6.355 742 HA ARG 95 HA ARG 95 2.597 -15.692 -6.693 743 1HB ARG 95 1HB ARG 95 1.521 -18.374 -5.924 744 2HB ARG 95 2HB ARG 95 3.120 -18.275 -6.649 745 1HG ARG 95 1HG ARG 95 3.526 -18.222 -4.361 746 2HG ARG 95 2HG ARG 95 3.628 -16.529 -4.851 747 1HD ARG 95 1HD ARG 95 2.291 -16.326 -3.008 748 2HD ARG 95 2HD ARG 95 1.062 -16.556 -4.251 749 HE ARG 95 HE ARG 95 0.502 -18.536 -3.264 750 1HH1 ARG 95 1HH1 ARG 95 3.674 -17.601 -2.148 751 2HH1 ARG 95 2HH1 ARG 95 3.780 -18.882 -0.987 752 1HH2 ARG 95 1HH2 ARG 95 0.639 -20.220 -1.738 753 2HH2 ARG 95 2HH2 ARG 95 2.057 -20.369 -0.754 754 HA PRO 96 HA PRO 96 2.577 -16.158 -11.089 755 1HB PRO 96 1HB PRO 96 5.361 -17.149 -10.765 756 2HB PRO 96 2HB PRO 96 4.747 -15.816 -11.750 757 1HG PRO 96 1HG PRO 96 6.090 -15.341 -9.497 758 2HG PRO 96 2HG PRO 96 4.701 -14.340 -9.965 759 1HD PRO 96 1HD PRO 96 4.875 -16.507 -7.914 760 2HD PRO 96 2HD PRO 96 3.974 -14.977 -7.868 761 H LEU 97 H LEU 97 3.921 -17.923 -12.641 762 HA LEU 97 HA LEU 97 2.864 -20.527 -11.758 763 1HB LEU 97 1HB LEU 97 2.051 -19.174 -13.916 764 2HB LEU 97 2HB LEU 97 3.418 -20.009 -14.629 765 HG LEU 97 HG LEU 97 1.371 -21.563 -13.093 766 1HD1 LEU 97 1HD1 LEU 97 1.012 -21.329 -16.015 767 2HD1 LEU 97 2HD1 LEU 97 0.492 -19.954 -15.042 768 3HD1 LEU 97 3HD1 LEU 97 -0.181 -21.555 -14.735 769 1HD2 LEU 97 1HD2 LEU 97 2.041 -23.223 -14.930 770 2HD2 LEU 97 2HD2 LEU 97 3.221 -22.868 -13.667 771 3HD2 LEU 97 3HD2 LEU 97 3.376 -22.116 -15.255 772 H ALA 98 H ALA 98 5.508 -19.467 -11.147 773 HA ALA 98 HA ALA 98 7.082 -21.643 -12.317 774 1HB ALA 98 1HB ALA 98 7.402 -19.179 -13.320 775 2HB ALA 98 2HB ALA 98 8.717 -20.347 -13.191 776 3HB ALA 98 3HB ALA 98 8.528 -19.093 -11.966 777 H ASP 99 H ASP 99 7.403 -18.909 -10.042 778 HA ASP 99 HA ASP 99 8.728 -20.735 -8.159 779 1HB ASP 99 1HB ASP 99 9.583 -18.315 -9.022 780 2HB ASP 99 2HB ASP 99 8.689 -17.832 -7.584 781 HD2 ASP 99 HD2 ASP 99 11.989 -19.980 -7.111 782 H GLU 100 H GLU 100 7.771 -21.302 -6.311 783 HA GLU 100 HA GLU 100 5.188 -20.068 -5.669 784 1HB GLU 100 1HB GLU 100 4.856 -22.090 -4.240 785 2HB GLU 100 2HB GLU 100 5.061 -22.450 -5.949 786 1HG GLU 100 1HG GLU 100 6.948 -23.602 -5.613 787 2HG GLU 100 2HG GLU 100 7.545 -22.470 -4.401 788 HE2 GLU 100 HE2 GLU 100 6.502 -25.749 -2.964 789 H ASN 101 H ASN 101 7.582 -18.674 -5.022 790 HA ASN 101 HA ASN 101 7.403 -18.714 -2.083 791 1HB ASN 101 1HB ASN 101 9.854 -18.425 -3.816 792 2HB ASN 101 2HB ASN 101 9.826 -17.891 -2.138 793 1HD2 ASN 101 1HD2 ASN 101 10.804 -20.303 -4.025 794 2HD2 ASN 101 2HD2 ASN 101 10.693 -21.634 -2.929 795 H PHE 102 H PHE 102 8.224 -16.771 -4.939 796 HA PHE 102 HA PHE 102 8.177 -14.278 -3.590 797 1HB PHE 102 1HB PHE 102 8.072 -15.099 -6.477 798 2HB PHE 102 2HB PHE 102 7.842 -13.414 -6.019 799 HD1 PHE 102 HD1 PHE 102 10.216 -16.193 -6.180 800 HD2 PHE 102 HD2 PHE 102 9.665 -12.100 -5.156 801 HE1 PHE 102 HE1 PHE 102 12.656 -15.890 -6.097 802 HE2 PHE 102 HE2 PHE 102 12.104 -11.788 -5.072 803 HZ PHE 102 HZ PHE 102 13.603 -13.685 -5.542 804 H HIS 103 H HIS 103 6.544 -12.936 -3.106 805 HA HIS 103 HA HIS 103 3.831 -13.817 -3.771 806 1HB HIS 103 1HB HIS 103 4.800 -11.808 -1.725 807 2HB HIS 103 2HB HIS 103 3.120 -12.275 -1.969 808 HD1 HIS 103 HD1 HIS 103 6.208 -13.278 -0.249 809 HD2 HIS 103 HD2 HIS 103 2.547 -14.995 -1.206 810 HE1 HIS 103 HE1 HIS 103 6.028 -15.328 1.198 811 HE2 HIS 103 HE2 HIS 103 3.840 -16.392 0.544 812 H LEU 104 H LEU 104 2.456 -12.637 -4.986 813 HA LEU 104 HA LEU 104 3.121 -9.881 -5.666 814 1HB LEU 104 1HB LEU 104 3.544 -12.110 -7.431 815 2HB LEU 104 2HB LEU 104 2.307 -11.060 -8.096 816 HG LEU 104 HG LEU 104 5.071 -10.166 -7.270 817 1HD1 LEU 104 1HD1 LEU 104 5.521 -11.347 -9.177 818 2HD1 LEU 104 2HD1 LEU 104 5.103 -9.778 -9.867 819 3HD1 LEU 104 3HD1 LEU 104 3.915 -11.081 -9.856 820 1HD2 LEU 104 1HD2 LEU 104 3.103 -8.523 -7.160 821 2HD2 LEU 104 2HD2 LEU 104 3.094 -8.630 -8.921 822 3HD2 LEU 104 3HD2 LEU 104 4.530 -8.045 -8.080 823 H GLY 105 H GLY 105 1.345 -8.715 -5.379 824 1HA GLY 105 1HA GLY 105 -1.211 -9.690 -6.375 825 2HA GLY 105 2HA GLY 105 -1.116 -9.425 -4.641 826 H LEU 106 H LEU 106 -2.986 -8.017 -5.835 827 HA LEU 106 HA LEU 106 -1.949 -5.293 -5.706 828 1HB LEU 106 1HB LEU 106 -3.492 -6.431 -8.028 829 2HB LEU 106 2HB LEU 106 -3.427 -4.710 -7.699 830 HG LEU 106 HG LEU 106 -0.842 -6.163 -7.923 831 1HD1 LEU 106 1HD1 LEU 106 -2.654 -5.537 -10.242 832 2HD1 LEU 106 2HD1 LEU 106 -1.945 -7.093 -9.810 833 3HD1 LEU 106 3HD1 LEU 106 -0.916 -5.788 -10.401 834 1HD2 LEU 106 1HD2 LEU 106 -0.041 -4.091 -8.689 835 2HD2 LEU 106 2HD2 LEU 106 -1.159 -3.699 -7.382 836 3HD2 LEU 106 3HD2 LEU 106 -1.664 -3.507 -9.061 837 H GLY 107 H GLY 107 -3.600 -3.692 -5.305 838 1HA GLY 107 1HA GLY 107 -6.321 -4.310 -4.929 839 2HA GLY 107 2HA GLY 107 -5.486 -4.490 -3.394 840 H PHE 108 H PHE 108 -6.934 -2.756 -2.702 841 HA PHE 108 HA PHE 108 -5.748 -0.138 -3.294 842 1HB PHE 108 1HB PHE 108 -8.724 -0.603 -3.036 843 2HB PHE 108 2HB PHE 108 -7.921 0.921 -3.398 844 HD1 PHE 108 HD1 PHE 108 -9.184 -2.186 -4.730 845 HD2 PHE 108 HD2 PHE 108 -6.792 1.228 -5.584 846 HE1 PHE 108 HE1 PHE 108 -9.353 -2.675 -7.135 847 HE2 PHE 108 HE2 PHE 108 -6.956 0.745 -7.992 848 HZ PHE 108 HZ PHE 108 -8.238 -1.209 -8.769 849 H THR 109 H THR 109 -5.763 1.339 -1.591 850 HA THR 109 HA THR 109 -6.661 0.279 1.007 851 HB THR 109 HB THR 109 -4.673 1.398 2.023 852 HG1 THR 109 HG1 THR 109 -3.038 2.099 0.684 853 1HG2 THR 109 1HG2 THR 109 -4.749 -1.070 1.024 854 2HG2 THR 109 2HG2 THR 109 -3.313 -0.382 1.784 855 3HG2 THR 109 3HG2 THR 109 -3.457 -0.402 0.027 856 H ALA 110 H ALA 110 -7.694 1.676 2.346 857 HA ALA 110 HA ALA 110 -8.125 4.402 1.317 858 1HB ALA 110 1HB ALA 110 -9.909 2.421 2.593 859 2HB ALA 110 2HB ALA 110 -10.250 3.623 1.348 860 3HB ALA 110 3HB ALA 110 -10.153 4.109 3.041 861 H GLY 111 H GLY 111 -7.509 6.096 2.510 862 1HA GLY 111 1HA GLY 111 -6.569 5.552 5.255 863 2HA GLY 111 2HA GLY 111 -5.915 6.800 4.206 864 H VAL 112 H VAL 112 -7.230 6.778 6.948 865 HA VAL 112 HA VAL 112 -9.264 8.834 6.374 866 HB VAL 112 HB VAL 112 -9.139 7.093 8.839 867 1HG1 VAL 112 1HG1 VAL 112 -11.565 7.959 8.979 868 2HG1 VAL 112 2HG1 VAL 112 -11.017 9.216 7.870 869 3HG1 VAL 112 3HG1 VAL 112 -10.254 9.040 9.450 870 1HG2 VAL 112 1HG2 VAL 112 -9.831 6.198 6.369 871 2HG2 VAL 112 2HG2 VAL 112 -11.387 6.761 6.979 872 3HG2 VAL 112 3HG2 VAL 112 -10.470 5.555 7.881 873 H THR 113 H THR 113 -8.779 10.820 7.026 874 HA THR 113 HA THR 113 -6.717 11.148 9.106 875 HB THR 113 HB THR 113 -7.412 13.077 6.883 876 HG1 THR 113 HG1 THR 113 -5.253 11.257 7.132 877 1HG2 THR 113 1HG2 THR 113 -6.131 14.558 7.895 878 2HG2 THR 113 2HG2 THR 113 -4.788 13.415 7.892 879 3HG2 THR 113 3HG2 THR 113 -5.914 13.450 9.249 880 H ALA 114 H ALA 114 -7.168 12.358 10.858 881 HA ALA 114 HA ALA 114 -9.902 13.342 11.132 882 1HB ALA 114 1HB ALA 114 -8.431 11.887 12.831 883 2HB ALA 114 2HB ALA 114 -9.715 12.975 13.357 884 3HB ALA 114 3HB ALA 114 -8.034 13.503 13.415 885 H ARG 115 H ARG 115 -10.426 15.446 11.709 886 HA ARG 115 HA ARG 115 -8.249 17.416 11.691 887 1HB ARG 115 1HB ARG 115 -9.516 18.881 10.214 888 2HB ARG 115 2HB ARG 115 -9.219 17.335 9.431 889 1HG ARG 115 1HG ARG 115 -11.463 16.633 9.784 890 2HG ARG 115 2HG ARG 115 -11.790 18.014 10.833 891 1HD ARG 115 1HD ARG 115 -11.418 19.521 8.919 892 2HD ARG 115 2HD ARG 115 -11.167 18.117 7.883 893 HE ARG 115 HE ARG 115 -13.681 18.091 9.276 894 1HH1 ARG 115 1HH1 ARG 115 -11.999 19.207 6.429 895 2HH1 ARG 115 2HH1 ARG 115 -13.441 19.349 5.480 896 1HH2 ARG 115 1HH2 ARG 115 -15.578 18.277 8.030 897 2HH2 ARG 115 2HH2 ARG 115 -15.472 18.822 6.389 898 H ASP 116 H ASP 116 -8.467 19.043 13.129 899 HA ASP 116 HA ASP 116 -9.259 20.236 14.896 900 1HB ASP 116 1HB ASP 116 -11.997 19.661 13.749 901 2HB ASP 116 2HB ASP 116 -11.557 20.979 14.831 902 HD2 ASP 116 HD2 ASP 116 -9.695 22.407 12.048 903 H ASN 117 H ASN 117 -10.948 20.111 16.783 904 HA ASN 117 HA ASN 117 -11.038 17.298 17.649 905 1HB ASN 117 1HB ASN 117 -10.398 19.835 19.063 906 2HB ASN 117 2HB ASN 117 -11.258 18.600 19.978 907 1HD2 ASN 117 1HD2 ASN 117 -9.645 18.008 21.326 908 2HD2 ASN 117 2HD2 ASN 117 -8.172 17.270 20.809 909 H TRP 118 H TRP 118 -12.815 20.336 17.546 910 HA TRP 118 HA TRP 118 -15.128 19.349 18.887 911 1HB TRP 118 1HB TRP 118 -14.348 21.826 17.481 912 2HB TRP 118 2HB TRP 118 -16.070 21.458 17.457 913 HD1 TRP 118 HD1 TRP 118 -13.700 23.324 19.436 914 HE1 TRP 118 HE1 TRP 118 -14.551 23.716 21.833 915 HE3 TRP 118 HE3 TRP 118 -17.485 19.888 19.528 916 HZ2 TRP 118 HZ2 TRP 118 -16.561 22.704 23.537 917 HZ3 TRP 118 HZ3 TRP 118 -18.823 19.661 21.580 918 HH2 TRP 118 HH2 TRP 118 -18.369 21.041 23.543 919 H ASN 119 H ASN 119 -14.112 19.554 15.531 920 HA ASN 119 HA ASN 119 -16.624 18.256 14.717 921 1HB ASN 119 1HB ASN 119 -15.569 20.508 13.676 922 2HB ASN 119 2HB ASN 119 -14.782 19.314 12.650 923 1HD2 ASN 119 1HD2 ASN 119 -16.860 21.340 12.089 924 2HD2 ASN 119 2HD2 ASN 119 -18.168 20.464 11.378 925 H TYR 120 H TYR 120 -16.250 16.113 14.950 926 HA TYR 120 HA TYR 120 -13.738 14.944 14.098 927 1HB TYR 120 1HB TYR 120 -16.207 13.893 15.445 928 2HB TYR 120 2HB TYR 120 -15.034 12.780 14.748 929 HD1 TYR 120 HD1 TYR 120 -15.717 15.124 17.451 930 HD2 TYR 120 HD2 TYR 120 -12.766 12.624 15.681 931 HE1 TYR 120 HE1 TYR 120 -14.364 15.283 19.498 932 HE2 TYR 120 HE2 TYR 120 -11.405 12.774 17.723 933 HH TYR 120 HH TYR 120 -11.329 14.753 19.743 934 H ILE 121 H ILE 121 -13.789 15.374 11.858 935 HA ILE 121 HA ILE 121 -15.731 13.741 10.356 936 HB ILE 121 HB ILE 121 -14.328 16.194 9.306 937 1HG1 ILE 121 1HG1 ILE 121 -15.851 16.784 11.160 938 2HG1 ILE 121 2HG1 ILE 121 -16.436 17.388 9.614 939 1HG2 ILE 121 1HG2 ILE 121 -16.477 14.387 8.251 940 2HG2 ILE 121 2HG2 ILE 121 -14.950 14.844 7.499 941 3HG2 ILE 121 3HG2 ILE 121 -16.253 16.024 7.636 942 1HD1 ILE 121 1HD1 ILE 121 -17.899 15.986 11.450 943 2HD1 ILE 121 2HD1 ILE 121 -17.467 14.750 10.268 944 3HD1 ILE 121 3HD1 ILE 121 -18.314 16.207 9.750 945 HA PRO 122 HA PRO 122 -11.811 11.652 9.399 946 1HB PRO 122 1HB PRO 122 -12.971 9.483 8.230 947 2HB PRO 122 2HB PRO 122 -12.788 9.659 9.979 948 1HG PRO 122 1HG PRO 122 -15.184 10.178 8.262 949 2HG PRO 122 2HG PRO 122 -15.091 9.374 9.840 950 1HD PRO 122 1HD PRO 122 -15.895 11.938 9.573 951 2HD PRO 122 2HD PRO 122 -14.990 11.372 10.992 952 H LEU 123 H LEU 123 -10.607 11.588 7.558 953 HA LEU 123 HA LEU 123 -11.939 12.472 5.089 954 1HB LEU 123 1HB LEU 123 -9.896 13.675 6.358 955 2HB LEU 123 2HB LEU 123 -8.989 12.592 5.321 956 HG LEU 123 HG LEU 123 -11.119 14.307 4.116 957 1HD1 LEU 123 1HD1 LEU 123 -9.295 15.520 5.674 958 2HD1 LEU 123 2HD1 LEU 123 -9.951 16.233 4.201 959 3HD1 LEU 123 3HD1 LEU 123 -8.389 15.416 4.164 960 1HD2 LEU 123 1HD2 LEU 123 -10.297 12.992 2.459 961 2HD2 LEU 123 2HD2 LEU 123 -8.728 12.795 3.241 962 3HD2 LEU 123 3HD2 LEU 123 -9.102 14.288 2.378 963 HA PRO 124 HA PRO 124 -10.714 8.143 4.125 964 1HB PRO 124 1HB PRO 124 -12.839 7.604 2.547 965 2HB PRO 124 2HB PRO 124 -12.917 7.493 4.309 966 1HG PRO 124 1HG PRO 124 -13.843 9.698 2.508 967 2HG PRO 124 2HG PRO 124 -14.654 8.990 3.917 968 1HD PRO 124 1HD PRO 124 -13.284 11.335 4.023 969 2HD PRO 124 2HD PRO 124 -13.424 10.235 5.408 970 H VAL 125 H VAL 125 -9.307 7.761 2.538 971 HA VAL 125 HA VAL 125 -9.782 8.886 -0.123 972 HB VAL 125 HB VAL 125 -7.365 9.506 -0.305 973 1HG1 VAL 125 1HG1 VAL 125 -7.648 11.546 1.310 974 2HG1 VAL 125 2HG1 VAL 125 -9.278 10.902 1.508 975 3HG1 VAL 125 3HG1 VAL 125 -8.701 11.366 -0.094 976 1HG2 VAL 125 1HG2 VAL 125 -6.514 10.041 2.199 977 2HG2 VAL 125 2HG2 VAL 125 -6.090 8.579 1.308 978 3HG2 VAL 125 3HG2 VAL 125 -7.408 8.547 2.480 979 H LEU 126 H LEU 126 -9.645 7.308 -1.566 980 HA LEU 126 HA LEU 126 -8.179 4.870 -0.883 981 1HB LEU 126 1HB LEU 126 -9.401 3.831 -2.710 982 2HB LEU 126 2HB LEU 126 -10.501 4.623 -1.599 983 HG LEU 126 HG LEU 126 -10.247 6.612 -3.351 984 1HD1 LEU 126 1HD1 LEU 126 -8.879 5.880 -5.007 985 2HD1 LEU 126 2HD1 LEU 126 -10.402 5.244 -5.629 986 3HD1 LEU 126 3HD1 LEU 126 -9.295 4.185 -4.755 987 1HD2 LEU 126 1HD2 LEU 126 -12.376 6.112 -4.012 988 2HD2 LEU 126 2HD2 LEU 126 -12.245 5.063 -2.599 989 3HD2 LEU 126 3HD2 LEU 126 -12.029 4.395 -4.217 990 H LEU 127 H LEU 127 -6.503 4.069 -2.079 991 HA LEU 127 HA LEU 127 -5.695 5.434 -4.518 992 1HB LEU 127 1HB LEU 127 -4.225 5.560 -1.938 993 2HB LEU 127 2HB LEU 127 -3.275 5.369 -3.400 994 HG LEU 127 HG LEU 127 -5.313 7.527 -3.399 995 1HD1 LEU 127 1HD1 LEU 127 -3.050 7.383 -1.508 996 2HD1 LEU 127 2HD1 LEU 127 -4.574 8.263 -1.395 997 3HD1 LEU 127 3HD1 LEU 127 -3.256 8.903 -2.378 998 1HD2 LEU 127 1HD2 LEU 127 -2.506 7.198 -4.443 999 2HD2 LEU 127 2HD2 LEU 127 -3.441 8.687 -4.584 1000 3HD2 LEU 127 3HD2 LEU 127 -4.005 7.213 -5.371 1001 HA PRO 128 HA PRO 128 -4.786 1.235 -5.648 1002 1HB PRO 128 1HB PRO 128 -2.849 2.417 -7.547 1003 2HB PRO 128 2HB PRO 128 -4.236 1.369 -7.861 1004 1HG PRO 128 1HG PRO 128 -4.293 3.970 -8.483 1005 2HG PRO 128 2HG PRO 128 -5.732 3.131 -7.875 1006 1HD PRO 128 1HD PRO 128 -3.864 4.974 -6.441 1007 2HD PRO 128 2HD PRO 128 -5.631 4.842 -6.325 1008 H LEU 129 H LEU 129 -3.329 -0.266 -5.019 1009 HA LEU 129 HA LEU 129 -0.546 0.453 -4.608 1010 1HB LEU 129 1HB LEU 129 -2.462 -0.144 -2.407 1011 2HB LEU 129 2HB LEU 129 -0.830 -0.771 -2.272 1012 HG LEU 129 HG LEU 129 -0.290 1.806 -2.886 1013 1HD1 LEU 129 1HD1 LEU 129 -1.969 2.909 -1.102 1014 2HD1 LEU 129 2HD1 LEU 129 -3.042 1.718 -1.836 1015 3HD1 LEU 129 3HD1 LEU 129 -2.247 2.925 -2.843 1016 1HD2 LEU 129 1HD2 LEU 129 -0.064 2.123 -0.387 1017 2HD2 LEU 129 2HD2 LEU 129 0.760 0.722 -1.069 1018 3HD2 LEU 129 3HD2 LEU 129 -0.766 0.516 -0.211 1019 H ALA 130 H ALA 130 0.801 -1.444 -4.097 1020 HA ALA 130 HA ALA 130 -0.422 -4.027 -4.711 1021 1HB ALA 130 1HB ALA 130 0.661 -2.677 -6.755 1022 2HB ALA 130 2HB ALA 130 0.696 -4.437 -6.634 1023 3HB ALA 130 3HB ALA 130 2.103 -3.491 -6.147 1024 H SER 131 H SER 131 0.715 -5.808 -3.930 1025 HA SER 131 HA SER 131 2.986 -5.159 -2.167 1026 1HB SER 131 1HB SER 131 0.988 -5.757 -0.880 1027 2HB SER 131 2HB SER 131 0.851 -7.270 -1.775 1028 HG SER 131 HG SER 131 1.895 -7.563 0.235 1029 H VAL 132 H VAL 132 4.822 -5.940 -2.946 1030 HA VAL 132 HA VAL 132 4.897 -8.689 -3.931 1031 HB VAL 132 HB VAL 132 4.633 -7.316 -5.948 1032 1HG1 VAL 132 1HG1 VAL 132 5.928 -5.360 -4.742 1033 2HG1 VAL 132 2HG1 VAL 132 5.926 -5.515 -6.499 1034 3HG1 VAL 132 3HG1 VAL 132 7.311 -6.081 -5.565 1035 1HG2 VAL 132 1HG2 VAL 132 6.153 -9.388 -5.783 1036 2HG2 VAL 132 2HG2 VAL 132 7.485 -8.238 -5.903 1037 3HG2 VAL 132 3HG2 VAL 132 6.300 -8.353 -7.203 1038 H GLY 133 H GLY 133 6.517 -9.745 -2.991 1039 1HA GLY 133 1HA GLY 133 9.138 -8.689 -2.718 1040 2HA GLY 133 2HA GLY 133 8.293 -8.621 -1.179 1041 H TYR 134 H TYR 134 10.056 -10.076 -0.513 1042 HA TYR 134 HA TYR 134 9.219 -12.850 -0.863 1043 1HB TYR 134 1HB TYR 134 11.046 -12.376 -2.524 1044 2HB TYR 134 2HB TYR 134 12.113 -12.031 -1.166 1045 HD1 TYR 134 HD1 TYR 134 10.985 -14.525 -3.378 1046 HD2 TYR 134 HD2 TYR 134 12.282 -13.944 0.632 1047 HE1 TYR 134 HE1 TYR 134 11.542 -16.914 -3.218 1048 HE2 TYR 134 HE2 TYR 134 12.843 -16.332 0.803 1049 HH TYR 134 HH TYR 134 13.490 -18.208 -1.033 1050 H GLY 135 H GLY 135 9.549 -14.128 0.919 1051 1HA GLY 135 1HA GLY 135 9.876 -14.613 3.139 1052 2HA GLY 135 2HA GLY 135 11.355 -13.676 2.995 1053 HA PRO 136 HA PRO 136 8.925 -11.377 6.106 1054 1HB PRO 136 1HB PRO 136 11.081 -10.136 7.212 1055 2HB PRO 136 2HB PRO 136 10.570 -11.767 7.658 1056 1HG PRO 136 1HG PRO 136 12.736 -10.908 5.780 1057 2HG PRO 136 2HG PRO 136 12.758 -12.195 6.999 1058 1HD PRO 136 1HD PRO 136 12.393 -12.701 4.371 1059 2HD PRO 136 2HD PRO 136 11.621 -13.674 5.640 1060 H VAL 137 H VAL 137 11.190 -10.328 3.683 1061 HA VAL 137 HA VAL 137 10.535 -7.523 3.991 1062 HB VAL 137 HB VAL 137 12.107 -8.819 1.763 1063 1HG1 VAL 137 1HG1 VAL 137 12.539 -6.041 2.740 1064 2HG1 VAL 137 2HG1 VAL 137 11.144 -6.368 1.712 1065 3HG1 VAL 137 3HG1 VAL 137 12.770 -6.722 1.129 1066 1HG2 VAL 137 1HG2 VAL 137 14.115 -8.207 3.048 1067 2HG2 VAL 137 2HG2 VAL 137 13.126 -9.400 3.888 1068 3HG2 VAL 137 3HG2 VAL 137 13.088 -7.711 4.392 1069 H THR 138 H THR 138 8.977 -6.467 2.939 1070 HA THR 138 HA THR 138 7.820 -7.682 0.526 1071 HB THR 138 HB THR 138 6.123 -6.326 2.613 1072 HG1 THR 138 HG1 THR 138 6.653 -8.038 3.755 1073 1HG2 THR 138 1HG2 THR 138 5.453 -6.946 0.100 1074 2HG2 THR 138 2HG2 THR 138 4.316 -6.979 1.448 1075 3HG2 THR 138 3HG2 THR 138 5.073 -8.474 0.896 1076 H PHE 139 H PHE 139 7.716 -6.316 -1.129 1077 HA PHE 139 HA PHE 139 8.254 -3.489 -0.651 1078 1HB PHE 139 1HB PHE 139 9.330 -5.111 -2.472 1079 2HB PHE 139 2HB PHE 139 7.935 -4.580 -3.406 1080 HD1 PHE 139 HD1 PHE 139 10.972 -3.439 -1.654 1081 HD2 PHE 139 HD2 PHE 139 7.840 -2.415 -4.345 1082 HE1 PHE 139 HE1 PHE 139 12.167 -1.374 -2.253 1083 HE2 PHE 139 HE2 PHE 139 9.029 -0.348 -4.951 1084 HZ PHE 139 HZ PHE 139 11.197 0.174 -3.904 1085 H GLN 140 H GLN 140 6.718 -1.991 -0.691 1086 HA GLN 140 HA GLN 140 4.097 -2.709 -1.820 1087 1HB GLN 140 1HB GLN 140 4.942 -1.123 0.540 1088 2HB GLN 140 2HB GLN 140 3.536 -0.536 -0.338 1089 1HG GLN 140 1HG GLN 140 3.531 -3.412 0.256 1090 2HG GLN 140 2HG GLN 140 3.447 -2.348 1.659 1091 1HE2 GLN 140 1HE2 GLN 140 1.372 -2.618 2.243 1092 2HE2 GLN 140 2HE2 GLN 140 0.015 -2.234 1.246 1093 H MET 141 H MET 141 3.534 -1.760 -3.653 1094 HA MET 141 HA MET 141 4.871 0.748 -4.411 1095 1HB MET 141 1HB MET 141 3.745 -1.530 -6.008 1096 2HB MET 141 2HB MET 141 3.937 0.058 -6.741 1097 1HG MET 141 1HG MET 141 6.372 -0.139 -5.812 1098 2HG MET 141 2HG MET 141 6.008 -1.864 -5.808 1099 1HE MET 141 1HE MET 141 7.770 -2.430 -8.959 1100 2HE MET 141 2HE MET 141 7.622 -2.656 -7.216 1101 3HE MET 141 3HE MET 141 8.482 -1.254 -7.853 1102 H THR 142 H THR 142 3.672 2.473 -5.241 1103 HA THR 142 HA THR 142 0.754 2.284 -4.921 1104 HB THR 142 HB THR 142 2.488 4.596 -4.029 1105 HG1 THR 142 HG1 THR 142 2.684 3.235 -2.407 1106 1HG2 THR 142 1HG2 THR 142 0.568 5.649 -3.190 1107 2HG2 THR 142 2HG2 THR 142 -0.436 4.228 -3.478 1108 3HG2 THR 142 3HG2 THR 142 0.167 5.174 -4.840 1109 H TYR 143 H TYR 143 -0.454 3.270 -6.460 1110 HA TYR 143 HA TYR 143 1.001 4.746 -8.557 1111 1HB TYR 143 1HB TYR 143 -1.196 2.703 -8.753 1112 2HB TYR 143 2HB TYR 143 -0.951 3.884 -10.036 1113 HD1 TYR 143 HD1 TYR 143 1.421 4.011 -11.060 1114 HD2 TYR 143 HD2 TYR 143 0.031 0.724 -8.744 1115 HE1 TYR 143 HE1 TYR 143 3.170 2.587 -12.041 1116 HE2 TYR 143 HE2 TYR 143 1.777 -0.708 -9.717 1117 HH TYR 143 HH TYR 143 3.331 -0.149 -12.396 1118 H ILE 144 H ILE 144 -0.040 6.516 -9.522 1119 HA ILE 144 HA ILE 144 -2.235 7.626 -7.908 1120 HB ILE 144 HB ILE 144 -1.536 9.833 -8.849 1121 1HG1 ILE 144 1HG1 ILE 144 1.119 8.754 -9.585 1122 2HG1 ILE 144 2HG1 ILE 144 -0.187 8.399 -10.712 1123 1HG2 ILE 144 1HG2 ILE 144 0.837 9.624 -7.594 1124 2HG2 ILE 144 2HG2 ILE 144 0.049 8.155 -7.018 1125 3HG2 ILE 144 3HG2 ILE 144 -0.710 9.725 -6.755 1126 1HD1 ILE 144 1HD1 ILE 144 1.033 10.425 -11.316 1127 2HD1 ILE 144 2HD1 ILE 144 0.600 11.143 -9.765 1128 3HD1 ILE 144 3HD1 ILE 144 -0.657 10.764 -10.942 1129 HA PRO 145 HA PRO 145 -4.870 7.316 -11.461 1130 1HB PRO 145 1HB PRO 145 -6.840 8.997 -10.712 1131 2HB PRO 145 2HB PRO 145 -6.599 7.426 -9.938 1132 1HG PRO 145 1HG PRO 145 -5.760 10.145 -9.007 1133 2HG PRO 145 2HG PRO 145 -6.486 8.820 -8.078 1134 1HD PRO 145 1HD PRO 145 -3.816 9.361 -8.070 1135 2HD PRO 145 2HD PRO 145 -4.479 7.733 -7.825 1136 H GLY 146 H GLY 146 -5.964 8.729 -13.099 1137 1HA GLY 146 1HA GLY 146 -5.836 11.338 -13.587 1138 2HA GLY 146 2HA GLY 146 -4.152 10.895 -13.824 1139 H THR 147 H THR 147 -5.000 11.931 -15.970 1140 HA THR 147 HA THR 147 -6.341 9.998 -17.682 1141 HB THR 147 HB THR 147 -7.060 12.266 -17.952 1142 HG1 THR 147 HG1 THR 147 -6.547 12.588 -20.156 1143 1HG2 THR 147 1HG2 THR 147 -4.871 13.598 -19.101 1144 2HG2 THR 147 2HG2 THR 147 -4.315 12.927 -17.568 1145 3HG2 THR 147 3HG2 THR 147 -5.724 13.987 -17.607 1146 H TYR 148 H TYR 148 -5.126 8.413 -18.481 1147 HA TYR 148 HA TYR 148 -3.446 7.301 -19.534 1148 1HB TYR 148 1HB TYR 148 -3.216 10.065 -20.618 1149 2HB TYR 148 2HB TYR 148 -1.882 8.957 -20.925 1150 HD1 TYR 148 HD1 TYR 148 -4.542 10.278 -22.487 1151 HD2 TYR 148 HD2 TYR 148 -3.044 6.427 -21.472 1152 HE1 TYR 148 HE1 TYR 148 -5.795 9.302 -24.365 1153 HE2 TYR 148 HE2 TYR 148 -4.293 5.441 -23.348 1154 HH TYR 148 HH TYR 148 -5.600 7.229 -25.829 1155 H ASN 149 H ASN 149 -3.061 8.292 -16.824 1156 HA ASN 149 HA ASN 149 -0.192 8.860 -16.732 1157 1HB ASN 149 1HB ASN 149 -2.142 10.000 -15.313 1158 2HB ASN 149 2HB ASN 149 -1.817 8.639 -14.246 1159 1HD2 ASN 149 1HD2 ASN 149 -0.868 11.722 -15.202 1160 2HD2 ASN 149 2HD2 ASN 149 0.615 11.812 -14.320 1161 H ASN 150 H ASN 150 0.473 6.753 -17.409 1162 HA ASN 150 HA ASN 150 0.501 4.842 -15.190 1163 1HB ASN 150 1HB ASN 150 0.142 2.964 -16.783 1164 2HB ASN 150 2HB ASN 150 -1.260 4.020 -16.633 1165 1HD2 ASN 150 1HD2 ASN 150 -1.450 5.731 -18.293 1166 2HD2 ASN 150 2HD2 ASN 150 -0.983 5.341 -19.910 1167 H GLY 151 H GLY 151 2.595 4.749 -14.686 1168 1HA GLY 151 1HA GLY 151 4.763 3.904 -15.048 1169 2HA GLY 151 2HA GLY 151 4.488 4.004 -16.781 1170 H ASN 152 H ASN 152 3.770 6.683 -14.671 1171 HA ASN 152 HA ASN 152 6.031 8.144 -15.863 1172 1HB ASN 152 1HB ASN 152 3.406 8.783 -16.066 1173 2HB ASN 152 2HB ASN 152 3.834 9.682 -14.613 1174 1HD2 ASN 152 1HD2 ASN 152 6.474 10.316 -15.245 1175 2HD2 ASN 152 2HD2 ASN 152 6.472 11.435 -16.561 1176 H VAL 153 H VAL 153 4.100 7.870 -12.890 1177 HA VAL 153 HA VAL 153 6.522 8.391 -11.336 1178 HB VAL 153 HB VAL 153 5.150 9.857 -9.783 1179 1HG1 VAL 153 1HG1 VAL 153 6.787 10.488 -11.827 1180 2HG1 VAL 153 2HG1 VAL 153 6.054 11.682 -10.756 1181 3HG1 VAL 153 3HG1 VAL 153 5.324 11.340 -12.324 1182 1HG2 VAL 153 1HG2 VAL 153 3.423 10.637 -12.041 1183 2HG2 VAL 153 2HG2 VAL 153 3.078 10.578 -10.313 1184 3HG2 VAL 153 3HG2 VAL 153 3.034 9.098 -11.271 1185 H TYR 154 H TYR 154 6.735 6.920 -9.790 1186 HA TYR 154 HA TYR 154 4.325 5.760 -8.578 1187 1HB TYR 154 1HB TYR 154 5.529 3.529 -8.586 1188 2HB TYR 154 2HB TYR 154 4.959 4.093 -10.153 1189 HD1 TYR 154 HD1 TYR 154 7.863 3.256 -8.140 1190 HD2 TYR 154 HD2 TYR 154 6.572 4.966 -11.815 1191 HE1 TYR 154 HE1 TYR 154 10.135 3.008 -9.046 1192 HE2 TYR 154 HE2 TYR 154 8.840 4.723 -12.732 1193 HH TYR 154 HH TYR 154 10.933 2.936 -12.016 1194 H PHE 155 H PHE 155 4.471 5.306 -6.420 1195 HA PHE 155 HA PHE 155 6.937 6.195 -5.096 1196 1HB PHE 155 1HB PHE 155 4.210 6.789 -4.637 1197 2HB PHE 155 2HB PHE 155 4.753 5.831 -3.264 1198 HD1 PHE 155 HD1 PHE 155 6.015 6.799 -1.565 1199 HD2 PHE 155 HD2 PHE 155 5.572 8.838 -5.275 1200 HE1 PHE 155 HE1 PHE 155 7.077 8.794 -0.592 1201 HE2 PHE 155 HE2 PHE 155 6.634 10.836 -4.308 1202 HZ PHE 155 HZ PHE 155 7.388 10.816 -1.963 1203 H ALA 156 H ALA 156 8.069 4.876 -3.778 1204 HA ALA 156 HA ALA 156 7.109 2.105 -3.535 1205 1HB ALA 156 1HB ALA 156 9.353 1.384 -3.476 1206 2HB ALA 156 2HB ALA 156 9.952 3.016 -3.184 1207 3HB ALA 156 3HB ALA 156 9.276 2.593 -4.757 1208 H TRP 157 H TRP 157 7.384 0.981 -1.561 1209 HA TRP 157 HA TRP 157 8.108 2.534 0.797 1210 1HB TRP 157 1HB TRP 157 5.411 1.197 0.496 1211 2HB TRP 157 2HB TRP 157 6.026 1.927 1.975 1212 HD1 TRP 157 HD1 TRP 157 4.702 2.870 -1.500 1213 HE1 TRP 157 HE1 TRP 157 4.012 5.349 -1.465 1214 HE3 TRP 157 HE3 TRP 157 6.449 4.135 3.136 1215 HZ2 TRP 157 HZ2 TRP 157 4.184 7.549 0.294 1216 HZ3 TRP 157 HZ3 TRP 157 6.146 6.447 3.920 1217 HH2 TRP 157 HH2 TRP 157 5.037 8.119 2.527 1218 H MET 158 H MET 158 8.544 1.248 2.655 1219 HA MET 158 HA MET 158 9.149 -1.548 1.979 1220 1HB MET 158 1HB MET 158 10.859 0.321 2.881 1221 2HB MET 158 2HB MET 158 10.296 -0.313 4.420 1222 1HG MET 158 1HG MET 158 10.823 -2.624 3.293 1223 2HG MET 158 2HG MET 158 11.883 -1.638 2.287 1224 1HE MET 158 1HE MET 158 13.929 -1.700 2.550 1225 2HE MET 158 2HE MET 158 14.904 -2.118 3.959 1226 3HE MET 158 3HE MET 158 14.442 -0.440 3.673 1227 H ARG 159 H ARG 159 8.008 -3.112 2.901 1228 HA ARG 159 HA ARG 159 6.552 -2.506 5.392 1229 1HB ARG 159 1HB ARG 159 5.349 -3.020 3.046 1230 2HB ARG 159 2HB ARG 159 5.559 -4.669 3.618 1231 1HG ARG 159 1HG ARG 159 4.443 -3.940 5.759 1232 2HG ARG 159 2HG ARG 159 4.033 -2.438 4.928 1233 1HD ARG 159 1HD ARG 159 2.224 -4.147 4.883 1234 2HD ARG 159 2HD ARG 159 2.754 -3.621 3.286 1235 HE ARG 159 HE ARG 159 3.498 -5.747 2.867 1236 1HH1 ARG 159 1HH1 ARG 159 2.894 -5.410 6.287 1237 2HH1 ARG 159 2HH1 ARG 159 3.107 -7.097 6.619 1238 1HH2 ARG 159 1HH2 ARG 159 3.776 -7.965 3.300 1239 2HH2 ARG 159 2HH2 ARG 159 3.608 -8.548 4.923 1240 H PHE 160 H PHE 160 7.674 -3.448 6.980 1241 HA PHE 160 HA PHE 160 8.873 -6.079 6.538 1242 1HB PHE 160 1HB PHE 160 9.815 -3.852 7.843 1243 2HB PHE 160 2HB PHE 160 9.235 -4.844 9.177 1244 HD1 PHE 160 HD1 PHE 160 11.955 -4.168 7.074 1245 HD2 PHE 160 HD2 PHE 160 9.990 -7.360 9.090 1246 HE1 PHE 160 HE1 PHE 160 14.020 -5.501 6.969 1247 HE2 PHE 160 HE2 PHE 160 12.052 -8.698 8.988 1248 HZ PHE 160 HZ PHE 160 14.071 -7.768 7.927 1249 H GLN 161 H GLN 161 8.282 -7.897 7.638 1250 HA GLN 161 HA GLN 161 5.886 -7.668 9.339 1251 1HB GLN 161 1HB GLN 161 5.424 -10.039 8.621 1252 2HB GLN 161 2HB GLN 161 5.284 -8.831 7.351 1253 1HG GLN 161 1HG GLN 161 6.974 -9.695 6.162 1254 2HG GLN 161 2HG GLN 161 7.937 -10.055 7.596 1255 1HE2 GLN 161 1HE2 GLN 161 5.236 -11.160 5.633 1256 2HE2 GLN 161 2HE2 GLN 161 5.373 -12.830 6.054 1257 H PHE 162 H PHE 162 6.234 -8.097 11.406 1258 HA PHE 162 HA PHE 162 8.263 -10.111 12.109 1259 1HB PHE 162 1HB PHE 162 8.841 -7.600 12.534 1260 2HB PHE 162 2HB PHE 162 7.729 -7.756 13.890 1261 HD1 PHE 162 HD1 PHE 162 10.344 -9.997 12.455 1262 HD2 PHE 162 HD2 PHE 162 8.891 -7.898 15.859 1263 HE1 PHE 162 HE1 PHE 162 12.149 -10.966 13.818 1264 HE2 PHE 162 HE2 PHE 162 10.693 -8.861 17.229 1265 HZ PHE 162 HZ PHE 162 12.326 -10.398 16.208 1266 H LEU 163 H LEU 163 7.936 -11.094 14.245 1267 HA LEU 163 HA LEU 163 5.313 -10.846 15.440 1268 1HB LEU 163 1HB LEU 163 4.982 -12.415 13.542 1269 2HB LEU 163 2HB LEU 163 6.189 -13.476 14.245 1270 HG LEU 163 HG LEU 163 4.565 -13.342 16.343 1271 1HD1 LEU 163 1HD1 LEU 163 2.456 -13.352 14.275 1272 2HD1 LEU 163 2HD1 LEU 163 3.123 -11.781 14.718 1273 3HD1 LEU 163 3HD1 LEU 163 2.402 -12.814 15.953 1274 1HD2 LEU 163 1HD2 LEU 163 4.517 -15.077 13.919 1275 2HD2 LEU 163 2HD2 LEU 163 3.302 -15.317 15.175 1276 3HD2 LEU 163 3HD2 LEU 163 5.016 -15.456 15.567 1277 H GLU 164 H GLU 164 5.185 -11.729 17.516 1278 HA GLU 164 HA GLU 164 7.786 -12.502 18.653 1279 1HB GLU 164 1HB GLU 164 5.490 -10.911 19.677 1280 2HB GLU 164 2HB GLU 164 6.386 -11.879 20.839 1281 1HG GLU 164 1HG GLU 164 7.723 -10.111 21.009 1282 2HG GLU 164 2HG GLU 164 8.394 -10.644 19.468 1283 HE2 GLU 164 HE2 GLU 164 5.801 -7.629 19.303 1284 H HIS 165 H HIS 165 7.991 -14.604 19.011 1285 HA HIS 165 HA HIS 165 5.811 -16.413 19.078 1286 1HB HIS 165 1HB HIS 165 8.721 -16.739 19.820 1287 2HB HIS 165 2HB HIS 165 7.568 -18.069 19.811 1288 HD1 HIS 165 HD1 HIS 165 6.166 -17.948 17.259 1289 HD2 HIS 165 HD2 HIS 165 10.161 -16.843 17.549 1290 HE1 HIS 165 HE1 HIS 165 7.091 -18.152 14.929 1291 HE2 HIS 165 HE2 HIS 165 9.490 -17.406 15.116 1292 H HIS 166 H HIS 166 7.634 -14.736 21.547 1293 HA HIS 166 HA HIS 166 6.263 -16.225 23.659 1294 1HB HIS 166 1HB HIS 166 7.811 -15.105 25.194 1295 2HB HIS 166 2HB HIS 166 8.685 -15.913 23.896 1296 HD1 HIS 166 HD1 HIS 166 8.273 -12.673 25.525 1297 HD2 HIS 166 HD2 HIS 166 9.661 -14.065 21.865 1298 HE1 HIS 166 HE1 HIS 166 9.588 -10.770 24.537 1299 HE2 HIS 166 HE2 HIS 166 10.344 -11.606 22.284 1300 H HIS 167 H HIS 167 4.680 -14.516 22.053 1301 HA HIS 167 HA HIS 167 4.163 -12.203 23.779 1302 1HB HIS 167 1HB HIS 167 4.383 -12.027 21.218 1303 2HB HIS 167 2HB HIS 167 2.788 -12.771 21.161 1304 HD1 HIS 167 HD1 HIS 167 0.823 -11.376 22.303 1305 HD2 HIS 167 HD2 HIS 167 4.400 -9.336 21.746 1306 HE1 HIS 167 HE1 HIS 167 0.253 -8.939 22.555 1307 HE2 HIS 167 HE2 HIS 167 2.421 -7.720 22.152 1308 H HIS 168 H HIS 168 3.508 -14.806 24.722 1309 HA HIS 168 HA HIS 168 0.685 -14.392 25.241 1310 1HB HIS 168 1HB HIS 168 0.081 -16.725 24.692 1311 2HB HIS 168 2HB HIS 168 0.600 -15.822 23.273 1312 HD1 HIS 168 HD1 HIS 168 0.795 -19.055 24.223 1313 HD2 HIS 168 HD2 HIS 168 3.791 -16.303 23.380 1314 HE1 HIS 168 HE1 HIS 168 2.817 -20.425 23.624 1315 HE2 HIS 168 HE2 HIS 168 4.642 -18.739 23.202 1316 H HIS 169 H HIS 169 0.361 -14.644 27.346 1317 HA HIS 169 HA HIS 169 2.395 -15.864 28.992 1318 1HB HIS 169 1HB HIS 169 0.873 -15.160 30.872 1319 2HB HIS 169 2HB HIS 169 1.421 -13.847 29.836 1320 HD1 HIS 169 HD1 HIS 169 -0.381 -12.271 29.257 1321 HD2 HIS 169 HD2 HIS 169 -1.842 -16.111 29.874 1322 HE1 HIS 169 HE1 HIS 169 -2.871 -12.099 28.956 1323 HE2 HIS 169 HE2 HIS 169 -3.742 -14.415 29.423 1324 H HIS 170 H HIS 170 1.757 -17.391 30.752 1325 HA HIS 170 HA HIS 170 -0.549 -19.053 30.319 1326 1HB HIS 170 1HB HIS 170 0.691 -21.124 29.873 1327 2HB HIS 170 2HB HIS 170 0.950 -19.942 28.595 1328 HD1 HIS 170 HD1 HIS 170 2.855 -22.394 29.684 1329 HD2 HIS 170 HD2 HIS 170 3.423 -18.295 30.069 1330 HE1 HIS 170 HE1 HIS 170 5.327 -22.087 30.025 1331 HE2 HIS 170 HE2 HIS 170 5.658 -19.594 30.174 Start of MODEL 12 1 1H MET 1 1H MET 1 -20.255 -26.637 5.612 2 2H MET 1 2H MET 1 -20.400 -25.748 7.073 3 H MET 1 H MET 1 -20.344 -26.605 6.473 4 3H MET 1 3H MET 1 -19.672 -25.028 5.697 5 HA MET 1 HA MET 1 -21.632 -24.828 4.582 6 1HB MET 1 1HB MET 1 -23.720 -25.949 5.523 7 2HB MET 1 2HB MET 1 -22.520 -27.007 4.795 8 1HG MET 1 1HG MET 1 -21.638 -27.303 7.191 9 2HG MET 1 2HG MET 1 -23.189 -26.629 7.685 10 1HE MET 1 1HE MET 1 -25.564 -29.385 7.597 11 2HE MET 1 2HE MET 1 -25.664 -27.991 6.523 12 3HE MET 1 3HE MET 1 -25.044 -27.797 8.162 13 H ASN 2 H ASN 2 -21.910 -25.159 8.128 14 HA ASN 2 HA ASN 2 -22.338 -22.312 8.381 15 1HB ASN 2 1HB ASN 2 -24.563 -24.137 8.328 16 2HB ASN 2 2HB ASN 2 -24.440 -23.403 9.924 17 1HD2 ASN 2 1HD2 ASN 2 -24.057 -22.378 6.544 18 2HD2 ASN 2 2HD2 ASN 2 -25.008 -20.945 6.695 19 H ALA 3 H ALA 3 -22.754 -25.358 10.195 20 HA ALA 3 HA ALA 3 -22.071 -24.368 12.706 21 1HB ALA 3 1HB ALA 3 -22.948 -26.739 11.825 22 2HB ALA 3 2HB ALA 3 -22.232 -26.509 13.420 23 3HB ALA 3 3HB ALA 3 -21.252 -27.141 12.097 24 H ASP 4 H ASP 4 -20.060 -25.129 9.998 25 HA ASP 4 HA ASP 4 -17.626 -25.413 11.492 26 1HB ASP 4 1HB ASP 4 -18.083 -24.922 8.540 27 2HB ASP 4 2HB ASP 4 -16.533 -25.327 9.271 28 HD2 ASP 4 HD2 ASP 4 -18.146 -28.546 10.105 29 H GLU 5 H GLU 5 -18.835 -22.918 9.249 30 HA GLU 5 HA GLU 5 -16.804 -21.047 9.935 31 1HB GLU 5 1HB GLU 5 -18.642 -21.269 7.905 32 2HB GLU 5 2HB GLU 5 -19.289 -19.932 8.843 33 1HG GLU 5 1HG GLU 5 -17.359 -18.637 8.532 34 2HG GLU 5 2HG GLU 5 -16.421 -20.021 7.975 35 HE2 GLU 5 HE2 GLU 5 -18.359 -17.923 5.343 36 H TRP 6 H TRP 6 -19.912 -21.842 11.246 37 HA TRP 6 HA TRP 6 -20.333 -19.391 12.650 38 1HB TRP 6 1HB TRP 6 -22.125 -21.060 12.036 39 2HB TRP 6 2HB TRP 6 -21.503 -22.096 13.316 40 HD1 TRP 6 HD1 TRP 6 -22.288 -18.289 13.351 41 HE1 TRP 6 HE1 TRP 6 -23.853 -17.828 15.341 42 HE3 TRP 6 HE3 TRP 6 -22.877 -23.076 15.048 43 HZ2 TRP 6 HZ2 TRP 6 -25.165 -19.299 17.362 44 HZ3 TRP 6 HZ3 TRP 6 -24.302 -23.463 17.015 45 HH2 TRP 6 HH2 TRP 6 -25.422 -21.611 18.148 46 H MET 7 H MET 7 -18.687 -22.395 13.350 47 HA MET 7 HA MET 7 -18.383 -21.860 16.157 48 1HB MET 7 1HB MET 7 -17.833 -24.040 14.345 49 2HB MET 7 2HB MET 7 -16.441 -23.736 15.375 50 1HG MET 7 1HG MET 7 -17.427 -24.886 16.979 51 2HG MET 7 2HG MET 7 -18.678 -23.647 17.058 52 1HE MET 7 1HE MET 7 -18.125 -27.564 15.757 53 2HE MET 7 2HE MET 7 -19.542 -27.731 16.793 54 3HE MET 7 3HE MET 7 -18.126 -26.851 17.371 55 H THR 8 H THR 8 -16.233 -21.765 13.327 56 HA THR 8 HA THR 8 -13.916 -20.938 14.657 57 HB THR 8 HB THR 8 -13.893 -21.766 12.357 58 HG1 THR 8 HG1 THR 8 -12.989 -19.082 12.441 59 1HG2 THR 8 1HG2 THR 8 -14.713 -20.634 10.504 60 2HG2 THR 8 2HG2 THR 8 -14.944 -19.134 11.402 61 3HG2 THR 8 3HG2 THR 8 -16.014 -20.507 11.689 62 H THR 9 H THR 9 -16.565 -19.066 13.250 63 HA THR 9 HA THR 9 -15.439 -16.515 13.575 64 HB THR 9 HB THR 9 -17.865 -15.750 13.565 65 HG1 THR 9 HG1 THR 9 -19.219 -17.251 14.092 66 1HG2 THR 9 1HG2 THR 9 -18.260 -17.048 11.250 67 2HG2 THR 9 2HG2 THR 9 -16.522 -17.272 11.439 68 3HG2 THR 9 3HG2 THR 9 -17.206 -15.646 11.423 69 H PHE 10 H PHE 10 -17.497 -18.445 15.722 70 HA PHE 10 HA PHE 10 -17.675 -16.476 17.760 71 1HB PHE 10 1HB PHE 10 -18.947 -18.843 17.260 72 2HB PHE 10 2HB PHE 10 -17.907 -19.286 18.609 73 HD1 PHE 10 HD1 PHE 10 -20.812 -17.392 17.551 74 HD2 PHE 10 HD2 PHE 10 -18.148 -18.161 20.779 75 HE1 PHE 10 HE1 PHE 10 -22.418 -16.378 19.113 76 HE2 PHE 10 HE2 PHE 10 -19.751 -17.148 22.348 77 HZ PHE 10 HZ PHE 10 -21.889 -16.256 21.515 78 H ARG 11 H ARG 11 -15.547 -19.249 17.227 79 HA ARG 11 HA ARG 11 -14.161 -18.982 19.704 80 1HB ARG 11 1HB ARG 11 -14.327 -20.954 17.864 81 2HB ARG 11 2HB ARG 11 -12.773 -20.262 17.426 82 1HG ARG 11 1HG ARG 11 -11.930 -21.614 18.982 83 2HG ARG 11 2HG ARG 11 -12.572 -20.455 20.147 84 1HD ARG 11 1HD ARG 11 -14.768 -21.960 19.678 85 2HD ARG 11 2HD ARG 11 -13.499 -23.163 19.453 86 HE ARG 11 HE ARG 11 -12.896 -21.852 21.801 87 1HH1 ARG 11 1HH1 ARG 11 -15.549 -23.754 20.569 88 2HH1 ARG 11 2HH1 ARG 11 -15.999 -24.363 22.127 89 1HH2 ARG 11 1HH2 ARG 11 -13.485 -22.652 23.850 90 2HH2 ARG 11 2HH2 ARG 11 -14.828 -23.737 23.990 91 H GLU 12 H GLU 12 -13.752 -17.663 16.493 92 HA GLU 12 HA GLU 12 -11.101 -16.674 16.941 93 1HB GLU 12 1HB GLU 12 -13.167 -16.337 14.803 94 2HB GLU 12 2HB GLU 12 -11.801 -15.231 14.858 95 1HG GLU 12 1HG GLU 12 -10.408 -17.442 14.984 96 2HG GLU 12 2HG GLU 12 -11.859 -18.147 14.273 97 HE2 GLU 12 HE2 GLU 12 -9.753 -15.601 12.066 98 H ASN 13 H ASN 13 -14.359 -15.349 17.160 99 HA ASN 13 HA ASN 13 -13.671 -12.651 17.505 100 1HB ASN 13 1HB ASN 13 -16.011 -13.966 17.255 101 2HB ASN 13 2HB ASN 13 -16.026 -13.670 18.991 102 1HD2 ASN 13 1HD2 ASN 13 -17.471 -12.093 19.213 103 2HD2 ASN 13 2HD2 ASN 13 -17.408 -10.564 18.410 104 H ILE 14 H ILE 14 -14.526 -15.072 19.985 105 HA ILE 14 HA ILE 14 -13.846 -13.431 22.178 106 HB ILE 14 HB ILE 14 -13.880 -15.510 23.512 107 1HG1 ILE 14 1HG1 ILE 14 -14.825 -17.488 21.917 108 2HG1 ILE 14 2HG1 ILE 14 -13.705 -16.701 20.809 109 1HG2 ILE 14 1HG2 ILE 14 -15.956 -14.209 22.449 110 2HG2 ILE 14 2HG2 ILE 14 -16.143 -15.610 23.504 111 3HG2 ILE 14 3HG2 ILE 14 -16.239 -15.805 21.754 112 1HD1 ILE 14 1HD1 ILE 14 -12.494 -18.413 21.863 113 2HD1 ILE 14 2HD1 ILE 14 -13.106 -17.974 23.457 114 3HD1 ILE 14 3HD1 ILE 14 -11.967 -16.913 22.627 115 H ALA 15 H ALA 15 -12.004 -15.686 20.224 116 HA ALA 15 HA ALA 15 -9.741 -15.832 21.938 117 1HB ALA 15 1HB ALA 15 -10.085 -17.572 20.338 118 2HB ALA 15 2HB ALA 15 -8.589 -16.738 19.917 119 3HB ALA 15 3HB ALA 15 -10.064 -16.421 19.002 120 H GLN 16 H GLN 16 -10.769 -13.609 19.457 121 HA GLN 16 HA GLN 16 -8.197 -12.352 19.168 122 1HB GLN 16 1HB GLN 16 -10.933 -11.919 18.080 123 2HB GLN 16 2HB GLN 16 -9.835 -10.546 18.079 124 1HG GLN 16 1HG GLN 16 -8.177 -12.008 16.887 125 2HG GLN 16 2HG GLN 16 -9.467 -13.197 16.715 126 1HE2 GLN 16 1HE2 GLN 16 -8.794 -12.735 14.410 127 2HE2 GLN 16 2HE2 GLN 16 -9.667 -11.493 13.586 128 H THR 17 H THR 17 -11.064 -11.874 21.101 129 HA THR 17 HA THR 17 -10.459 -9.226 21.952 130 HB THR 17 HB THR 17 -12.167 -11.295 23.345 131 HG1 THR 17 HG1 THR 17 -13.659 -10.896 21.926 132 1HG2 THR 17 1HG2 THR 17 -13.312 -8.789 23.618 133 2HG2 THR 17 2HG2 THR 17 -11.595 -8.533 23.928 134 3HG2 THR 17 3HG2 THR 17 -12.493 -9.725 24.868 135 H TRP 18 H TRP 18 -9.591 -12.420 23.080 136 HA TRP 18 HA TRP 18 -8.355 -11.337 25.490 137 1HB TRP 18 1HB TRP 18 -9.703 -13.604 25.211 138 2HB TRP 18 2HB TRP 18 -8.122 -14.215 24.736 139 HD1 TRP 18 HD1 TRP 18 -6.808 -15.198 26.687 140 HE1 TRP 18 HE1 TRP 18 -6.714 -14.829 29.233 141 HE3 TRP 18 HE3 TRP 18 -10.208 -11.399 27.084 142 HZ2 TRP 18 HZ2 TRP 18 -7.922 -13.151 31.154 143 HZ3 TRP 18 HZ3 TRP 18 -10.680 -10.469 29.312 144 HH2 TRP 18 HH2 TRP 18 -9.561 -11.328 31.304 145 H GLN 19 H GLN 19 -7.440 -13.135 22.570 146 HA GLN 19 HA GLN 19 -4.669 -13.200 23.133 147 1HB GLN 19 1HB GLN 19 -5.908 -14.669 21.493 148 2HB GLN 19 2HB GLN 19 -5.944 -13.294 20.398 149 1HG GLN 19 1HG GLN 19 -3.988 -13.958 19.615 150 2HG GLN 19 2HG GLN 19 -3.279 -13.526 21.170 151 1HE2 GLN 19 1HE2 GLN 19 -5.439 -16.161 20.197 152 2HE2 GLN 19 2HE2 GLN 19 -4.408 -17.438 20.735 153 H GLN 20 H GLN 20 -6.750 -10.851 21.597 154 HA GLN 20 HA GLN 20 -6.396 -8.723 20.875 155 1HB GLN 20 1HB GLN 20 -4.509 -9.147 23.031 156 2HB GLN 20 2HB GLN 20 -3.862 -8.019 21.848 157 1HG GLN 20 1HG GLN 20 -5.063 -6.418 22.778 158 2HG GLN 20 2HG GLN 20 -6.527 -7.257 22.268 159 1HE2 GLN 20 1HE2 GLN 20 -4.048 -7.587 24.792 160 2HE2 GLN 20 2HE2 GLN 20 -5.160 -7.850 26.088 161 HA PRO 21 HA PRO 21 -3.969 -8.398 17.213 162 1HB PRO 21 1HB PRO 21 -2.272 -6.260 18.415 163 2HB PRO 21 2HB PRO 21 -3.153 -6.269 16.883 164 1HG PRO 21 1HG PRO 21 -4.080 -4.903 18.970 165 2HG PRO 21 2HG PRO 21 -5.183 -5.783 17.895 166 1HD PRO 21 1HD PRO 21 -4.249 -6.483 20.639 167 2HD PRO 21 2HD PRO 21 -5.824 -6.772 19.873 168 H GLU 22 H GLU 22 -2.659 -10.076 16.828 169 HA GLU 22 HA GLU 22 -0.261 -10.435 18.474 170 1HB GLU 22 1HB GLU 22 -2.000 -12.298 17.956 171 2HB GLU 22 2HB GLU 22 -1.204 -12.380 16.390 172 1HG GLU 22 1HG GLU 22 0.949 -12.759 17.590 173 2HG GLU 22 2HG GLU 22 0.028 -12.866 19.089 174 HE2 GLU 22 HE2 GLU 22 0.317 -16.045 16.921 175 H HIS 23 H HIS 23 -1.247 -10.372 15.056 176 HA HIS 23 HA HIS 23 1.349 -10.502 13.980 177 1HB HIS 23 1HB HIS 23 -1.276 -9.497 12.900 178 2HB HIS 23 2HB HIS 23 0.203 -9.410 11.948 179 HD1 HIS 23 HD1 HIS 23 -0.338 -12.377 14.132 180 HD2 HIS 23 HD2 HIS 23 -0.821 -11.318 10.144 181 HE1 HIS 23 HE1 HIS 23 -0.732 -14.537 12.907 182 HE2 HIS 23 HE2 HIS 23 -1.109 -13.862 10.509 183 H TYR 24 H TYR 24 2.931 -9.054 13.912 184 HA TYR 24 HA TYR 24 2.271 -6.240 14.480 185 1HB TYR 24 1HB TYR 24 4.705 -7.899 15.106 186 2HB TYR 24 2HB TYR 24 4.767 -6.140 15.112 187 HD1 TYR 24 HD1 TYR 24 2.679 -5.069 16.485 188 HD2 TYR 24 HD2 TYR 24 4.404 -8.901 17.153 189 HE1 TYR 24 HE1 TYR 24 1.827 -5.044 18.792 190 HE2 TYR 24 HE2 TYR 24 3.557 -8.886 19.461 191 HH TYR 24 HH TYR 24 1.843 -7.828 20.787 192 H ASP 25 H ASP 25 2.076 -5.261 12.551 193 HA ASP 25 HA ASP 25 4.096 -5.792 10.489 194 1HB ASP 25 1HB ASP 25 1.350 -4.549 10.372 195 2HB ASP 25 2HB ASP 25 2.479 -4.473 9.023 196 HD2 ASP 25 HD2 ASP 25 2.061 -7.867 8.327 197 H LEU 26 H LEU 26 5.552 -4.300 9.899 198 HA LEU 26 HA LEU 26 5.371 -1.652 11.172 199 1HB LEU 26 1HB LEU 26 7.645 -3.467 10.544 200 2HB LEU 26 2HB LEU 26 7.935 -1.740 10.466 201 HG LEU 26 HG LEU 26 8.550 -2.753 12.645 202 1HD1 LEU 26 1HD1 LEU 26 8.247 -0.538 12.996 203 2HD1 LEU 26 2HD1 LEU 26 6.892 -1.124 13.959 204 3HD1 LEU 26 3HD1 LEU 26 6.620 -0.538 12.317 205 1HD2 LEU 26 1HD2 LEU 26 5.591 -3.094 13.076 206 2HD2 LEU 26 2HD2 LEU 26 6.908 -3.579 14.146 207 3HD2 LEU 26 3HD2 LEU 26 6.663 -4.416 12.614 208 H TYR 27 H TYR 27 5.745 0.200 9.971 209 HA TYR 27 HA TYR 27 5.997 -0.156 7.061 210 1HB TYR 27 1HB TYR 27 3.695 0.719 8.402 211 2HB TYR 27 2HB TYR 27 4.420 2.178 7.738 212 HD1 TYR 27 HD1 TYR 27 1.846 0.301 7.049 213 HD2 TYR 27 HD2 TYR 27 5.591 1.170 5.229 214 HE1 TYR 27 HE1 TYR 27 0.892 -0.235 4.847 215 HE2 TYR 27 HE2 TYR 27 4.648 0.636 3.021 216 HH TYR 27 HH TYR 27 1.910 -1.052 2.550 217 H ILE 28 H ILE 28 7.557 1.025 6.166 218 HA ILE 28 HA ILE 28 8.691 3.243 7.738 219 HB ILE 28 HB ILE 28 10.119 1.673 5.596 220 1HG1 ILE 28 1HG1 ILE 28 9.489 0.208 7.492 221 2HG1 ILE 28 2HG1 ILE 28 11.231 0.441 7.377 222 1HG2 ILE 28 1HG2 ILE 28 12.092 2.729 6.358 223 2HG2 ILE 28 2HG2 ILE 28 11.282 3.369 7.787 224 3HG2 ILE 28 3HG2 ILE 28 10.884 4.003 6.190 225 1HD1 ILE 28 1HD1 ILE 28 9.498 2.051 9.222 226 2HD1 ILE 28 2HD1 ILE 28 11.254 1.889 9.234 227 3HD1 ILE 28 3HD1 ILE 28 10.239 0.520 9.687 228 HA PRO 29 HA PRO 29 7.372 5.886 4.410 229 1HB PRO 29 1HB PRO 29 8.751 8.112 5.079 230 2HB PRO 29 2HB PRO 29 7.337 7.565 5.988 231 1HG PRO 29 1HG PRO 29 10.243 7.204 6.609 232 2HG PRO 29 2HG PRO 29 8.914 7.649 7.696 233 1HD PRO 29 1HD PRO 29 9.911 5.126 7.538 234 2HD PRO 29 2HD PRO 29 8.217 5.469 7.937 235 H ALA 30 H ALA 30 8.412 7.393 2.764 236 HA ALA 30 HA ALA 30 11.067 6.385 1.977 237 1HB ALA 30 1HB ALA 30 9.548 5.315 0.513 238 2HB ALA 30 2HB ALA 30 10.264 6.642 -0.404 239 3HB ALA 30 3HB ALA 30 8.637 6.803 0.255 240 H ILE 31 H ILE 31 11.855 7.877 0.027 241 HA ILE 31 HA ILE 31 11.786 10.607 1.096 242 HB ILE 31 HB ILE 31 13.799 10.976 -0.330 243 1HG1 ILE 31 1HG1 ILE 31 14.113 8.028 -0.631 244 2HG1 ILE 31 2HG1 ILE 31 13.044 8.853 -1.760 245 1HG2 ILE 31 1HG2 ILE 31 14.340 10.582 1.878 246 2HG2 ILE 31 2HG2 ILE 31 15.253 9.321 1.050 247 3HG2 ILE 31 3HG2 ILE 31 13.727 8.929 1.843 248 1HD1 ILE 31 1HD1 ILE 31 15.193 10.464 -1.879 249 2HD1 ILE 31 2HD1 ILE 31 14.933 9.083 -2.944 250 3HD1 ILE 31 3HD1 ILE 31 15.971 8.921 -1.528 251 H THR 32 H THR 32 11.184 12.352 -0.110 252 HA THR 32 HA THR 32 10.110 11.784 -2.796 253 HB THR 32 HB THR 32 8.256 12.259 -1.399 254 HG1 THR 32 HG1 THR 32 7.450 14.030 -2.389 255 1HG2 THR 32 1HG2 THR 32 8.201 14.533 -0.184 256 2HG2 THR 32 2HG2 THR 32 9.960 14.418 -0.244 257 3HG2 THR 32 3HG2 THR 32 9.021 13.169 0.574 258 H TRP 33 H TRP 33 10.318 13.409 -4.391 259 HA TRP 33 HA TRP 33 12.504 15.306 -3.850 260 1HB TRP 33 1HB TRP 33 12.941 15.222 -6.293 261 2HB TRP 33 2HB TRP 33 13.122 13.654 -5.514 262 HD1 TRP 33 HD1 TRP 33 11.021 11.892 -5.895 263 HE1 TRP 33 HE1 TRP 33 9.499 11.599 -7.949 264 HE3 TRP 33 HE3 TRP 33 11.863 16.388 -8.179 265 HZ2 TRP 33 HZ2 TRP 33 8.752 13.077 -10.235 266 HZ3 TRP 33 HZ3 TRP 33 10.705 16.869 -10.297 267 HH2 TRP 33 HH2 TRP 33 9.183 15.247 -11.302 268 H HIS 34 H HIS 34 11.285 17.049 -3.167 269 HA HIS 34 HA HIS 34 10.066 18.957 -3.368 270 1HB HIS 34 1HB HIS 34 11.363 18.631 -5.805 271 2HB HIS 34 2HB HIS 34 9.690 18.938 -6.258 272 HD1 HIS 34 HD1 HIS 34 8.646 21.206 -5.196 273 HD2 HIS 34 HD2 HIS 34 12.787 20.857 -5.158 274 HE1 HIS 34 HE1 HIS 34 9.515 23.538 -4.831 275 HE2 HIS 34 HE2 HIS 34 12.020 23.291 -4.740 276 H ALA 35 H ALA 35 8.043 18.886 -2.664 277 HA ALA 35 HA ALA 35 5.965 17.829 -4.436 278 1HB ALA 35 1HB ALA 35 5.622 17.186 -1.573 279 2HB ALA 35 2HB ALA 35 6.837 16.256 -2.449 280 3HB ALA 35 3HB ALA 35 5.164 16.267 -3.007 281 H ARG 36 H ARG 36 6.392 19.281 -1.200 282 HA ARG 36 HA ARG 36 4.065 20.983 -1.713 283 1HB ARG 36 1HB ARG 36 4.642 19.559 0.483 284 2HB ARG 36 2HB ARG 36 5.467 21.053 0.906 285 1HG ARG 36 1HG ARG 36 3.531 22.230 1.110 286 2HG ARG 36 2HG ARG 36 2.679 21.252 -0.086 287 1HD ARG 36 1HD ARG 36 3.498 19.839 2.365 288 2HD ARG 36 2HD ARG 36 2.274 21.088 2.583 289 HE ARG 36 HE ARG 36 1.531 19.492 0.409 290 1HH1 ARG 36 1HH1 ARG 36 1.892 19.251 3.871 291 2HH1 ARG 36 2HH1 ARG 36 0.674 18.031 4.039 292 1HH2 ARG 36 1HH2 ARG 36 -0.071 17.888 0.628 293 2HH2 ARG 36 2HH2 ARG 36 -0.441 17.257 2.198 294 H PHE 37 H PHE 37 6.678 21.435 -2.978 295 HA PHE 37 HA PHE 37 8.080 23.151 -3.489 296 1HB PHE 37 1HB PHE 37 5.580 24.263 -3.086 297 2HB PHE 37 2HB PHE 37 6.625 25.259 -2.078 298 HD1 PHE 37 HD1 PHE 37 5.075 25.470 -4.977 299 HD2 PHE 37 HD2 PHE 37 9.091 25.409 -3.570 300 HE1 PHE 37 HE1 PHE 37 5.788 26.724 -6.970 301 HE2 PHE 37 HE2 PHE 37 9.811 26.665 -5.561 302 HZ PHE 37 HZ PHE 37 8.158 27.325 -7.263 303 H ALA 38 H ALA 38 9.960 22.939 -2.437 304 HA ALA 38 HA ALA 38 10.199 23.240 0.402 305 1HB ALA 38 1HB ALA 38 12.287 22.389 0.168 306 2HB ALA 38 2HB ALA 38 12.627 23.326 -1.287 307 3HB ALA 38 3HB ALA 38 11.635 21.872 -1.386 308 H TYR 39 H TYR 39 9.636 25.301 1.012 309 HA TYR 39 HA TYR 39 10.485 27.659 -0.285 310 1HB TYR 39 1HB TYR 39 9.372 27.068 2.444 311 2HB TYR 39 2HB TYR 39 9.919 28.689 2.031 312 HD1 TYR 39 HD1 TYR 39 8.566 30.133 0.742 313 HD2 TYR 39 HD2 TYR 39 7.533 26.019 1.073 314 HE1 TYR 39 HE1 TYR 39 6.396 30.600 -0.314 315 HE2 TYR 39 HE2 TYR 39 5.359 26.474 0.017 316 HH TYR 39 HH TYR 39 3.843 28.332 -0.349 317 H ASP 40 H ASP 40 12.394 28.636 -0.300 318 HA ASP 40 HA ASP 40 14.477 27.700 1.516 319 1HB ASP 40 1HB ASP 40 14.467 29.214 -1.073 320 2HB ASP 40 2HB ASP 40 15.883 29.279 -0.027 321 HD2 ASP 40 HD2 ASP 40 15.340 26.120 -2.228 322 H LYS 41 H LYS 41 15.843 29.176 2.660 323 HA LYS 41 HA LYS 41 14.727 31.853 3.099 324 1HB LYS 41 1HB LYS 41 15.125 29.697 5.131 325 2HB LYS 41 2HB LYS 41 15.379 31.371 5.608 326 1HG LYS 41 1HG LYS 41 12.851 30.377 4.319 327 2HG LYS 41 2HG LYS 41 13.096 30.465 6.065 328 1HD LYS 41 1HD LYS 41 12.206 32.522 5.838 329 2HD LYS 41 2HD LYS 41 13.836 32.962 5.323 330 1HE LYS 41 1HE LYS 41 13.231 33.201 3.155 331 2HE LYS 41 2HE LYS 41 12.052 31.891 3.229 332 1HZ LYS 41 1HZ LYS 41 11.338 34.410 3.035 333 2HZ LYS 41 2HZ LYS 41 11.445 34.327 4.721 334 3HZ LYS 41 3HZ LYS 41 10.408 33.282 3.888 335 H GLU 42 H GLU 42 17.380 29.725 4.179 336 HA GLU 42 HA GLU 42 19.623 30.060 4.358 337 1HB GLU 42 1HB GLU 42 18.868 31.816 2.065 338 2HB GLU 42 2HB GLU 42 20.491 31.957 2.729 339 1HG GLU 42 1HG GLU 42 20.508 30.441 0.868 340 2HG GLU 42 2HG GLU 42 20.830 29.551 2.356 341 HE2 GLU 42 HE2 GLU 42 17.832 28.438 0.168 342 H LYS 43 H LYS 43 17.950 31.386 6.208 343 HA LYS 43 HA LYS 43 19.416 33.895 6.689 344 1HB LYS 43 1HB LYS 43 16.896 33.989 6.440 345 2HB LYS 43 2HB LYS 43 16.794 33.080 7.942 346 1HG LYS 43 1HG LYS 43 16.495 35.378 8.463 347 2HG LYS 43 2HG LYS 43 18.092 34.904 9.045 348 1HD LYS 43 1HD LYS 43 18.670 35.746 6.525 349 2HD LYS 43 2HD LYS 43 17.332 36.816 6.948 350 1HE LYS 43 1HE LYS 43 18.993 38.059 7.844 351 2HE LYS 43 2HE LYS 43 18.759 36.972 9.212 352 1HZ LYS 43 1HZ LYS 43 21.042 36.967 8.833 353 2HZ LYS 43 2HZ LYS 43 20.875 36.897 7.152 354 3HZ LYS 43 3HZ LYS 43 20.517 35.539 8.094 355 H THR 44 H THR 44 17.752 31.406 8.633 356 HA THR 44 HA THR 44 19.770 31.735 10.717 357 HB THR 44 HB THR 44 17.469 31.768 11.461 358 HG1 THR 44 HG1 THR 44 17.569 30.021 12.947 359 1HG2 THR 44 1HG2 THR 44 17.237 29.124 10.066 360 2HG2 THR 44 2HG2 THR 44 16.251 30.571 9.853 361 3HG2 THR 44 3HG2 THR 44 16.129 29.631 11.341 362 H ASP 45 H ASP 45 21.183 30.170 11.341 363 HA ASP 45 HA ASP 45 21.312 27.781 9.630 364 1HB ASP 45 1HB ASP 45 23.244 29.634 9.978 365 2HB ASP 45 2HB ASP 45 23.655 28.527 11.285 366 HD2 ASP 45 HD2 ASP 45 23.930 27.121 7.575 367 H ARG 46 H ARG 46 20.719 25.936 10.539 368 HA ARG 46 HA ARG 46 21.503 25.327 13.268 369 1HB ARG 46 1HB ARG 46 19.070 26.434 13.000 370 2HB ARG 46 2HB ARG 46 18.651 24.757 12.681 371 1HG ARG 46 1HG ARG 46 20.336 25.256 15.051 372 2HG ARG 46 2HG ARG 46 18.672 25.837 15.128 373 1HD ARG 46 1HD ARG 46 18.761 23.178 14.028 374 2HD ARG 46 2HD ARG 46 19.601 23.231 15.576 375 HE ARG 46 HE ARG 46 17.599 23.743 16.635 376 1HH1 ARG 46 1HH1 ARG 46 17.154 23.626 13.170 377 2HH1 ARG 46 2HH1 ARG 46 15.426 23.595 13.271 378 1HH2 ARG 46 1HH2 ARG 46 15.329 23.702 16.761 379 2HH2 ARG 46 2HH2 ARG 46 14.392 23.637 15.306 380 H TYR 47 H TYR 47 21.067 23.044 13.828 381 HA TYR 47 HA TYR 47 21.240 21.362 11.421 382 1HB TYR 47 1HB TYR 47 23.125 21.490 13.232 383 2HB TYR 47 2HB TYR 47 22.061 20.430 14.151 384 HD1 TYR 47 HD1 TYR 47 23.268 20.653 10.612 385 HD2 TYR 47 HD2 TYR 47 22.609 18.201 14.026 386 HE1 TYR 47 HE1 TYR 47 24.150 18.715 9.383 387 HE2 TYR 47 HE2 TYR 47 23.490 16.256 12.807 388 HH TYR 47 HH TYR 47 23.737 15.558 10.386 389 H ASN 48 H ASN 48 19.197 20.728 10.983 390 HA ASN 48 HA ASN 48 17.392 19.937 13.105 391 1HB ASN 48 1HB ASN 48 16.725 21.189 10.973 392 2HB ASN 48 2HB ASN 48 16.903 19.645 10.143 393 1HD2 ASN 48 1HD2 ASN 48 14.513 20.898 10.100 394 2HD2 ASN 48 2HD2 ASN 48 13.370 20.049 11.079 395 H GLU 49 H GLU 49 16.525 17.873 13.395 396 HA GLU 49 HA GLU 49 18.198 15.708 12.319 397 1HB GLU 49 1HB GLU 49 16.497 15.818 14.816 398 2HB GLU 49 2HB GLU 49 17.366 14.392 14.267 399 1HG GLU 49 1HG GLU 49 19.346 16.255 14.303 400 2HG GLU 49 2HG GLU 49 18.338 16.776 15.652 401 HE2 GLU 49 HE2 GLU 49 20.306 13.355 15.962 402 H ARG 50 H ARG 50 17.222 13.756 11.624 403 HA ARG 50 HA ARG 50 14.419 14.087 10.782 404 1HB ARG 50 1HB ARG 50 16.819 13.001 9.423 405 2HB ARG 50 2HB ARG 50 15.306 12.154 9.133 406 1HG ARG 50 1HG ARG 50 15.669 15.114 8.740 407 2HG ARG 50 2HG ARG 50 15.856 13.914 7.459 408 1HD ARG 50 1HD ARG 50 13.668 14.459 7.132 409 2HD ARG 50 2HD ARG 50 13.465 13.167 8.315 410 HE ARG 50 HE ARG 50 13.716 15.778 9.490 411 1HH1 ARG 50 1HH1 ARG 50 11.497 13.474 8.092 412 2HH1 ARG 50 2HH1 ARG 50 10.115 14.122 8.909 413 1HH2 ARG 50 1HH2 ARG 50 11.898 16.631 10.565 414 2HH2 ARG 50 2HH2 ARG 50 10.341 15.915 10.312 415 HA PRO 51 HA PRO 51 14.282 10.607 13.786 416 1HB PRO 51 1HB PRO 51 11.720 11.074 14.558 417 2HB PRO 51 2HB PRO 51 13.104 11.921 15.257 418 1HG PRO 51 1HG PRO 51 11.206 12.830 13.128 419 2HG PRO 51 2HG PRO 51 11.852 13.733 14.511 420 1HD PRO 51 1HD PRO 51 12.841 14.008 12.008 421 2HD PRO 51 2HD PRO 51 13.858 14.160 13.455 422 H TRP 52 H TRP 52 12.059 11.577 11.242 423 HA TRP 52 HA TRP 52 10.832 10.393 9.739 424 1HB TRP 52 1HB TRP 52 12.932 8.451 10.557 425 2HB TRP 52 2HB TRP 52 11.545 7.817 9.677 426 HD1 TRP 52 HD1 TRP 52 11.036 9.814 7.446 427 HE1 TRP 52 HE1 TRP 52 12.784 10.329 5.627 428 HE3 TRP 52 HE3 TRP 52 15.248 8.294 9.914 429 HZ2 TRP 52 HZ2 TRP 52 15.578 10.117 5.284 430 HZ3 TRP 52 HZ3 TRP 52 17.418 8.483 8.769 431 HH2 TRP 52 HH2 TRP 52 17.577 9.376 6.502 432 H GLY 53 H GLY 53 8.779 9.767 9.907 433 1HA GLY 53 1HA GLY 53 7.661 8.994 12.386 434 2HA GLY 53 2HA GLY 53 6.830 8.984 10.838 435 H GLY 54 H GLY 54 5.768 7.043 11.544 436 1HA GLY 54 1HA GLY 54 7.070 4.692 10.607 437 2HA GLY 54 2HA GLY 54 6.981 4.693 12.362 438 H GLY 55 H GLY 55 5.736 2.749 10.801 439 1HA GLY 55 1HA GLY 55 2.896 3.394 11.303 440 2HA GLY 55 2HA GLY 55 3.400 2.510 9.871 441 H PHE 56 H PHE 56 1.566 1.722 12.020 442 HA PHE 56 HA PHE 56 2.716 -0.891 12.524 443 1HB PHE 56 1HB PHE 56 2.872 1.059 14.519 444 2HB PHE 56 2HB PHE 56 1.500 0.059 14.983 445 HD1 PHE 56 HD1 PHE 56 2.285 -2.597 14.137 446 HD2 PHE 56 HD2 PHE 56 4.626 0.490 15.898 447 HE1 PHE 56 HE1 PHE 56 3.823 -4.288 15.046 448 HE2 PHE 56 HE2 PHE 56 6.170 -1.195 16.810 449 HZ PHE 56 HZ PHE 56 5.770 -3.588 16.384 450 H GLY 57 H GLY 57 1.207 -2.465 12.462 451 1HA GLY 57 1HA GLY 57 -1.525 -2.040 13.189 452 2HA GLY 57 2HA GLY 57 -1.316 -2.064 11.445 453 H LEU 58 H LEU 58 -2.754 -3.941 11.580 454 HA LEU 58 HA LEU 58 -1.204 -6.388 12.093 455 1HB LEU 58 1HB LEU 58 -3.168 -7.496 12.961 456 2HB LEU 58 2HB LEU 58 -2.830 -6.057 13.905 457 HG LEU 58 HG LEU 58 -4.857 -6.024 11.687 458 1HD1 LEU 58 1HD1 LEU 58 -5.073 -7.214 14.386 459 2HD1 LEU 58 2HD1 LEU 58 -5.933 -7.605 12.897 460 3HD1 LEU 58 3HD1 LEU 58 -6.411 -6.199 13.849 461 1HD2 LEU 58 1HD2 LEU 58 -3.978 -4.226 13.854 462 2HD2 LEU 58 2HD2 LEU 58 -5.716 -4.312 13.572 463 3HD2 LEU 58 3HD2 LEU 58 -4.632 -3.852 12.259 464 H SER 59 H SER 59 -2.552 -8.329 11.088 465 HA SER 59 HA SER 59 -3.689 -7.531 8.509 466 1HB SER 59 1HB SER 59 -1.497 -9.601 8.785 467 2HB SER 59 2HB SER 59 -2.295 -9.115 7.289 468 HG SER 59 HG SER 59 -1.470 -6.949 7.788 469 H ARG 60 H ARG 60 -4.723 -9.394 7.377 470 HA ARG 60 HA ARG 60 -5.391 -11.707 8.962 471 1HB ARG 60 1HB ARG 60 -7.348 -9.481 8.507 472 2HB ARG 60 2HB ARG 60 -7.917 -11.141 8.618 473 1HG ARG 60 1HG ARG 60 -6.634 -11.240 10.827 474 2HG ARG 60 2HG ARG 60 -6.565 -9.481 10.713 475 1HD ARG 60 1HD ARG 60 -9.231 -10.264 10.173 476 2HD ARG 60 2HD ARG 60 -8.706 -11.137 11.612 477 HE ARG 60 HE ARG 60 -8.682 -9.159 12.767 478 1HH1 ARG 60 1HH1 ARG 60 -8.862 -8.475 9.350 479 2HH1 ARG 60 2HH1 ARG 60 -9.146 -6.782 9.576 480 1HH2 ARG 60 1HH2 ARG 60 -9.055 -6.933 13.068 481 2HH2 ARG 60 2HH2 ARG 60 -9.256 -5.906 11.687 482 H TRP 61 H TRP 61 -5.940 -13.408 7.704 483 HA TRP 61 HA TRP 61 -6.240 -12.880 4.825 484 1HB TRP 61 1HB TRP 61 -5.385 -15.149 4.467 485 2HB TRP 61 2HB TRP 61 -4.255 -14.198 5.426 486 HD1 TRP 61 HD1 TRP 61 -4.325 -14.722 8.165 487 HE1 TRP 61 HE1 TRP 61 -4.689 -16.972 9.359 488 HE3 TRP 61 HE3 TRP 61 -6.494 -17.331 4.340 489 HZ2 TRP 61 HZ2 TRP 61 -5.756 -19.517 8.760 490 HZ3 TRP 61 HZ3 TRP 61 -7.157 -19.668 4.734 491 HH2 TRP 61 HH2 TRP 61 -6.793 -20.737 6.898 492 H ASP 62 H ASP 62 -8.039 -13.495 3.787 493 HA ASP 62 HA ASP 62 -10.104 -14.864 5.355 494 1HB ASP 62 1HB ASP 62 -10.388 -12.568 4.086 495 2HB ASP 62 2HB ASP 62 -10.657 -13.615 2.694 496 HD2 ASP 62 HD2 ASP 62 -13.444 -14.987 4.708 497 H GLU 63 H GLU 63 -10.829 -16.832 4.845 498 HA GLU 63 HA GLU 63 -9.438 -18.555 3.178 499 1HB GLU 63 1HB GLU 63 -11.276 -20.119 3.487 500 2HB GLU 63 2HB GLU 63 -10.919 -19.294 4.998 501 1HG GLU 63 1HG GLU 63 -13.162 -19.103 5.055 502 2HG GLU 63 2HG GLU 63 -12.822 -17.670 4.086 503 HE2 GLU 63 HE2 GLU 63 -14.302 -19.041 1.281 504 H LYS 64 H LYS 64 -11.887 -16.259 2.376 505 HA LYS 64 HA LYS 64 -12.433 -17.508 -0.201 506 1HB LYS 64 1HB LYS 64 -14.208 -16.401 1.271 507 2HB LYS 64 2HB LYS 64 -13.506 -14.867 0.772 508 1HG LYS 64 1HG LYS 64 -15.169 -15.067 -0.770 509 2HG LYS 64 2HG LYS 64 -13.855 -15.869 -1.634 510 1HD LYS 64 1HD LYS 64 -14.825 -17.983 -0.345 511 2HD LYS 64 2HD LYS 64 -16.297 -17.012 -0.394 512 1HE LYS 64 1HE LYS 64 -14.767 -17.210 -2.913 513 2HE LYS 64 2HE LYS 64 -15.557 -18.685 -2.361 514 1HZ LYS 64 1HZ LYS 64 -17.548 -16.992 -2.054 515 2HZ LYS 64 2HZ LYS 64 -17.257 -17.779 -3.523 516 3HZ LYS 64 3HZ LYS 64 -16.734 -16.187 -3.299 517 H GLY 65 H GLY 65 -9.769 -16.354 0.499 518 1HA GLY 65 1HA GLY 65 -8.114 -15.229 -0.625 519 2HA GLY 65 2HA GLY 65 -9.219 -15.128 -1.987 520 H ASN 66 H ASN 66 -9.216 -13.750 1.304 521 HA ASN 66 HA ASN 66 -9.337 -11.079 0.084 522 1HB ASN 66 1HB ASN 66 -11.518 -12.273 1.248 523 2HB ASN 66 2HB ASN 66 -10.850 -11.343 2.586 524 1HD2 ASN 66 1HD2 ASN 66 -10.370 -9.050 2.117 525 2HD2 ASN 66 2HD2 ASN 66 -11.455 -8.191 1.084 526 H TRP 67 H TRP 67 -7.362 -10.331 0.613 527 HA TRP 67 HA TRP 67 -6.262 -10.812 3.259 528 1HB TRP 67 1HB TRP 67 -4.922 -10.873 1.074 529 2HB TRP 67 2HB TRP 67 -5.021 -9.115 1.098 530 HD1 TRP 67 HD1 TRP 67 -4.452 -8.523 4.123 531 HE1 TRP 67 HE1 TRP 67 -2.128 -8.984 5.126 532 HE3 TRP 67 HE3 TRP 67 -2.751 -11.923 0.703 533 HZ2 TRP 67 HZ2 TRP 67 0.128 -10.579 4.545 534 HZ3 TRP 67 HZ3 TRP 67 -0.500 -12.868 0.999 535 HH2 TRP 67 HH2 TRP 67 0.910 -12.209 2.881 536 H HIS 68 H HIS 68 -7.113 -9.584 4.822 537 HA HIS 68 HA HIS 68 -7.727 -6.776 4.283 538 1HB HIS 68 1HB HIS 68 -9.129 -8.646 5.667 539 2HB HIS 68 2HB HIS 68 -8.241 -7.876 6.977 540 HD1 HIS 68 HD1 HIS 68 -9.558 -6.019 3.972 541 HD2 HIS 68 HD2 HIS 68 -10.364 -6.465 8.024 542 HE1 HIS 68 HE1 HIS 68 -11.277 -4.264 4.513 543 HE2 HIS 68 HE2 HIS 68 -11.814 -4.613 6.949 544 H GLY 69 H GLY 69 -6.423 -5.179 4.901 545 1HA GLY 69 1HA GLY 69 -4.499 -5.704 7.075 546 2HA GLY 69 2HA GLY 69 -3.963 -4.989 5.562 547 H LEU 70 H LEU 70 -4.271 -4.127 8.534 548 HA LEU 70 HA LEU 70 -5.278 -1.447 7.877 549 1HB LEU 70 1HB LEU 70 -7.013 -2.695 9.125 550 2HB LEU 70 2HB LEU 70 -5.873 -2.934 10.435 551 HG LEU 70 HG LEU 70 -6.382 -0.132 9.604 552 1HD1 LEU 70 1HD1 LEU 70 -8.503 0.058 10.384 553 2HD1 LEU 70 2HD1 LEU 70 -8.331 -1.291 11.506 554 3HD1 LEU 70 3HD1 LEU 70 -8.593 -1.600 9.790 555 1HD2 LEU 70 1HD2 LEU 70 -4.911 -1.186 11.545 556 2HD2 LEU 70 2HD2 LEU 70 -6.449 -1.114 12.403 557 3HD2 LEU 70 3HD2 LEU 70 -5.744 0.357 11.733 558 H TYR 71 H TYR 71 -3.624 -0.101 8.085 559 HA TYR 71 HA TYR 71 -1.818 -0.445 10.385 560 1HB TYR 71 1HB TYR 71 -0.923 0.620 7.709 561 2HB TYR 71 2HB TYR 71 0.078 0.119 9.068 562 HD1 TYR 71 HD1 TYR 71 -1.166 -0.837 5.935 563 HD2 TYR 71 HD2 TYR 71 -0.229 -2.419 9.771 564 HE1 TYR 71 HE1 TYR 71 -0.975 -3.085 4.956 565 HE2 TYR 71 HE2 TYR 71 -0.034 -4.670 8.803 566 HH TYR 71 HH TYR 71 0.478 -5.638 6.482 567 H ALA 72 H ALA 72 -0.981 1.458 11.308 568 HA ALA 72 HA ALA 72 -2.282 3.953 10.441 569 1HB ALA 72 1HB ALA 72 -2.819 4.559 12.645 570 2HB ALA 72 2HB ALA 72 -1.792 3.300 13.331 571 3HB ALA 72 3HB ALA 72 -3.293 2.865 12.512 572 H MET 73 H MET 73 -0.710 5.213 9.687 573 HA MET 73 HA MET 73 1.951 5.100 10.875 574 1HB MET 73 1HB MET 73 1.351 5.163 8.320 575 2HB MET 73 2HB MET 73 1.235 6.897 8.591 576 1HG MET 73 1HG MET 73 3.485 7.110 9.058 577 2HG MET 73 2HG MET 73 3.662 5.408 9.482 578 1HE MET 73 1HE MET 73 6.059 6.251 7.503 579 2HE MET 73 2HE MET 73 5.857 4.735 6.624 580 3HE MET 73 3HE MET 73 5.560 4.792 8.361 581 H ALA 74 H ALA 74 3.101 7.266 11.094 582 HA ALA 74 HA ALA 74 1.425 9.512 11.811 583 1HB ALA 74 1HB ALA 74 2.618 9.561 14.127 584 2HB ALA 74 2HB ALA 74 2.794 7.827 13.862 585 3HB ALA 74 3HB ALA 74 1.188 8.555 13.896 586 H PHE 75 H PHE 75 2.488 11.425 11.648 587 HA PHE 75 HA PHE 75 5.382 11.286 11.107 588 1HB PHE 75 1HB PHE 75 3.788 11.937 9.203 589 2HB PHE 75 2HB PHE 75 3.546 13.444 10.080 590 HD1 PHE 75 HD1 PHE 75 5.773 11.525 7.972 591 HD2 PHE 75 HD2 PHE 75 5.437 14.996 10.412 592 HE1 PHE 75 HE1 PHE 75 7.799 12.452 6.927 593 HE2 PHE 75 HE2 PHE 75 7.461 15.930 9.370 594 HZ PHE 75 HZ PHE 75 8.645 14.657 7.625 595 H LYS 76 H LYS 76 6.414 11.943 12.884 596 HA LYS 76 HA LYS 76 5.292 14.052 14.548 597 1HB LYS 76 1HB LYS 76 6.373 11.909 15.440 598 2HB LYS 76 2HB LYS 76 7.911 12.628 14.985 599 1HG LYS 76 1HG LYS 76 6.076 14.237 16.670 600 2HG LYS 76 2HG LYS 76 6.913 12.874 17.416 601 1HD LYS 76 1HD LYS 76 9.059 13.787 16.662 602 2HD LYS 76 2HD LYS 76 8.217 15.152 15.925 603 1HE LYS 76 1HE LYS 76 7.969 14.491 18.847 604 2HE LYS 76 2HE LYS 76 9.249 15.530 18.221 605 1HZ LYS 76 1HZ LYS 76 7.325 16.823 17.159 606 2HZ LYS 76 2HZ LYS 76 7.588 17.006 18.819 607 3HZ LYS 76 3HZ LYS 76 6.339 16.009 18.267 608 H ASP 77 H ASP 77 5.662 16.083 13.954 609 HA ASP 77 HA ASP 77 8.299 16.757 12.828 610 1HB ASP 77 1HB ASP 77 5.927 17.137 11.598 611 2HB ASP 77 2HB ASP 77 6.052 18.657 12.479 612 HD2 ASP 77 HD2 ASP 77 9.104 18.075 10.024 613 H SER 78 H SER 78 9.308 18.692 13.494 614 HA SER 78 HA SER 78 8.749 19.380 16.250 615 1HB SER 78 1HB SER 78 11.079 19.003 15.218 616 2HB SER 78 2HB SER 78 10.896 20.620 14.537 617 HG SER 78 HG SER 78 10.953 21.483 16.521 618 H TRP 79 H TRP 79 7.989 20.627 13.164 619 HA TRP 79 HA TRP 79 7.953 23.366 13.526 620 1HB TRP 79 1HB TRP 79 6.431 21.450 11.849 621 2HB TRP 79 2HB TRP 79 5.734 23.056 12.029 622 HD1 TRP 79 HD1 TRP 79 9.520 22.784 11.958 623 HE1 TRP 79 HE1 TRP 79 10.392 23.781 9.750 624 HE3 TRP 79 HE3 TRP 79 5.064 23.406 9.530 625 HZ2 TRP 79 HZ2 TRP 79 9.331 24.707 7.304 626 HZ3 TRP 79 HZ3 TRP 79 5.080 24.354 7.260 627 HH2 TRP 79 HH2 TRP 79 7.170 24.991 6.172 628 H ASN 80 H ASN 80 5.091 21.264 13.912 629 HA ASN 80 HA ASN 80 4.211 23.024 16.100 630 1HB ASN 80 1HB ASN 80 2.776 22.232 13.627 631 2HB ASN 80 2HB ASN 80 1.834 22.228 15.115 632 1HD2 ASN 80 1HD2 ASN 80 0.995 24.079 15.768 633 2HD2 ASN 80 2HD2 ASN 80 1.432 25.646 15.187 634 H LYS 81 H LYS 81 2.817 20.107 14.627 635 HA LYS 81 HA LYS 81 3.523 18.497 16.926 636 1HB LYS 81 1HB LYS 81 1.258 19.870 17.250 637 2HB LYS 81 2HB LYS 81 0.610 18.523 16.324 638 1HG LYS 81 1HG LYS 81 2.347 17.641 18.472 639 2HG LYS 81 2HG LYS 81 0.991 18.608 19.054 640 1HD LYS 81 1HD LYS 81 0.566 16.384 17.089 641 2HD LYS 81 2HD LYS 81 0.685 16.054 18.819 642 1HE LYS 81 1HE LYS 81 -1.269 17.173 19.302 643 2HE LYS 81 2HE LYS 81 -1.166 18.190 17.866 644 1HZ LYS 81 1HZ LYS 81 -2.088 16.591 16.553 645 2HZ LYS 81 2HZ LYS 81 -2.863 16.222 18.011 646 3HZ LYS 81 3HZ LYS 81 -1.535 15.306 17.505 647 H TRP 82 H TRP 82 2.591 16.229 16.674 648 HA TRP 82 HA TRP 82 3.247 15.288 14.062 649 1HB TRP 82 1HB TRP 82 2.617 13.050 15.004 650 2HB TRP 82 2HB TRP 82 3.828 13.916 15.945 651 HD1 TRP 82 HD1 TRP 82 3.310 14.298 18.449 652 HE1 TRP 82 HE1 TRP 82 1.286 13.845 19.973 653 HE3 TRP 82 HE3 TRP 82 -0.118 13.004 14.884 654 HZ2 TRP 82 HZ2 TRP 82 -1.407 13.046 19.701 655 HZ3 TRP 82 HZ3 TRP 82 -2.397 12.409 15.599 656 HH2 TRP 82 HH2 TRP 82 -3.025 12.429 17.959 657 H GLU 83 H GLU 83 1.905 14.149 12.600 658 HA GLU 83 HA GLU 83 -0.949 14.839 12.838 659 1HB GLU 83 1HB GLU 83 0.561 14.372 10.267 660 2HB GLU 83 2HB GLU 83 -1.060 15.027 10.451 661 1HG GLU 83 1HG GLU 83 0.987 16.548 11.869 662 2HG GLU 83 2HG GLU 83 1.221 16.489 10.123 663 HE2 GLU 83 HE2 GLU 83 -1.981 18.078 9.707 664 HA PRO 84 HA PRO 84 -1.453 10.391 12.807 665 1HB PRO 84 1HB PRO 84 -4.112 10.322 13.157 666 2HB PRO 84 2HB PRO 84 -3.017 10.794 14.463 667 1HG PRO 84 1HG PRO 84 -4.660 12.520 12.652 668 2HG PRO 84 2HG PRO 84 -4.397 12.664 14.399 669 1HD PRO 84 1HD PRO 84 -3.053 14.145 12.523 670 2HD PRO 84 2HD PRO 84 -2.403 13.758 14.128 671 H ILE 85 H ILE 85 -2.065 8.835 11.338 672 HA ILE 85 HA ILE 85 -3.843 9.462 9.151 673 HB ILE 85 HB ILE 85 -1.709 10.404 8.353 674 1HG1 ILE 85 1HG1 ILE 85 -1.561 8.601 6.333 675 2HG1 ILE 85 2HG1 ILE 85 -3.115 8.159 7.033 676 1HG2 ILE 85 1HG2 ILE 85 -0.615 7.604 8.358 677 2HG2 ILE 85 2HG2 ILE 85 -0.303 8.756 9.657 678 3HG2 ILE 85 3HG2 ILE 85 0.235 9.111 8.015 679 1HD1 ILE 85 1HD1 ILE 85 -2.782 10.047 5.147 680 2HD1 ILE 85 2HD1 ILE 85 -2.703 11.034 6.607 681 3HD1 ILE 85 3HD1 ILE 85 -4.117 10.026 6.300 682 H ALA 86 H ALA 86 -5.063 7.712 8.969 683 HA ALA 86 HA ALA 86 -3.867 5.084 9.544 684 1HB ALA 86 1HB ALA 86 -5.595 5.160 11.019 685 2HB ALA 86 2HB ALA 86 -6.464 4.522 9.624 686 3HB ALA 86 3HB ALA 86 -6.557 6.239 10.010 687 H GLY 87 H GLY 87 -4.576 3.260 8.252 688 1HA GLY 87 1HA GLY 87 -5.864 3.799 5.713 689 2HA GLY 87 2HA GLY 87 -4.156 3.405 5.596 690 H TYR 88 H TYR 88 -6.847 2.042 4.902 691 HA TYR 88 HA TYR 88 -5.919 -0.621 5.500 692 1HB TYR 88 1HB TYR 88 -8.140 -1.302 6.488 693 2HB TYR 88 2HB TYR 88 -7.139 -0.293 7.526 694 HD1 TYR 88 HD1 TYR 88 -10.316 -0.638 5.894 695 HD2 TYR 88 HD2 TYR 88 -7.675 2.182 7.676 696 HE1 TYR 88 HE1 TYR 88 -12.182 0.946 6.140 697 HE2 TYR 88 HE2 TYR 88 -9.533 3.773 7.927 698 HH TYR 88 HH TYR 88 -11.938 3.796 8.031 699 H GLY 89 H GLY 89 -6.858 -2.213 4.180 700 1HA GLY 89 1HA GLY 89 -9.085 -1.740 2.491 701 2HA GLY 89 2HA GLY 89 -7.595 -1.430 1.615 702 H TRP 90 H TRP 90 -8.571 -3.237 0.305 703 HA TRP 90 HA TRP 90 -7.944 -5.862 1.474 704 1HB TRP 90 1HB TRP 90 -9.346 -6.800 -0.339 705 2HB TRP 90 2HB TRP 90 -10.238 -5.684 0.692 706 HD1 TRP 90 HD1 TRP 90 -8.935 -6.083 -2.868 707 HE1 TRP 90 HE1 TRP 90 -10.005 -4.274 -4.353 708 HE3 TRP 90 HE3 TRP 90 -11.209 -3.295 0.763 709 HZ2 TRP 90 HZ2 TRP 90 -11.601 -1.969 -4.027 710 HZ3 TRP 90 HZ3 TRP 90 -12.488 -1.302 0.092 711 HH2 TRP 90 HH2 TRP 90 -12.679 -0.654 -2.253 712 H GLU 91 H GLU 91 -6.712 -7.366 0.292 713 HA GLU 91 HA GLU 91 -5.330 -6.378 -2.091 714 1HB GLU 91 1HB GLU 91 -4.050 -5.983 0.159 715 2HB GLU 91 2HB GLU 91 -3.715 -7.705 0.054 716 1HG GLU 91 1HG GLU 91 -3.186 -6.230 -2.415 717 2HG GLU 91 2HG GLU 91 -2.195 -5.736 -1.043 718 HE2 GLU 91 HE2 GLU 91 -0.882 -9.078 -0.866 719 H SER 92 H SER 92 -4.616 -7.972 -3.490 720 HA SER 92 HA SER 92 -5.380 -10.729 -2.782 721 1HB SER 92 1HB SER 92 -5.907 -11.045 -5.212 722 2HB SER 92 2HB SER 92 -6.968 -9.894 -4.398 723 HG SER 92 HG SER 92 -6.338 -8.470 -5.791 724 H THR 93 H THR 93 -3.482 -11.698 -2.365 725 HA THR 93 HA THR 93 -1.085 -11.075 -3.821 726 HB THR 93 HB THR 93 -1.016 -11.701 -1.443 727 HG1 THR 93 HG1 THR 93 0.729 -13.074 -1.627 728 1HG2 THR 93 1HG2 THR 93 -2.842 -13.399 -1.526 729 2HG2 THR 93 2HG2 THR 93 -1.389 -13.909 -0.664 730 3HG2 THR 93 3HG2 THR 93 -1.698 -14.500 -2.297 731 H TRP 94 H TRP 94 -0.577 -11.865 -5.742 732 HA TRP 94 HA TRP 94 -1.715 -14.460 -6.548 733 1HB TRP 94 1HB TRP 94 -1.193 -11.933 -8.052 734 2HB TRP 94 2HB TRP 94 -1.061 -13.463 -8.914 735 HD1 TRP 94 HD1 TRP 94 -3.546 -10.922 -7.924 736 HE1 TRP 94 HE1 TRP 94 -5.935 -11.771 -8.362 737 HE3 TRP 94 HE3 TRP 94 -2.517 -15.865 -8.723 738 HZ2 TRP 94 HZ2 TRP 94 -7.215 -14.214 -8.967 739 HZ3 TRP 94 HZ3 TRP 94 -4.380 -17.392 -9.226 740 HH2 TRP 94 HH2 TRP 94 -6.680 -16.581 -9.344 741 H ARG 95 H ARG 95 -0.390 -15.875 -7.805 742 HA ARG 95 HA ARG 95 2.477 -15.507 -7.265 743 1HB ARG 95 1HB ARG 95 2.614 -17.994 -7.522 744 2HB ARG 95 2HB ARG 95 1.641 -17.459 -6.159 745 1HG ARG 95 1HG ARG 95 0.216 -17.943 -8.703 746 2HG ARG 95 2HG ARG 95 0.850 -19.354 -7.854 747 1HD ARG 95 1HD ARG 95 -0.281 -18.054 -5.795 748 2HD ARG 95 2HD ARG 95 -1.321 -17.495 -7.103 749 HE ARG 95 HE ARG 95 -1.308 -20.080 -5.929 750 1HH1 ARG 95 1HH1 ARG 95 -1.767 -18.425 -8.967 751 2HH1 ARG 95 2HH1 ARG 95 -2.803 -19.649 -9.620 752 1HH2 ARG 95 1HH2 ARG 95 -2.671 -21.691 -6.787 753 2HH2 ARG 95 2HH2 ARG 95 -3.318 -21.502 -8.382 754 HA PRO 96 HA PRO 96 3.070 -15.233 -11.658 755 1HB PRO 96 1HB PRO 96 5.751 -15.483 -11.746 756 2HB PRO 96 2HB PRO 96 4.964 -14.032 -11.114 757 1HG PRO 96 1HG PRO 96 6.147 -16.345 -9.628 758 2HG PRO 96 2HG PRO 96 6.281 -14.610 -9.286 759 1HD PRO 96 1HD PRO 96 4.551 -16.269 -7.981 760 2HD PRO 96 2HD PRO 96 4.246 -14.537 -8.227 761 H LEU 97 H LEU 97 4.853 -16.484 -13.212 762 HA LEU 97 HA LEU 97 4.145 -19.323 -12.911 763 1HB LEU 97 1HB LEU 97 3.708 -17.628 -15.025 764 2HB LEU 97 2HB LEU 97 5.180 -18.447 -15.512 765 HG LEU 97 HG LEU 97 2.817 -20.035 -14.575 766 1HD1 LEU 97 1HD1 LEU 97 3.119 -19.631 -17.477 767 2HD1 LEU 97 2HD1 LEU 97 2.470 -18.264 -16.571 768 3HD1 LEU 97 3HD1 LEU 97 1.665 -19.832 -16.500 769 1HD2 LEU 97 1HD2 LEU 97 5.057 -20.595 -16.516 770 2HD2 LEU 97 2HD2 LEU 97 3.791 -21.726 -16.040 771 3HD2 LEU 97 3HD2 LEU 97 4.966 -21.164 -14.849 772 H ALA 98 H ALA 98 5.687 -20.884 -12.926 773 HA ALA 98 HA ALA 98 7.736 -21.856 -12.738 774 1HB ALA 98 1HB ALA 98 9.587 -20.463 -14.083 775 2HB ALA 98 2HB ALA 98 8.130 -19.791 -14.812 776 3HB ALA 98 3HB ALA 98 8.422 -21.528 -14.868 777 H ASP 99 H ASP 99 6.874 -19.864 -10.792 778 HA ASP 99 HA ASP 99 9.296 -19.627 -9.328 779 1HB ASP 99 1HB ASP 99 9.123 -17.628 -11.116 780 2HB ASP 99 2HB ASP 99 8.183 -16.916 -9.808 781 HD2 ASP 99 HD2 ASP 99 11.797 -17.847 -8.546 782 H GLU 100 H GLU 100 8.713 -19.914 -7.286 783 HA GLU 100 HA GLU 100 6.002 -19.118 -6.473 784 1HB GLU 100 1HB GLU 100 6.214 -20.779 -4.688 785 2HB GLU 100 2HB GLU 100 6.480 -21.509 -6.265 786 1HG GLU 100 1HG GLU 100 8.291 -22.412 -5.346 787 2HG GLU 100 2HG GLU 100 9.013 -20.813 -5.522 788 HE2 GLU 100 HE2 GLU 100 9.553 -21.043 -2.128 789 H ASN 101 H ASN 101 9.401 -18.855 -5.665 790 HA ASN 101 HA ASN 101 9.171 -17.680 -3.134 791 1HB ASN 101 1HB ASN 101 11.266 -17.798 -5.238 792 2HB ASN 101 2HB ASN 101 11.437 -16.544 -4.014 793 1HD2 ASN 101 1HD2 ASN 101 13.048 -18.932 -4.539 794 2HD2 ASN 101 2HD2 ASN 101 13.067 -19.821 -3.058 795 H PHE 102 H PHE 102 8.833 -16.345 -6.342 796 HA PHE 102 HA PHE 102 8.863 -13.607 -5.425 797 1HB PHE 102 1HB PHE 102 9.613 -14.471 -7.735 798 2HB PHE 102 2HB PHE 102 7.897 -14.530 -8.122 799 HD1 PHE 102 HD1 PHE 102 6.586 -12.300 -7.556 800 HD2 PHE 102 HD2 PHE 102 10.776 -12.565 -8.249 801 HE1 PHE 102 HE1 PHE 102 6.635 -9.911 -8.140 802 HE2 PHE 102 HE2 PHE 102 10.834 -10.176 -8.835 803 HZ PHE 102 HZ PHE 102 8.762 -8.846 -8.781 804 H HIS 103 H HIS 103 7.160 -12.380 -4.884 805 HA HIS 103 HA HIS 103 4.469 -13.519 -5.273 806 1HB HIS 103 1HB HIS 103 5.764 -12.344 -2.872 807 2HB HIS 103 2HB HIS 103 4.071 -11.943 -3.135 808 HD1 HIS 103 HD1 HIS 103 4.270 -13.443 -0.717 809 HD2 HIS 103 HD2 HIS 103 4.343 -15.421 -4.370 810 HE1 HIS 103 HE1 HIS 103 3.625 -15.819 -0.208 811 HE2 HIS 103 HE2 HIS 103 3.594 -16.977 -2.445 812 H LEU 104 H LEU 104 2.895 -12.200 -6.048 813 HA LEU 104 HA LEU 104 3.324 -9.333 -6.201 814 1HB LEU 104 1HB LEU 104 3.071 -9.189 -8.591 815 2HB LEU 104 2HB LEU 104 4.435 -10.224 -8.215 816 HG LEU 104 HG LEU 104 2.558 -12.114 -8.460 817 1HD1 LEU 104 1HD1 LEU 104 1.654 -10.415 -10.692 818 2HD1 LEU 104 2HD1 LEU 104 1.036 -9.993 -9.095 819 3HD1 LEU 104 3HD1 LEU 104 0.774 -11.612 -9.743 820 1HD2 LEU 104 1HD2 LEU 104 3.580 -12.674 -10.438 821 2HD2 LEU 104 2HD2 LEU 104 4.770 -11.567 -9.754 822 3HD2 LEU 104 3HD2 LEU 104 3.655 -11.004 -10.999 823 H GLY 105 H GLY 105 1.470 -8.366 -5.715 824 1HA GLY 105 1HA GLY 105 -1.048 -9.598 -6.605 825 2HA GLY 105 2HA GLY 105 -0.846 -9.194 -4.907 826 H LEU 106 H LEU 106 -2.923 -8.024 -5.794 827 HA LEU 106 HA LEU 106 -2.186 -5.229 -6.004 828 1HB LEU 106 1HB LEU 106 -2.708 -6.565 -8.338 829 2HB LEU 106 2HB LEU 106 -4.287 -5.920 -7.933 830 HG LEU 106 HG LEU 106 -1.885 -4.127 -7.943 831 1HD1 LEU 106 1HD1 LEU 106 -3.417 -5.159 -10.301 832 2HD1 LEU 106 2HD1 LEU 106 -1.673 -4.991 -10.092 833 3HD1 LEU 106 3HD1 LEU 106 -2.677 -3.558 -10.321 834 1HD2 LEU 106 1HD2 LEU 106 -4.426 -3.690 -7.171 835 2HD2 LEU 106 2HD2 LEU 106 -4.544 -3.267 -8.879 836 3HD2 LEU 106 3HD2 LEU 106 -3.380 -2.441 -7.845 837 H GLY 107 H GLY 107 -3.724 -3.847 -5.170 838 1HA GLY 107 1HA GLY 107 -6.424 -4.662 -4.680 839 2HA GLY 107 2HA GLY 107 -5.446 -4.730 -3.221 840 H PHE 108 H PHE 108 -7.296 -3.109 -2.753 841 HA PHE 108 HA PHE 108 -6.396 -0.407 -3.510 842 1HB PHE 108 1HB PHE 108 -9.038 -1.624 -3.385 843 2HB PHE 108 2HB PHE 108 -8.952 -0.142 -2.438 844 HD1 PHE 108 HD1 PHE 108 -8.777 1.982 -3.483 845 HD2 PHE 108 HD2 PHE 108 -8.556 -1.580 -5.804 846 HE1 PHE 108 HE1 PHE 108 -9.022 3.310 -5.540 847 HE2 PHE 108 HE2 PHE 108 -8.799 -0.257 -7.864 848 HZ PHE 108 HZ PHE 108 -9.033 2.191 -7.734 849 H THR 109 H THR 109 -6.224 1.176 -1.919 850 HA THR 109 HA THR 109 -6.437 0.247 0.865 851 HB THR 109 HB THR 109 -4.365 1.914 1.113 852 HG1 THR 109 HG1 THR 109 -4.392 2.227 -1.234 853 1HG2 THR 109 1HG2 THR 109 -2.953 0.114 1.362 854 2HG2 THR 109 2HG2 THR 109 -3.711 -0.796 0.054 855 3HG2 THR 109 3HG2 THR 109 -4.541 -0.616 1.600 856 H ALA 110 H ALA 110 -7.907 1.450 1.856 857 HA ALA 110 HA ALA 110 -8.374 4.195 0.963 858 1HB ALA 110 1HB ALA 110 -10.158 2.275 1.473 859 2HB ALA 110 2HB ALA 110 -10.512 3.990 1.688 860 3HB ALA 110 3HB ALA 110 -10.064 3.001 3.077 861 H GLY 111 H GLY 111 -7.505 5.847 2.020 862 1HA GLY 111 1HA GLY 111 -6.596 5.409 4.791 863 2HA GLY 111 2HA GLY 111 -5.897 6.573 3.677 864 H VAL 112 H VAL 112 -7.287 6.657 6.432 865 HA VAL 112 HA VAL 112 -9.190 8.809 5.767 866 HB VAL 112 HB VAL 112 -10.145 8.375 8.068 867 1HG1 VAL 112 1HG1 VAL 112 -10.324 6.346 5.860 868 2HG1 VAL 112 2HG1 VAL 112 -11.434 7.663 6.237 869 3HG1 VAL 112 3HG1 VAL 112 -11.338 6.259 7.299 870 1HG2 VAL 112 1HG2 VAL 112 -8.036 7.005 8.689 871 2HG2 VAL 112 2HG2 VAL 112 -8.871 5.673 7.892 872 3HG2 VAL 112 3HG2 VAL 112 -9.610 6.473 9.280 873 H THR 113 H THR 113 -8.903 10.786 6.648 874 HA THR 113 HA THR 113 -6.549 11.138 8.380 875 HB THR 113 HB THR 113 -6.962 13.627 7.535 876 HG1 THR 113 HG1 THR 113 -7.973 12.053 5.406 877 1HG2 THR 113 1HG2 THR 113 -5.064 11.837 6.994 878 2HG2 THR 113 2HG2 THR 113 -5.169 13.404 6.191 879 3HG2 THR 113 3HG2 THR 113 -5.802 11.961 5.397 880 H ALA 114 H ALA 114 -6.657 12.747 10.060 881 HA ALA 114 HA ALA 114 -9.327 13.599 10.880 882 1HB ALA 114 1HB ALA 114 -9.308 12.577 12.975 883 2HB ALA 114 2HB ALA 114 -7.581 12.229 12.896 884 3HB ALA 114 3HB ALA 114 -8.711 11.318 11.895 885 H ARG 115 H ARG 115 -9.333 15.315 12.403 886 HA ARG 115 HA ARG 115 -6.822 16.829 12.416 887 1HB ARG 115 1HB ARG 115 -9.681 17.705 12.852 888 2HB ARG 115 2HB ARG 115 -8.291 18.771 12.999 889 1HG ARG 115 1HG ARG 115 -7.734 18.329 10.641 890 2HG ARG 115 2HG ARG 115 -9.185 17.331 10.510 891 1HD ARG 115 1HD ARG 115 -10.598 19.134 10.614 892 2HD ARG 115 2HD ARG 115 -9.459 20.110 11.539 893 HE ARG 115 HE ARG 115 -8.571 20.881 9.574 894 1HH1 ARG 115 1HH1 ARG 115 -10.547 18.084 8.904 895 2HH1 ARG 115 2HH1 ARG 115 -10.457 18.278 7.186 896 1HH2 ARG 115 1HH2 ARG 115 -8.453 21.138 7.313 897 2HH2 ARG 115 2HH2 ARG 115 -9.269 20.010 6.282 898 H ASP 116 H ASP 116 -6.875 18.452 14.437 899 HA ASP 116 HA ASP 116 -6.568 16.740 16.732 900 1HB ASP 116 1HB ASP 116 -6.214 19.735 16.477 901 2HB ASP 116 2HB ASP 116 -5.705 18.752 17.846 902 HD2 ASP 116 HD2 ASP 116 -3.117 19.218 15.132 903 H ASN 117 H ASN 117 -8.662 19.446 15.812 904 HA ASN 117 HA ASN 117 -10.211 19.123 18.265 905 1HB ASN 117 1HB ASN 117 -9.915 21.241 16.212 906 2HB ASN 117 2HB ASN 117 -11.508 21.087 16.946 907 1HD2 ASN 117 1HD2 ASN 117 -11.787 22.397 18.584 908 2HD2 ASN 117 2HD2 ASN 117 -10.582 22.894 19.717 909 H TRP 118 H TRP 118 -11.730 17.606 18.252 910 HA TRP 118 HA TRP 118 -12.830 16.455 15.926 911 1HB TRP 118 1HB TRP 118 -12.728 15.669 18.483 912 2HB TRP 118 2HB TRP 118 -14.366 16.315 18.470 913 HD1 TRP 118 HD1 TRP 118 -16.169 14.642 17.776 914 HE1 TRP 118 HE1 TRP 118 -16.224 12.412 16.494 915 HE3 TRP 118 HE3 TRP 118 -11.256 14.384 16.385 916 HZ2 TRP 118 HZ2 TRP 118 -14.424 10.761 15.080 917 HZ3 TRP 118 HZ3 TRP 118 -10.504 12.446 15.069 918 HH2 TRP 118 HH2 TRP 118 -12.056 10.673 14.431 919 H ASN 119 H ASN 119 -13.753 17.956 14.577 920 HA ASN 119 HA ASN 119 -16.253 19.160 15.553 921 1HB ASN 119 1HB ASN 119 -14.277 20.492 13.686 922 2HB ASN 119 2HB ASN 119 -15.816 21.163 14.215 923 1HD2 ASN 119 1HD2 ASN 119 -13.380 22.460 14.554 924 2HD2 ASN 119 2HD2 ASN 119 -13.040 22.567 16.244 925 H TYR 120 H TYR 120 -14.372 18.276 12.669 926 HA TYR 120 HA TYR 120 -16.896 17.812 11.234 927 1HB TYR 120 1HB TYR 120 -14.823 19.290 10.395 928 2HB TYR 120 2HB TYR 120 -14.295 17.721 9.796 929 HD1 TYR 120 HD1 TYR 120 -17.028 20.212 9.631 930 HD2 TYR 120 HD2 TYR 120 -15.284 16.753 7.874 931 HE1 TYR 120 HE1 TYR 120 -18.493 20.475 7.674 932 HE2 TYR 120 HE2 TYR 120 -16.743 17.006 5.912 933 HH TYR 120 HH TYR 120 -18.134 19.527 4.966 934 H ILE 121 H ILE 121 -16.776 15.966 9.617 935 HA ILE 121 HA ILE 121 -16.058 13.575 11.059 936 HB ILE 121 HB ILE 121 -17.024 12.396 9.070 937 1HG1 ILE 121 1HG1 ILE 121 -18.097 15.022 8.130 938 2HG1 ILE 121 2HG1 ILE 121 -16.479 14.546 7.625 939 1HG2 ILE 121 1HG2 ILE 121 -18.624 12.553 10.666 940 2HG2 ILE 121 2HG2 ILE 121 -19.373 13.602 9.462 941 3HG2 ILE 121 3HG2 ILE 121 -18.472 14.304 10.806 942 1HD1 ILE 121 1HD1 ILE 121 -19.109 13.337 6.949 943 2HD1 ILE 121 2HD1 ILE 121 -17.668 12.321 6.955 944 3HD1 ILE 121 3HD1 ILE 121 -17.745 13.736 5.905 945 HA PRO 122 HA PRO 122 -12.180 12.445 9.323 946 1HB PRO 122 1HB PRO 122 -13.455 9.948 8.312 947 2HB PRO 122 2HB PRO 122 -12.012 10.150 9.313 948 1HG PRO 122 1HG PRO 122 -14.300 9.326 10.391 949 2HG PRO 122 2HG PRO 122 -13.240 10.453 11.258 950 1HD PRO 122 1HD PRO 122 -15.799 10.984 9.815 951 2HD PRO 122 2HD PRO 122 -15.165 11.723 11.299 952 H LEU 123 H LEU 123 -11.066 11.923 7.292 953 HA LEU 123 HA LEU 123 -12.704 12.531 4.920 954 1HB LEU 123 1HB LEU 123 -10.138 13.712 5.860 955 2HB LEU 123 2HB LEU 123 -10.364 13.511 4.133 956 HG LEU 123 HG LEU 123 -12.580 14.784 4.474 957 1HD1 LEU 123 1HD1 LEU 123 -11.134 15.507 7.017 958 2HD1 LEU 123 2HD1 LEU 123 -12.681 14.671 6.885 959 3HD1 LEU 123 3HD1 LEU 123 -12.540 16.354 6.372 960 1HD2 LEU 123 1HD2 LEU 123 -11.269 16.990 4.538 961 2HD2 LEU 123 2HD2 LEU 123 -10.917 15.853 3.237 962 3HD2 LEU 123 3HD2 LEU 123 -9.831 15.972 4.621 963 HA PRO 124 HA PRO 124 -10.589 8.521 4.135 964 1HB PRO 124 1HB PRO 124 -12.613 7.436 2.703 965 2HB PRO 124 2HB PRO 124 -12.580 7.413 4.471 966 1HG PRO 124 1HG PRO 124 -14.057 9.252 2.628 967 2HG PRO 124 2HG PRO 124 -14.622 8.469 4.114 968 1HD PRO 124 1HD PRO 124 -13.808 11.057 4.032 969 2HD PRO 124 2HD PRO 124 -13.619 10.034 5.470 970 H VAL 125 H VAL 125 -9.765 7.638 2.186 971 HA VAL 125 HA VAL 125 -10.366 8.938 -0.331 972 HB VAL 125 HB VAL 125 -8.705 10.466 0.639 973 1HG1 VAL 125 1HG1 VAL 125 -6.334 9.575 0.845 974 2HG1 VAL 125 2HG1 VAL 125 -7.055 7.965 0.860 975 3HG1 VAL 125 3HG1 VAL 125 -7.465 9.127 2.121 976 1HG2 VAL 125 1HG2 VAL 125 -7.081 9.134 -1.425 977 2HG2 VAL 125 2HG2 VAL 125 -7.676 10.792 -1.341 978 3HG2 VAL 125 3HG2 VAL 125 -8.745 9.496 -1.879 979 H LEU 126 H LEU 126 -9.867 7.689 -2.088 980 HA LEU 126 HA LEU 126 -8.988 4.970 -1.496 981 1HB LEU 126 1HB LEU 126 -10.135 6.122 -4.040 982 2HB LEU 126 2HB LEU 126 -9.832 4.423 -3.725 983 HG LEU 126 HG LEU 126 -11.850 6.160 -2.302 984 1HD1 LEU 126 1HD1 LEU 126 -12.605 3.744 -3.832 985 2HD1 LEU 126 2HD1 LEU 126 -12.132 5.167 -4.760 986 3HD1 LEU 126 3HD1 LEU 126 -13.467 5.267 -3.612 987 1HD2 LEU 126 1HD2 LEU 126 -11.279 3.217 -1.978 988 2HD2 LEU 126 2HD2 LEU 126 -12.539 4.138 -1.158 989 3HD2 LEU 126 3HD2 LEU 126 -10.841 4.475 -0.822 990 H LEU 127 H LEU 127 -7.125 4.093 -2.206 991 HA LEU 127 HA LEU 127 -5.549 5.483 -4.231 992 1HB LEU 127 1HB LEU 127 -4.559 4.865 -1.450 993 2HB LEU 127 2HB LEU 127 -3.507 5.281 -2.789 994 HG LEU 127 HG LEU 127 -5.705 7.174 -2.138 995 1HD1 LEU 127 1HD1 LEU 127 -4.676 8.120 -0.284 996 2HD1 LEU 127 2HD1 LEU 127 -3.152 7.283 -0.579 997 3HD1 LEU 127 3HD1 LEU 127 -4.547 6.388 0.024 998 1HD2 LEU 127 1HD2 LEU 127 -3.581 8.685 -2.549 999 2HD2 LEU 127 2HD2 LEU 127 -4.482 7.980 -3.890 1000 3HD2 LEU 127 3HD2 LEU 127 -2.986 7.226 -3.339 1001 HA PRO 128 HA PRO 128 -5.360 0.997 -5.016 1002 1HB PRO 128 1HB PRO 128 -4.782 1.222 -7.653 1003 2HB PRO 128 2HB PRO 128 -6.425 1.372 -7.020 1004 1HG PRO 128 1HG PRO 128 -4.490 3.522 -7.788 1005 2HG PRO 128 2HG PRO 128 -6.227 3.407 -8.126 1006 1HD PRO 128 1HD PRO 128 -5.226 4.941 -6.129 1007 2HD PRO 128 2HD PRO 128 -6.813 4.153 -6.027 1008 H LEU 129 H LEU 129 -3.630 -0.350 -5.043 1009 HA LEU 129 HA LEU 129 -1.084 0.424 -6.113 1010 1HB LEU 129 1HB LEU 129 0.134 0.203 -3.952 1011 2HB LEU 129 2HB LEU 129 -0.874 1.633 -4.068 1012 HG LEU 129 HG LEU 129 -2.641 0.216 -2.805 1013 1HD1 LEU 129 1HD1 LEU 129 -1.272 -1.317 -1.177 1014 2HD1 LEU 129 2HD1 LEU 129 -0.174 -1.429 -2.551 1015 3HD1 LEU 129 3HD1 LEU 129 -1.854 -1.933 -2.722 1016 1HD2 LEU 129 1HD2 LEU 129 -1.607 0.851 -0.636 1017 2HD2 LEU 129 2HD2 LEU 129 -1.616 2.152 -1.827 1018 3HD2 LEU 129 3HD2 LEU 129 -0.129 1.259 -1.508 1019 H ALA 130 H ALA 130 0.615 -1.300 -5.519 1020 HA ALA 130 HA ALA 130 -0.714 -3.930 -5.406 1021 1HB ALA 130 1HB ALA 130 0.109 -3.515 -7.638 1022 2HB ALA 130 2HB ALA 130 1.084 -4.769 -6.873 1023 3HB ALA 130 3HB ALA 130 1.710 -3.127 -7.008 1024 H SER 131 H SER 131 0.587 -5.689 -4.544 1025 HA SER 131 HA SER 131 2.538 -4.742 -2.547 1026 1HB SER 131 1HB SER 131 0.277 -6.663 -2.366 1027 2HB SER 131 2HB SER 131 1.745 -7.078 -1.480 1028 HG SER 131 HG SER 131 1.116 -5.696 -0.044 1029 H VAL 132 H VAL 132 4.509 -5.643 -2.523 1030 HA VAL 132 HA VAL 132 4.971 -7.975 -4.268 1031 HB VAL 132 HB VAL 132 6.980 -5.806 -3.661 1032 1HG1 VAL 132 1HG1 VAL 132 7.004 -8.324 -5.221 1033 2HG1 VAL 132 2HG1 VAL 132 8.296 -7.538 -4.313 1034 3HG1 VAL 132 3HG1 VAL 132 7.852 -6.940 -5.911 1035 1HG2 VAL 132 1HG2 VAL 132 5.452 -4.648 -4.955 1036 2HG2 VAL 132 2HG2 VAL 132 4.987 -6.080 -5.873 1037 3HG2 VAL 132 3HG2 VAL 132 6.542 -5.305 -6.176 1038 H GLY 133 H GLY 133 5.587 -9.737 -3.209 1039 1HA GLY 133 1HA GLY 133 6.820 -9.413 -0.552 1040 2HA GLY 133 2HA GLY 133 5.916 -10.824 -1.077 1041 H TYR 134 H TYR 134 8.966 -9.537 -0.609 1042 HA TYR 134 HA TYR 134 10.171 -11.787 -2.060 1043 1HB TYR 134 1HB TYR 134 10.384 -9.492 -3.247 1044 2HB TYR 134 2HB TYR 134 11.537 -9.109 -1.973 1045 HD1 TYR 134 HD1 TYR 134 10.876 -11.262 -4.882 1046 HD2 TYR 134 HD2 TYR 134 13.721 -10.113 -1.935 1047 HE1 TYR 134 HE1 TYR 134 12.646 -12.399 -6.157 1048 HE2 TYR 134 HE2 TYR 134 15.499 -11.245 -3.201 1049 HH TYR 134 HH TYR 134 14.925 -13.441 -5.615 1050 H GLY 135 H GLY 135 11.127 -13.034 -0.601 1051 1HA GLY 135 1HA GLY 135 12.321 -13.711 1.238 1052 2HA GLY 135 2HA GLY 135 13.208 -12.205 1.063 1053 HA PRO 136 HA PRO 136 11.097 -11.907 5.130 1054 1HB PRO 136 1HB PRO 136 13.086 -10.573 6.381 1055 2HB PRO 136 2HB PRO 136 13.104 -12.330 6.178 1056 1HG PRO 136 1HG PRO 136 14.517 -10.225 4.585 1057 2HG PRO 136 2HG PRO 136 15.130 -11.780 5.176 1058 1HD PRO 136 1HD PRO 136 14.295 -11.394 2.618 1059 2HD PRO 136 2HD PRO 136 14.171 -12.957 3.449 1060 H VAL 137 H VAL 137 12.105 -9.686 2.774 1061 HA VAL 137 HA VAL 137 10.927 -7.424 4.242 1062 HB VAL 137 HB VAL 137 12.578 -7.278 1.720 1063 1HG1 VAL 137 1HG1 VAL 137 12.888 -4.897 2.827 1064 2HG1 VAL 137 2HG1 VAL 137 11.330 -5.298 3.552 1065 3HG1 VAL 137 3HG1 VAL 137 11.505 -5.265 1.797 1066 1HG2 VAL 137 1HG2 VAL 137 14.411 -6.503 3.231 1067 2HG2 VAL 137 2HG2 VAL 137 13.996 -8.207 3.408 1068 3HG2 VAL 137 3HG2 VAL 137 13.434 -7.035 4.600 1069 H THR 138 H THR 138 9.479 -6.007 3.118 1070 HA THR 138 HA THR 138 8.215 -7.136 0.723 1071 HB THR 138 HB THR 138 5.991 -6.348 1.845 1072 HG1 THR 138 HG1 THR 138 7.220 -5.505 3.699 1073 1HG2 THR 138 1HG2 THR 138 7.121 -8.802 3.110 1074 2HG2 THR 138 2HG2 THR 138 6.796 -8.753 1.377 1075 3HG2 THR 138 3HG2 THR 138 5.486 -8.488 2.528 1076 H PHE 139 H PHE 139 7.524 -5.658 -0.748 1077 HA PHE 139 HA PHE 139 7.788 -2.817 -0.009 1078 1HB PHE 139 1HB PHE 139 8.947 -4.346 -2.247 1079 2HB PHE 139 2HB PHE 139 8.215 -2.811 -2.704 1080 HD1 PHE 139 HD1 PHE 139 10.759 -4.371 -0.527 1081 HD2 PHE 139 HD2 PHE 139 9.283 -0.768 -2.243 1082 HE1 PHE 139 HE1 PHE 139 12.784 -3.191 0.220 1083 HE2 PHE 139 HE2 PHE 139 11.306 0.419 -1.501 1084 HZ PHE 139 HZ PHE 139 13.061 -0.792 -0.268 1085 H GLN 140 H GLN 140 6.301 -1.370 -0.867 1086 HA GLN 140 HA GLN 140 4.055 -2.536 -2.366 1087 1HB GLN 140 1HB GLN 140 3.458 -2.323 0.028 1088 2HB GLN 140 2HB GLN 140 3.802 -0.601 -0.057 1089 1HG GLN 140 1HG GLN 140 2.028 -0.390 -1.779 1090 2HG GLN 140 2HG GLN 140 1.636 -2.088 -1.520 1091 1HE2 GLN 140 1HE2 GLN 140 0.772 -2.723 0.495 1092 2HE2 GLN 140 2HE2 GLN 140 -0.021 -1.584 1.524 1093 H MET 141 H MET 141 3.867 -1.529 -4.244 1094 HA MET 141 HA MET 141 4.740 1.269 -4.452 1095 1HB MET 141 1HB MET 141 4.544 -0.977 -6.433 1096 2HB MET 141 2HB MET 141 4.561 0.692 -6.985 1097 1HG MET 141 1HG MET 141 6.741 0.975 -6.505 1098 2HG MET 141 2HG MET 141 6.671 -0.049 -5.071 1099 1HE MET 141 1HE MET 141 9.484 -1.495 -7.370 1100 2HE MET 141 2HE MET 141 9.070 -0.069 -6.419 1101 3HE MET 141 3HE MET 141 8.822 -0.067 -8.165 1102 H THR 142 H THR 142 3.367 2.858 -5.048 1103 HA THR 142 HA THR 142 0.548 2.109 -5.384 1104 HB THR 142 HB THR 142 1.304 4.944 -4.939 1105 HG1 THR 142 HG1 THR 142 1.695 4.607 -2.766 1106 1HG2 THR 142 1HG2 THR 142 -1.062 3.804 -4.952 1107 2HG2 THR 142 2HG2 THR 142 -0.679 5.122 -3.843 1108 3HG2 THR 142 3HG2 THR 142 -0.646 3.453 -3.275 1109 H TYR 143 H TYR 143 -0.697 2.950 -7.054 1110 HA TYR 143 HA TYR 143 0.761 4.381 -9.172 1111 1HB TYR 143 1HB TYR 143 0.567 1.990 -9.762 1112 2HB TYR 143 2HB TYR 143 -1.183 2.100 -9.597 1113 HD1 TYR 143 HD1 TYR 143 -2.368 2.281 -11.559 1114 HD2 TYR 143 HD2 TYR 143 1.551 3.928 -11.386 1115 HE1 TYR 143 HE1 TYR 143 -2.551 2.950 -13.919 1116 HE2 TYR 143 HE2 TYR 143 1.379 4.601 -13.745 1117 HH TYR 143 HH TYR 143 -0.662 3.411 -15.854 1118 H ILE 144 H ILE 144 -0.294 6.055 -10.079 1119 HA ILE 144 HA ILE 144 -3.138 6.412 -9.398 1120 HB ILE 144 HB ILE 144 -1.738 7.933 -8.073 1121 1HG1 ILE 144 1HG1 ILE 144 -2.758 10.112 -9.411 1122 2HG1 ILE 144 2HG1 ILE 144 -3.770 8.800 -10.006 1123 1HG2 ILE 144 1HG2 ILE 144 -0.086 8.046 -10.193 1124 2HG2 ILE 144 2HG2 ILE 144 -0.096 9.240 -8.895 1125 3HG2 ILE 144 3HG2 ILE 144 -0.958 9.565 -10.400 1126 1HD1 ILE 144 1HD1 ILE 144 -4.768 9.862 -8.074 1127 2HD1 ILE 144 2HD1 ILE 144 -3.323 9.524 -7.121 1128 3HD1 ILE 144 3HD1 ILE 144 -4.325 8.195 -7.705 1129 HA PRO 145 HA PRO 145 -3.235 6.538 -13.918 1130 1HB PRO 145 1HB PRO 145 -5.941 6.516 -14.136 1131 2HB PRO 145 2HB PRO 145 -4.992 5.058 -13.823 1132 1HG PRO 145 1HG PRO 145 -6.502 6.785 -11.898 1133 2HG PRO 145 2HG PRO 145 -6.429 5.016 -11.993 1134 1HD PRO 145 1HD PRO 145 -4.975 6.432 -10.207 1135 2HD PRO 145 2HD PRO 145 -4.389 4.915 -10.921 1136 H GLY 146 H GLY 146 -3.531 8.166 -15.392 1137 1HA GLY 146 1HA GLY 146 -4.444 10.739 -14.280 1138 2HA GLY 146 2HA GLY 146 -3.308 10.559 -15.608 1139 H THR 147 H THR 147 -6.471 9.037 -15.072 1140 HA THR 147 HA THR 147 -8.406 9.076 -16.266 1141 HB THR 147 HB THR 147 -7.661 11.428 -17.906 1142 HG1 THR 147 HG1 THR 147 -7.056 12.592 -16.292 1143 1HG2 THR 147 1HG2 THR 147 -9.831 12.028 -17.712 1144 2HG2 THR 147 2HG2 THR 147 -9.978 11.400 -16.072 1145 3HG2 THR 147 3HG2 THR 147 -10.009 10.294 -17.445 1146 H TYR 148 H TYR 148 -6.096 10.458 -18.609 1147 HA TYR 148 HA TYR 148 -6.802 8.274 -20.444 1148 1HB TYR 148 1HB TYR 148 -5.430 10.864 -21.166 1149 2HB TYR 148 2HB TYR 148 -6.189 9.706 -22.256 1150 HD1 TYR 148 HD1 TYR 148 -6.839 12.294 -19.705 1151 HD2 TYR 148 HD2 TYR 148 -8.536 9.766 -22.677 1152 HE1 TYR 148 HE1 TYR 148 -8.941 13.561 -19.573 1153 HE2 TYR 148 HE2 TYR 148 -10.643 11.027 -22.555 1154 HH TYR 148 HH TYR 148 -11.345 13.378 -21.864 1155 H ASN 149 H ASN 149 -4.851 8.066 -18.259 1156 HA ASN 149 HA ASN 149 -2.777 7.219 -17.862 1157 1HB ASN 149 1HB ASN 149 -3.759 5.832 -19.975 1158 2HB ASN 149 2HB ASN 149 -2.282 6.480 -20.682 1159 1HD2 ASN 149 1HD2 ASN 149 -0.595 5.213 -20.496 1160 2HD2 ASN 149 2HD2 ASN 149 -0.303 4.075 -19.232 1161 H ASN 150 H ASN 150 -1.806 9.221 -17.428 1162 HA ASN 150 HA ASN 150 0.455 9.840 -18.981 1163 1HB ASN 150 1HB ASN 150 -1.444 10.833 -20.388 1164 2HB ASN 150 2HB ASN 150 -1.618 12.025 -19.103 1165 1HD2 ASN 150 1HD2 ASN 150 -0.267 11.491 -22.016 1166 2HD2 ASN 150 2HD2 ASN 150 1.060 12.596 -21.941 1167 H GLY 151 H GLY 151 1.902 11.019 -17.816 1168 1HA GLY 151 1HA GLY 151 2.803 12.161 -16.039 1169 2HA GLY 151 2HA GLY 151 1.222 12.895 -15.813 1170 H ASN 152 H ASN 152 1.891 9.443 -15.690 1171 HA ASN 152 HA ASN 152 0.531 9.101 -13.246 1172 1HB ASN 152 1HB ASN 152 2.447 7.300 -14.735 1173 2HB ASN 152 2HB ASN 152 1.566 6.801 -13.293 1174 1HD2 ASN 152 1HD2 ASN 152 1.561 6.483 -16.476 1175 2HD2 ASN 152 2HD2 ASN 152 -0.131 6.337 -16.791 1176 H VAL 153 H VAL 153 1.570 8.015 -11.312 1177 HA VAL 153 HA VAL 153 4.245 9.095 -10.756 1178 HB VAL 153 HB VAL 153 1.973 9.252 -8.776 1179 1HG1 VAL 153 1HG1 VAL 153 3.805 9.315 -7.440 1180 2HG1 VAL 153 2HG1 VAL 153 3.775 11.015 -7.906 1181 3HG1 VAL 153 3HG1 VAL 153 4.862 9.895 -8.728 1182 1HG2 VAL 153 1HG2 VAL 153 1.985 11.677 -9.197 1183 2HG2 VAL 153 2HG2 VAL 153 1.504 10.756 -10.622 1184 3HG2 VAL 153 3HG2 VAL 153 3.131 11.429 -10.515 1185 H TYR 154 H TYR 154 5.567 7.716 -9.726 1186 HA TYR 154 HA TYR 154 4.420 5.164 -8.828 1187 1HB TYR 154 1HB TYR 154 7.052 5.943 -10.007 1188 2HB TYR 154 2HB TYR 154 6.989 4.549 -8.935 1189 HD1 TYR 154 HD1 TYR 154 4.512 5.730 -11.458 1190 HD2 TYR 154 HD2 TYR 154 7.265 2.694 -10.313 1191 HE1 TYR 154 HE1 TYR 154 3.743 4.334 -13.331 1192 HE2 TYR 154 HE2 TYR 154 6.503 1.291 -12.183 1193 HH TYR 154 HH TYR 154 5.402 1.514 -14.326 1194 H PHE 155 H PHE 155 4.223 4.885 -6.716 1195 HA PHE 155 HA PHE 155 5.956 6.426 -4.912 1196 1HB PHE 155 1HB PHE 155 3.247 5.154 -4.533 1197 2HB PHE 155 2HB PHE 155 4.213 5.729 -3.177 1198 HD1 PHE 155 HD1 PHE 155 2.237 6.701 -6.090 1199 HD2 PHE 155 HD2 PHE 155 4.564 8.091 -2.810 1200 HE1 PHE 155 HE1 PHE 155 1.339 8.969 -6.418 1201 HE2 PHE 155 HE2 PHE 155 3.670 10.360 -3.131 1202 HZ PHE 155 HZ PHE 155 2.055 10.801 -4.938 1203 H ALA 156 H ALA 156 6.960 5.417 -3.129 1204 HA ALA 156 HA ALA 156 7.107 2.481 -3.254 1205 1HB ALA 156 1HB ALA 156 9.073 3.450 -4.371 1206 2HB ALA 156 2HB ALA 156 9.507 2.555 -2.915 1207 3HB ALA 156 3HB ALA 156 9.471 4.317 -2.888 1208 H TRP 157 H TRP 157 7.044 1.451 -1.336 1209 HA TRP 157 HA TRP 157 7.556 2.944 1.122 1210 1HB TRP 157 1HB TRP 157 4.998 1.392 0.673 1211 2HB TRP 157 2HB TRP 157 5.461 2.238 2.146 1212 HD1 TRP 157 HD1 TRP 157 3.816 2.775 -1.192 1213 HE1 TRP 157 HE1 TRP 157 3.064 5.228 -1.397 1214 HE3 TRP 157 HE3 TRP 157 6.208 4.704 2.895 1215 HZ2 TRP 157 HZ2 TRP 157 3.436 7.659 -0.011 1216 HZ3 TRP 157 HZ3 TRP 157 5.960 7.103 3.384 1217 HH2 TRP 157 HH2 TRP 157 4.602 8.548 1.959 1218 H MET 158 H MET 158 8.361 1.713 2.769 1219 HA MET 158 HA MET 158 8.999 -1.060 2.092 1220 1HB MET 158 1HB MET 158 10.512 0.994 3.186 1221 2HB MET 158 2HB MET 158 10.158 -0.037 4.565 1222 1HG MET 158 1HG MET 158 11.104 -1.945 3.429 1223 2HG MET 158 2HG MET 158 11.374 -0.980 1.980 1224 1HE MET 158 1HE MET 158 13.759 0.156 1.537 1225 2HE MET 158 2HE MET 158 14.310 1.266 2.791 1226 3HE MET 158 3HE MET 158 12.652 1.359 2.198 1227 H ARG 159 H ARG 159 8.570 -2.787 3.468 1228 HA ARG 159 HA ARG 159 6.897 -2.269 5.813 1229 1HB ARG 159 1HB ARG 159 6.072 -3.640 3.327 1230 2HB ARG 159 2HB ARG 159 5.639 -4.457 4.822 1231 1HG ARG 159 1HG ARG 159 5.017 -1.669 5.032 1232 2HG ARG 159 2HG ARG 159 4.305 -2.335 3.562 1233 1HD ARG 159 1HD ARG 159 3.920 -4.180 5.712 1234 2HD ARG 159 2HD ARG 159 3.384 -2.581 6.222 1235 HE ARG 159 HE ARG 159 1.635 -2.735 4.754 1236 1HH1 ARG 159 1HH1 ARG 159 3.986 -5.191 3.968 1237 2HH1 ARG 159 2HH1 ARG 159 2.965 -5.973 2.809 1238 1HH2 ARG 159 1HH2 ARG 159 0.290 -3.763 3.230 1239 2HH2 ARG 159 2HH2 ARG 159 0.868 -5.163 2.390 1240 H PHE 160 H PHE 160 7.034 -3.815 7.425 1241 HA PHE 160 HA PHE 160 8.803 -6.106 6.945 1242 1HB PHE 160 1HB PHE 160 9.658 -3.842 8.272 1243 2HB PHE 160 2HB PHE 160 9.166 -4.902 9.588 1244 HD1 PHE 160 HD1 PHE 160 10.497 -6.719 10.242 1245 HD2 PHE 160 HD2 PHE 160 11.347 -4.671 6.610 1246 HE1 PHE 160 HE1 PHE 160 12.625 -7.940 10.056 1247 HE2 PHE 160 HE2 PHE 160 13.476 -5.888 6.417 1248 HZ PHE 160 HZ PHE 160 14.117 -7.526 8.141 1249 H GLN 161 H GLN 161 7.878 -7.926 7.598 1250 HA GLN 161 HA GLN 161 5.654 -7.773 9.503 1251 1HB GLN 161 1HB GLN 161 5.732 -8.981 7.092 1252 2HB GLN 161 2HB GLN 161 6.246 -10.320 8.110 1253 1HG GLN 161 1HG GLN 161 3.804 -8.740 8.797 1254 2HG GLN 161 2HG GLN 161 3.741 -10.018 7.584 1255 1HE2 GLN 161 1HE2 GLN 161 2.804 -11.711 8.474 1256 2HE2 GLN 161 2HE2 GLN 161 3.176 -12.381 10.023 1257 H PHE 162 H PHE 162 6.017 -8.314 11.540 1258 HA PHE 162 HA PHE 162 7.984 -10.419 12.122 1259 1HB PHE 162 1HB PHE 162 8.582 -7.830 12.588 1260 2HB PHE 162 2HB PHE 162 7.761 -8.219 14.096 1261 HD1 PHE 162 HD1 PHE 162 8.580 -10.294 15.368 1262 HD2 PHE 162 HD2 PHE 162 10.814 -8.376 12.296 1263 HE1 PHE 162 HE1 PHE 162 10.640 -11.334 16.222 1264 HE2 PHE 162 HE2 PHE 162 12.878 -9.412 13.144 1265 HZ PHE 162 HZ PHE 162 12.792 -10.893 15.110 1266 H LEU 163 H LEU 163 7.616 -11.592 14.063 1267 HA LEU 163 HA LEU 163 4.964 -11.210 15.273 1268 1HB LEU 163 1HB LEU 163 4.862 -13.015 13.592 1269 2HB LEU 163 2HB LEU 163 6.148 -13.858 14.437 1270 HG LEU 163 HG LEU 163 4.442 -13.675 16.467 1271 1HD1 LEU 163 1HD1 LEU 163 2.563 -13.892 14.132 1272 2HD1 LEU 163 2HD1 LEU 163 2.847 -12.377 14.989 1273 3HD1 LEU 163 3HD1 LEU 163 2.172 -13.762 15.847 1274 1HD2 LEU 163 1HD2 LEU 163 4.112 -15.910 16.192 1275 2HD2 LEU 163 2HD2 LEU 163 5.405 -15.679 15.017 1276 3HD2 LEU 163 3HD2 LEU 163 3.728 -15.756 14.477 1277 H GLU 164 H GLU 164 4.766 -11.827 17.434 1278 HA GLU 164 HA GLU 164 7.284 -11.884 18.882 1279 1HB GLU 164 1HB GLU 164 4.427 -11.384 19.605 1280 2HB GLU 164 2HB GLU 164 5.549 -11.865 20.870 1281 1HG GLU 164 1HG GLU 164 5.808 -9.466 19.073 1282 2HG GLU 164 2HG GLU 164 5.349 -9.459 20.774 1283 HE2 GLU 164 HE2 GLU 164 8.689 -10.215 21.711 1284 H HIS 165 H HIS 165 8.222 -13.746 19.373 1285 HA HIS 165 HA HIS 165 6.886 -16.251 19.178 1286 1HB HIS 165 1HB HIS 165 9.620 -15.345 19.963 1287 2HB HIS 165 2HB HIS 165 9.122 -16.974 20.406 1288 HD1 HIS 165 HD1 HIS 165 7.537 -17.666 17.819 1289 HD2 HIS 165 HD2 HIS 165 11.317 -15.942 17.904 1290 HE1 HIS 165 HE1 HIS 165 8.579 -18.223 15.600 1291 HE2 HIS 165 HE2 HIS 165 10.898 -17.242 15.708 1292 H HIS 166 H HIS 166 5.641 -17.201 20.640 1293 HA HIS 166 HA HIS 166 5.360 -16.122 23.281 1294 1HB HIS 166 1HB HIS 166 3.663 -17.433 21.630 1295 2HB HIS 166 2HB HIS 166 4.159 -18.759 22.676 1296 HD1 HIS 166 HD1 HIS 166 2.853 -15.204 23.098 1297 HD2 HIS 166 HD2 HIS 166 2.646 -18.939 24.906 1298 HE1 HIS 166 HE1 HIS 166 1.244 -14.936 25.011 1299 HE2 HIS 166 HE2 HIS 166 1.070 -17.229 26.039 1300 H HIS 167 H HIS 167 6.133 -19.425 22.163 1301 HA HIS 167 HA HIS 167 8.406 -19.735 23.778 1302 1HB HIS 167 1HB HIS 167 6.241 -19.713 25.386 1303 2HB HIS 167 2HB HIS 167 6.284 -21.424 24.974 1304 HD1 HIS 167 HD1 HIS 167 7.804 -18.945 27.173 1305 HD2 HIS 167 HD2 HIS 167 8.805 -22.700 25.703 1306 HE1 HIS 167 HE1 HIS 167 9.652 -19.778 28.662 1307 HE2 HIS 167 HE2 HIS 167 10.298 -22.016 27.702 1308 H HIS 168 H HIS 168 9.542 -21.367 22.948 1309 HA HIS 168 HA HIS 168 8.114 -23.346 21.307 1310 1HB HIS 168 1HB HIS 168 10.309 -23.691 20.183 1311 2HB HIS 168 2HB HIS 168 9.702 -22.045 20.027 1312 HD1 HIS 168 HD1 HIS 168 12.604 -23.962 21.122 1313 HD2 HIS 168 HD2 HIS 168 11.052 -20.169 21.809 1314 HE1 HIS 168 HE1 HIS 168 14.496 -22.630 22.109 1315 HE2 HIS 168 HE2 HIS 168 13.506 -20.365 22.602 1316 H HIS 169 H HIS 169 8.010 -25.371 22.007 1317 HA HIS 169 HA HIS 169 10.180 -26.681 23.308 1318 1HB HIS 169 1HB HIS 169 8.765 -25.190 25.060 1319 2HB HIS 169 2HB HIS 169 7.826 -26.680 25.105 1320 HD1 HIS 169 HD1 HIS 169 11.349 -25.437 25.708 1321 HD2 HIS 169 HD2 HIS 169 8.925 -28.691 26.604 1322 HE1 HIS 169 HE1 HIS 169 12.658 -26.818 27.353 1323 HE2 HIS 169 HE2 HIS 169 11.136 -28.737 27.944 1324 H HIS 170 H HIS 170 8.434 -27.059 21.032 1325 HA HIS 170 HA HIS 170 7.086 -29.563 21.804 1326 1HB HIS 170 1HB HIS 170 5.945 -27.430 20.563 1327 2HB HIS 170 2HB HIS 170 6.446 -28.386 19.173 1328 HD1 HIS 170 HD1 HIS 170 4.775 -30.045 18.434 1329 HD2 HIS 170 HD2 HIS 170 4.366 -29.140 22.468 1330 HE1 HIS 170 HE1 HIS 170 2.765 -31.340 19.213 1331 HE2 HIS 170 HE2 HIS 170 2.486 -30.709 21.635 Start of MODEL 13 1 1H MET 1 1H MET 1 -9.550 -31.756 8.229 2 2H MET 1 2H MET 1 -10.847 -32.563 9.011 3 H MET 1 H MET 1 -11.185 -32.513 8.562 4 3H MET 1 3H MET 1 -10.851 -32.381 7.305 5 HA MET 1 HA MET 1 -10.242 -34.606 8.190 6 1HB MET 1 1HB MET 1 -8.508 -34.861 6.470 7 2HB MET 1 2HB MET 1 -9.834 -33.860 5.895 8 1HG MET 1 1HG MET 1 -8.392 -31.871 6.601 9 2HG MET 1 2HG MET 1 -7.068 -33.030 6.687 10 1HE MET 1 1HE MET 1 -6.182 -34.345 4.985 11 2HE MET 1 2HE MET 1 -6.124 -33.919 3.275 12 3HE MET 1 3HE MET 1 -7.423 -34.945 3.885 13 H ASN 2 H ASN 2 -8.444 -35.902 8.905 14 HA ASN 2 HA ASN 2 -6.771 -36.441 10.347 15 1HB ASN 2 1HB ASN 2 -5.676 -34.618 8.693 16 2HB ASN 2 2HB ASN 2 -5.503 -33.763 10.222 17 1HD2 ASN 2 1HD2 ASN 2 -3.818 -35.510 8.191 18 2HD2 ASN 2 2HD2 ASN 2 -2.788 -36.391 9.262 19 H ALA 3 H ALA 3 -8.308 -36.474 12.075 20 HA ALA 3 HA ALA 3 -8.996 -34.284 13.668 21 1HB ALA 3 1HB ALA 3 -9.795 -35.851 15.261 22 2HB ALA 3 2HB ALA 3 -8.716 -37.111 14.661 23 3HB ALA 3 3HB ALA 3 -10.067 -36.560 13.670 24 H ASP 4 H ASP 4 -6.040 -36.024 13.451 25 HA ASP 4 HA ASP 4 -5.082 -35.385 16.080 26 1HB ASP 4 1HB ASP 4 -3.881 -36.589 13.612 27 2HB ASP 4 2HB ASP 4 -2.824 -36.028 14.905 28 HD2 ASP 4 HD2 ASP 4 -3.898 -39.529 15.416 29 H GLU 5 H GLU 5 -4.163 -34.296 12.812 30 HA GLU 5 HA GLU 5 -2.540 -32.166 13.732 31 1HB GLU 5 1HB GLU 5 -2.358 -33.215 11.479 32 2HB GLU 5 2HB GLU 5 -3.882 -32.457 11.040 33 1HG GLU 5 1HG GLU 5 -2.870 -30.250 11.410 34 2HG GLU 5 2HG GLU 5 -1.337 -31.036 11.785 35 HE2 GLU 5 HE2 GLU 5 -1.903 -30.192 8.133 36 H TRP 6 H TRP 6 -5.943 -32.506 13.177 37 HA TRP 6 HA TRP 6 -6.638 -29.801 12.836 38 1HB TRP 6 1HB TRP 6 -8.015 -32.311 13.317 39 2HB TRP 6 2HB TRP 6 -8.769 -30.989 14.203 40 HD1 TRP 6 HD1 TRP 6 -7.194 -30.677 10.691 41 HE1 TRP 6 HE1 TRP 6 -9.036 -29.948 9.048 42 HE3 TRP 6 HE3 TRP 6 -11.215 -30.876 13.841 43 HZ2 TRP 6 HZ2 TRP 6 -11.825 -29.515 9.083 44 HZ3 TRP 6 HZ3 TRP 6 -13.435 -30.289 12.958 45 HH2 TRP 6 HH2 TRP 6 -13.732 -29.622 10.628 46 H MET 7 H MET 7 -6.116 -31.757 15.717 47 HA MET 7 HA MET 7 -7.095 -29.886 17.593 48 1HB MET 7 1HB MET 7 -5.399 -32.327 17.697 49 2HB MET 7 2HB MET 7 -5.337 -31.243 19.080 50 1HG MET 7 1HG MET 7 -8.034 -31.909 18.125 51 2HG MET 7 2HG MET 7 -7.110 -33.252 18.793 52 1HE MET 7 1HE MET 7 -9.923 -31.794 19.918 53 2HE MET 7 2HE MET 7 -9.263 -30.230 19.441 54 3HE MET 7 3HE MET 7 -9.626 -30.554 21.136 55 H THR 8 H THR 8 -4.019 -30.268 15.983 56 HA THR 8 HA THR 8 -2.533 -28.546 17.694 57 HB THR 8 HB THR 8 -1.716 -28.822 14.856 58 HG1 THR 8 HG1 THR 8 -1.457 -30.943 14.915 59 1HG2 THR 8 1HG2 THR 8 -0.089 -27.908 16.300 60 2HG2 THR 8 2HG2 THR 8 0.411 -29.564 15.956 61 3HG2 THR 8 3HG2 THR 8 -0.343 -29.174 17.502 62 H THR 9 H THR 9 -3.990 -28.077 14.478 63 HA THR 9 HA THR 9 -3.320 -25.355 14.241 64 HB THR 9 HB THR 9 -3.938 -26.546 12.271 65 HG1 THR 9 HG1 THR 9 -6.108 -24.822 12.856 66 1HG2 THR 9 1HG2 THR 9 -6.513 -27.150 13.681 67 2HG2 THR 9 2HG2 THR 9 -5.351 -28.275 12.978 68 3HG2 THR 9 3HG2 THR 9 -6.338 -27.258 11.929 69 H PHE 10 H PHE 10 -6.014 -26.996 15.758 70 HA PHE 10 HA PHE 10 -7.666 -24.713 16.092 71 1HB PHE 10 1HB PHE 10 -7.648 -27.506 17.005 72 2HB PHE 10 2HB PHE 10 -8.388 -26.385 18.143 73 HD1 PHE 10 HD1 PHE 10 -8.443 -27.280 14.527 74 HD2 PHE 10 HD2 PHE 10 -10.612 -25.848 17.896 75 HE1 PHE 10 HE1 PHE 10 -10.515 -27.314 13.201 76 HE2 PHE 10 HE2 PHE 10 -12.689 -25.879 16.577 77 HZ PHE 10 HZ PHE 10 -12.642 -26.613 14.226 78 H ARG 11 H ARG 11 -5.183 -26.233 18.085 79 HA ARG 11 HA ARG 11 -5.591 -24.698 20.410 80 1HB ARG 11 1HB ARG 11 -3.472 -26.462 19.351 81 2HB ARG 11 2HB ARG 11 -2.939 -25.271 20.529 82 1HG ARG 11 1HG ARG 11 -5.369 -26.773 21.242 83 2HG ARG 11 2HG ARG 11 -3.873 -27.706 21.170 84 1HD ARG 11 1HD ARG 11 -3.813 -25.100 22.589 85 2HD ARG 11 2HD ARG 11 -4.652 -26.437 23.371 86 HE ARG 11 HE ARG 11 -2.284 -27.531 22.666 87 1HH1 ARG 11 1HH1 ARG 11 -3.143 -24.638 24.418 88 2HH1 ARG 11 2HH1 ARG 11 -1.712 -24.653 25.393 89 1HH2 ARG 11 1HH2 ARG 11 -0.402 -27.552 23.947 90 2HH2 ARG 11 2HH2 ARG 11 -0.155 -26.307 25.126 91 H GLU 12 H GLU 12 -3.845 -24.077 17.449 92 HA GLU 12 HA GLU 12 -2.402 -21.813 18.434 93 1HB GLU 12 1HB GLU 12 -1.633 -23.149 16.504 94 2HB GLU 12 2HB GLU 12 -3.028 -22.604 15.583 95 1HG GLU 12 1HG GLU 12 -2.243 -20.364 15.560 96 2HG GLU 12 2HG GLU 12 -0.975 -20.732 16.730 97 HE2 GLU 12 HE2 GLU 12 0.492 -22.712 13.957 98 H ASN 13 H ASN 13 -5.512 -22.329 16.928 99 HA ASN 13 HA ASN 13 -6.008 -19.605 16.259 100 1HB ASN 13 1HB ASN 13 -7.842 -21.979 16.610 101 2HB ASN 13 2HB ASN 13 -8.409 -20.391 16.104 102 1HD2 ASN 13 1HD2 ASN 13 -8.191 -23.121 14.801 103 2HD2 ASN 13 2HD2 ASN 13 -7.446 -22.795 13.277 104 H ILE 14 H ILE 14 -7.179 -21.679 18.910 105 HA ILE 14 HA ILE 14 -8.627 -19.707 20.266 106 HB ILE 14 HB ILE 14 -8.839 -22.114 20.743 107 1HG1 ILE 14 1HG1 ILE 14 -8.387 -21.677 23.411 108 2HG1 ILE 14 2HG1 ILE 14 -8.480 -20.032 22.790 109 1HG2 ILE 14 1HG2 ILE 14 -7.185 -23.230 22.173 110 2HG2 ILE 14 2HG2 ILE 14 -6.149 -21.806 22.068 111 3HG2 ILE 14 3HG2 ILE 14 -6.501 -22.749 20.619 112 1HD1 ILE 14 1HD1 ILE 14 -10.569 -22.131 22.930 113 2HD1 ILE 14 2HD1 ILE 14 -10.640 -20.959 21.614 114 3HD1 ILE 14 3HD1 ILE 14 -10.666 -20.407 23.288 115 H ALA 15 H ALA 15 -5.223 -20.586 20.400 116 HA ALA 15 HA ALA 15 -4.613 -18.938 22.655 117 1HB ALA 15 1HB ALA 15 -3.328 -20.984 21.556 118 2HB ALA 15 2HB ALA 15 -2.491 -19.742 22.487 119 3HB ALA 15 3HB ALA 15 -2.486 -19.678 20.724 120 H GLN 16 H GLN 16 -4.711 -18.476 19.196 121 HA GLN 16 HA GLN 16 -3.210 -16.059 19.137 122 1HB GLN 16 1HB GLN 16 -3.729 -17.634 17.187 123 2HB GLN 16 2HB GLN 16 -5.306 -16.857 17.127 124 1HG GLN 16 1HG GLN 16 -4.288 -14.723 16.676 125 2HG GLN 16 2HG GLN 16 -2.677 -15.414 16.871 126 1HE2 GLN 16 1HE2 GLN 16 -2.709 -17.662 15.468 127 2HE2 GLN 16 2HE2 GLN 16 -3.051 -17.366 13.801 128 H THR 17 H THR 17 -6.662 -16.805 19.327 129 HA THR 17 HA THR 17 -7.403 -14.013 19.339 130 HB THR 17 HB THR 17 -9.151 -16.388 19.992 131 HG1 THR 17 HG1 THR 17 -8.761 -16.928 18.003 132 1HG2 THR 17 1HG2 THR 17 -10.543 -14.474 18.515 133 2HG2 THR 17 2HG2 THR 17 -9.664 -13.580 19.754 134 3HG2 THR 17 3HG2 THR 17 -10.754 -14.887 20.217 135 H TRP 18 H TRP 18 -6.854 -16.557 21.666 136 HA TRP 18 HA TRP 18 -8.052 -15.166 23.869 137 1HB TRP 18 1HB TRP 18 -7.841 -17.647 23.769 138 2HB TRP 18 2HB TRP 18 -6.097 -17.472 23.925 139 HD1 TRP 18 HD1 TRP 18 -5.128 -17.168 26.325 140 HE1 TRP 18 HE1 TRP 18 -6.164 -17.104 28.680 141 HE3 TRP 18 HE3 TRP 18 -10.064 -16.830 25.034 142 HZ2 TRP 18 HZ2 TRP 18 -8.733 -16.933 29.838 143 HZ3 TRP 18 HZ3 TRP 18 -11.747 -16.721 26.826 144 HH2 TRP 18 HH2 TRP 18 -11.093 -16.771 29.178 145 H GLN 19 H GLN 19 -4.859 -15.388 22.464 146 HA GLN 19 HA GLN 19 -3.765 -13.748 24.640 147 1HB GLN 19 1HB GLN 19 -2.719 -15.973 23.483 148 2HB GLN 19 2HB GLN 19 -1.948 -14.715 22.526 149 1HG GLN 19 1HG GLN 19 -0.964 -13.736 24.457 150 2HG GLN 19 2HG GLN 19 -1.907 -14.770 25.530 151 1HE2 GLN 19 1HE2 GLN 19 -0.850 -16.420 26.342 152 2HE2 GLN 19 2HE2 GLN 19 0.507 -17.219 25.629 153 H GLN 20 H GLN 20 -3.146 -13.960 21.134 154 HA GLN 20 HA GLN 20 -4.037 -11.382 20.497 155 1HB GLN 20 1HB GLN 20 -1.914 -10.187 20.247 156 2HB GLN 20 2HB GLN 20 -2.197 -10.631 21.925 157 1HG GLN 20 1HG GLN 20 -0.770 -12.765 21.046 158 2HG GLN 20 2HG GLN 20 -0.080 -11.461 20.080 159 1HE2 GLN 20 1HE2 GLN 20 -1.282 -11.686 23.412 160 2HE2 GLN 20 2HE2 GLN 20 0.152 -11.070 24.153 161 HA PRO 21 HA PRO 21 -3.604 -12.729 16.337 162 1HB PRO 21 1HB PRO 21 -2.073 -10.235 15.764 163 2HB PRO 21 2HB PRO 21 -3.494 -10.895 14.947 164 1HG PRO 21 1HG PRO 21 -3.726 -8.826 16.602 165 2HG PRO 21 2HG PRO 21 -4.957 -10.102 16.565 166 1HD PRO 21 1HD PRO 21 -2.811 -9.592 18.575 167 2HD PRO 21 2HD PRO 21 -4.460 -10.207 18.812 168 H GLU 22 H GLU 22 -1.846 -12.796 14.485 169 HA GLU 22 HA GLU 22 0.737 -13.492 15.722 170 1HB GLU 22 1HB GLU 22 -0.956 -15.324 14.710 171 2HB GLU 22 2HB GLU 22 -0.081 -14.901 13.244 172 1HG GLU 22 1HG GLU 22 2.036 -15.414 14.393 173 2HG GLU 22 2HG GLU 22 1.118 -15.911 15.813 174 HE2 GLU 22 HE2 GLU 22 1.829 -18.678 13.371 175 H HIS 23 H HIS 23 -0.801 -12.728 12.598 176 HA HIS 23 HA HIS 23 1.681 -11.853 11.445 177 1HB HIS 23 1HB HIS 23 -1.126 -11.441 10.401 178 2HB HIS 23 2HB HIS 23 0.369 -11.318 9.480 179 HD1 HIS 23 HD1 HIS 23 -2.314 -13.556 9.994 180 HD2 HIS 23 HD2 HIS 23 1.801 -14.015 9.643 181 HE1 HIS 23 HE1 HIS 23 -1.957 -15.967 9.375 182 HE2 HIS 23 HE2 HIS 23 0.545 -16.240 9.244 183 H TYR 24 H TYR 24 2.537 -9.878 11.484 184 HA TYR 24 HA TYR 24 0.827 -7.628 12.319 185 1HB TYR 24 1HB TYR 24 3.488 -8.507 13.328 186 2HB TYR 24 2HB TYR 24 3.195 -6.775 13.208 187 HD1 TYR 24 HD1 TYR 24 2.595 -5.817 15.209 188 HD2 TYR 24 HD2 TYR 24 1.215 -9.746 14.338 189 HE1 TYR 24 HE1 TYR 24 1.401 -5.868 17.358 190 HE2 TYR 24 HE2 TYR 24 0.016 -9.807 16.484 191 HH TYR 24 HH TYR 24 0.571 -7.643 18.963 192 H ASP 25 H ASP 25 1.487 -5.529 11.549 193 HA ASP 25 HA ASP 25 3.093 -5.661 9.080 194 1HB ASP 25 1HB ASP 25 0.427 -4.454 9.616 195 2HB ASP 25 2HB ASP 25 1.510 -3.569 8.545 196 HD2 ASP 25 HD2 ASP 25 0.828 -7.203 7.169 197 H LEU 26 H LEU 26 4.514 -4.004 8.669 198 HA LEU 26 HA LEU 26 4.728 -1.886 10.697 199 1HB LEU 26 1HB LEU 26 6.819 -3.808 9.771 200 2HB LEU 26 2HB LEU 26 7.298 -2.184 10.222 201 HG LEU 26 HG LEU 26 6.116 -2.606 12.442 202 1HD1 LEU 26 1HD1 LEU 26 6.308 -5.242 12.838 203 2HD1 LEU 26 2HD1 LEU 26 5.848 -5.244 11.135 204 3HD1 LEU 26 3HD1 LEU 26 4.816 -4.454 12.327 205 1HD2 LEU 26 1HD2 LEU 26 8.414 -2.536 12.601 206 2HD2 LEU 26 2HD2 LEU 26 8.639 -3.913 11.524 207 3HD2 LEU 26 3HD2 LEU 26 8.070 -4.169 13.173 208 H TYR 27 H TYR 27 4.831 0.086 9.849 209 HA TYR 27 HA TYR 27 5.423 0.336 6.981 210 1HB TYR 27 1HB TYR 27 3.253 1.246 8.401 211 2HB TYR 27 2HB TYR 27 4.276 2.677 8.330 212 HD1 TYR 27 HD1 TYR 27 5.425 2.840 5.801 213 HD2 TYR 27 HD2 TYR 27 1.618 1.217 6.789 214 HE1 TYR 27 HE1 TYR 27 4.649 3.280 3.510 215 HE2 TYR 27 HE2 TYR 27 0.832 1.653 4.500 216 HH TYR 27 HH TYR 27 2.495 2.002 2.018 217 H ILE 28 H ILE 28 7.224 1.325 6.350 218 HA ILE 28 HA ILE 28 8.388 3.480 7.859 219 HB ILE 28 HB ILE 28 9.298 1.531 9.056 220 1HG1 ILE 28 1HG1 ILE 28 11.334 3.008 7.371 221 2HG1 ILE 28 2HG1 ILE 28 10.640 3.574 8.888 222 1HG2 ILE 28 1HG2 ILE 28 10.788 0.778 6.566 223 2HG2 ILE 28 2HG2 ILE 28 9.217 0.075 6.952 224 3HG2 ILE 28 3HG2 ILE 28 10.575 -0.145 8.054 225 1HD1 ILE 28 1HD1 ILE 28 13.001 2.266 8.645 226 2HD1 ILE 28 2HD1 ILE 28 11.906 0.944 9.049 227 3HD1 ILE 28 3HD1 ILE 28 12.035 2.339 10.119 228 HA PRO 29 HA PRO 29 9.433 4.813 3.766 229 1HB PRO 29 1HB PRO 29 11.860 5.929 5.089 230 2HB PRO 29 2HB PRO 29 10.686 6.726 4.036 231 1HG PRO 29 1HG PRO 29 10.655 7.151 6.661 232 2HG PRO 29 2HG PRO 29 9.143 7.006 5.746 233 1HD PRO 29 1HD PRO 29 10.464 5.033 7.555 234 2HD PRO 29 2HD PRO 29 8.737 5.355 7.302 235 H ALA 30 H ALA 30 10.802 4.255 2.083 236 HA ALA 30 HA ALA 30 12.634 2.052 2.659 237 1HB ALA 30 1HB ALA 30 12.548 1.618 0.246 238 2HB ALA 30 2HB ALA 30 11.522 3.036 0.034 239 3HB ALA 30 3HB ALA 30 10.938 1.657 0.965 240 H ILE 31 H ILE 31 12.582 5.289 1.306 241 HA ILE 31 HA ILE 31 15.460 5.141 0.757 242 HB ILE 31 HB ILE 31 15.089 7.412 -0.295 243 1HG1 ILE 31 1HG1 ILE 31 12.205 6.798 -0.571 244 2HG1 ILE 31 2HG1 ILE 31 12.715 7.395 1.005 245 1HG2 ILE 31 1HG2 ILE 31 15.352 5.621 -1.770 246 2HG2 ILE 31 2HG2 ILE 31 13.854 6.391 -2.291 247 3HG2 ILE 31 3HG2 ILE 31 13.798 4.912 -1.332 248 1HD1 ILE 31 1HD1 ILE 31 12.398 9.411 0.110 249 2HD1 ILE 31 2HD1 ILE 31 12.453 8.793 -1.541 250 3HD1 ILE 31 3HD1 ILE 31 13.952 9.140 -0.679 251 H THR 32 H THR 32 16.932 6.244 1.920 252 HA THR 32 HA THR 32 16.134 8.421 3.659 253 HB THR 32 HB THR 32 17.445 5.956 4.818 254 HG1 THR 32 HG1 THR 32 15.469 5.629 5.843 255 1HG2 THR 32 1HG2 THR 32 16.578 8.551 6.036 256 2HG2 THR 32 2HG2 THR 32 18.151 7.760 6.125 257 3HG2 THR 32 3HG2 THR 32 16.772 7.079 6.986 258 H TRP 33 H TRP 33 18.868 6.155 3.282 259 HA TRP 33 HA TRP 33 20.584 8.472 2.693 260 1HB TRP 33 1HB TRP 33 20.728 6.804 4.977 261 2HB TRP 33 2HB TRP 33 22.105 6.392 3.962 262 HD1 TRP 33 HD1 TRP 33 20.764 9.120 6.213 263 HE1 TRP 33 HE1 TRP 33 22.553 10.950 6.487 264 HE3 TRP 33 HE3 TRP 33 24.083 7.553 2.654 265 HZ2 TRP 33 HZ2 TRP 33 25.041 11.638 5.347 266 HZ3 TRP 33 HZ3 TRP 33 26.144 8.853 2.308 267 HH2 TRP 33 HH2 TRP 33 26.611 10.854 3.627 268 H HIS 34 H HIS 34 21.552 8.301 0.791 269 HA HIS 34 HA HIS 34 22.250 5.630 -0.215 270 1HB HIS 34 1HB HIS 34 20.372 7.528 -1.369 271 2HB HIS 34 2HB HIS 34 21.662 7.121 -2.495 272 HD1 HIS 34 HD1 HIS 34 18.450 6.187 -2.205 273 HD2 HIS 34 HD2 HIS 34 21.931 3.936 -1.921 274 HE1 HIS 34 HE1 HIS 34 17.763 3.821 -2.707 275 HE2 HIS 34 HE2 HIS 34 19.903 2.493 -2.622 276 H ALA 35 H ALA 35 24.387 5.575 -0.379 277 HA ALA 35 HA ALA 35 25.766 7.722 -1.784 278 1HB ALA 35 1HB ALA 35 26.183 7.048 1.083 279 2HB ALA 35 2HB ALA 35 26.242 8.611 0.267 280 3HB ALA 35 3HB ALA 35 27.587 7.483 0.108 281 H ARG 36 H ARG 36 26.065 6.190 -3.434 282 HA ARG 36 HA ARG 36 28.144 4.201 -2.833 283 1HB ARG 36 1HB ARG 36 25.604 3.436 -3.321 284 2HB ARG 36 2HB ARG 36 26.208 3.519 -4.970 285 1HG ARG 36 1HG ARG 36 28.206 2.139 -3.831 286 2HG ARG 36 2HG ARG 36 26.865 1.637 -2.800 287 1HD ARG 36 1HD ARG 36 26.826 0.056 -4.496 288 2HD ARG 36 2HD ARG 36 25.614 1.224 -5.023 289 HE ARG 36 HE ARG 36 27.874 2.098 -6.222 290 1HH1 ARG 36 1HH1 ARG 36 26.285 -1.006 -6.106 291 2HH1 ARG 36 2HH1 ARG 36 26.840 -1.489 -7.674 292 1HH2 ARG 36 1HH2 ARG 36 28.605 1.466 -8.284 293 2HH2 ARG 36 2HH2 ARG 36 28.158 -0.086 -8.910 294 H PHE 37 H PHE 37 26.467 6.009 -5.390 295 HA PHE 37 HA PHE 37 28.609 5.659 -7.269 296 1HB PHE 37 1HB PHE 37 26.232 7.532 -7.330 297 2HB PHE 37 2HB PHE 37 27.319 7.224 -8.680 298 HD1 PHE 37 HD1 PHE 37 27.076 5.306 -10.040 299 HD2 PHE 37 HD2 PHE 37 24.768 5.714 -6.489 300 HE1 PHE 37 HE1 PHE 37 25.674 3.410 -10.739 301 HE2 PHE 37 HE2 PHE 37 23.362 3.817 -7.180 302 HZ PHE 37 HZ PHE 37 23.814 2.662 -9.308 303 H ALA 38 H ALA 38 27.306 8.483 -5.525 304 HA ALA 38 HA ALA 38 29.788 9.932 -6.085 305 1HB ALA 38 1HB ALA 38 27.431 10.899 -6.464 306 2HB ALA 38 2HB ALA 38 28.638 11.914 -5.674 307 3HB ALA 38 3HB ALA 38 27.398 11.109 -4.713 308 H TYR 39 H TYR 39 31.342 9.527 -4.643 309 HA TYR 39 HA TYR 39 30.955 8.644 -2.010 310 1HB TYR 39 1HB TYR 39 33.364 10.107 -3.106 311 2HB TYR 39 2HB TYR 39 33.326 9.066 -1.687 312 HD1 TYR 39 HD1 TYR 39 31.820 6.748 -2.616 313 HD2 TYR 39 HD2 TYR 39 34.749 9.068 -4.648 314 HE1 TYR 39 HE1 TYR 39 32.371 4.808 -4.023 315 HE2 TYR 39 HE2 TYR 39 35.309 7.135 -6.062 316 HH TYR 39 HH TYR 39 34.265 5.052 -6.831 317 H ASP 40 H ASP 40 31.020 9.680 -0.031 318 HA ASP 40 HA ASP 40 30.098 12.411 -0.041 319 1HB ASP 40 1HB ASP 40 30.677 10.567 2.287 320 2HB ASP 40 2HB ASP 40 29.820 12.104 2.376 321 HD2 ASP 40 HD2 ASP 40 27.798 8.922 1.486 322 H LYS 41 H LYS 41 31.263 14.187 0.328 323 HA LYS 41 HA LYS 41 33.891 13.932 1.605 324 1HB LYS 41 1HB LYS 41 34.030 13.999 -0.948 325 2HB LYS 41 2HB LYS 41 33.474 15.663 -0.826 326 1HG LYS 41 1HG LYS 41 35.823 15.751 -0.991 327 2HG LYS 41 2HG LYS 41 35.433 16.090 0.696 328 1HD LYS 41 1HD LYS 41 35.749 13.508 0.977 329 2HD LYS 41 2HD LYS 41 36.673 13.659 -0.518 330 1HE LYS 41 1HE LYS 41 38.278 13.903 1.155 331 2HE LYS 41 2HE LYS 41 37.915 15.561 0.675 332 1HZ LYS 41 1HZ LYS 41 37.999 14.916 3.173 333 2HZ LYS 41 2HZ LYS 41 36.428 14.349 2.901 334 3HZ LYS 41 3HZ LYS 41 36.801 15.974 2.619 335 H GLU 42 H GLU 42 34.664 15.851 2.604 336 HA GLU 42 HA GLU 42 32.643 17.404 3.832 337 1HB GLU 42 1HB GLU 42 35.179 16.803 4.495 338 2HB GLU 42 2HB GLU 42 35.429 18.419 3.849 339 1HG GLU 42 1HG GLU 42 35.100 18.771 6.115 340 2HG GLU 42 2HG GLU 42 33.528 19.133 5.402 341 HE2 GLU 42 HE2 GLU 42 32.474 17.032 7.972 342 H LYS 43 H LYS 43 31.521 18.961 2.881 343 HA LYS 43 HA LYS 43 32.924 21.021 1.377 344 1HB LYS 43 1HB LYS 43 31.828 19.031 -0.071 345 2HB LYS 43 2HB LYS 43 30.423 20.076 0.096 346 1HG LYS 43 1HG LYS 43 31.255 20.986 -1.788 347 2HG LYS 43 2HG LYS 43 32.233 21.903 -0.640 348 1HD LYS 43 1HD LYS 43 33.890 21.151 -2.015 349 2HD LYS 43 2HD LYS 43 33.826 19.798 -0.884 350 1HE LYS 43 1HE LYS 43 32.114 18.788 -2.513 351 2HE LYS 43 2HE LYS 43 32.710 19.985 -3.662 352 1HZ LYS 43 1HZ LYS 43 34.539 18.145 -2.245 353 2HZ LYS 43 2HZ LYS 43 34.831 19.040 -3.651 354 3HZ LYS 43 3HZ LYS 43 33.789 17.709 -3.698 355 H THR 44 H THR 44 29.768 19.858 2.520 356 HA THR 44 HA THR 44 28.893 22.621 2.907 357 HB THR 44 HB THR 44 26.699 21.437 3.539 358 HG1 THR 44 HG1 THR 44 26.544 19.314 2.733 359 1HG2 THR 44 1HG2 THR 44 27.224 20.618 0.778 360 2HG2 THR 44 2HG2 THR 44 27.576 22.308 1.138 361 3HG2 THR 44 3HG2 THR 44 25.964 21.658 1.441 362 H ASP 45 H ASP 45 27.544 22.969 4.962 363 HA ASP 45 HA ASP 45 28.879 21.689 7.255 364 1HB ASP 45 1HB ASP 45 28.530 24.571 6.611 365 2HB ASP 45 2HB ASP 45 28.335 24.096 8.296 366 HD2 ASP 45 HD2 ASP 45 31.882 24.737 7.327 367 H ARG 46 H ARG 46 27.598 22.306 9.354 368 HA ARG 46 HA ARG 46 25.715 21.992 10.589 369 1HB ARG 46 1HB ARG 46 24.495 23.291 8.154 370 2HB ARG 46 2HB ARG 46 23.567 22.895 9.594 371 1HG ARG 46 1HG ARG 46 26.017 24.450 10.062 372 2HG ARG 46 2HG ARG 46 24.747 25.275 9.157 373 1HD ARG 46 1HD ARG 46 23.274 24.194 11.122 374 2HD ARG 46 2HD ARG 46 24.807 24.381 11.974 375 HE ARG 46 HE ARG 46 24.447 26.797 10.817 376 1HH1 ARG 46 1HH1 ARG 46 22.419 24.795 12.831 377 2HH1 ARG 46 2HH1 ARG 46 21.589 26.137 13.544 378 1HH2 ARG 46 1HH2 ARG 46 23.357 28.563 11.755 379 2HH2 ARG 46 2HH2 ARG 46 22.120 28.276 12.933 380 H TYR 47 H TYR 47 23.785 20.664 10.810 381 HA TYR 47 HA TYR 47 23.918 18.344 9.036 382 1HB TYR 47 1HB TYR 47 23.894 18.448 11.734 383 2HB TYR 47 2HB TYR 47 22.168 18.284 11.427 384 HD1 TYR 47 HD1 TYR 47 25.331 16.590 11.582 385 HD2 TYR 47 HD2 TYR 47 21.369 16.310 10.057 386 HE1 TYR 47 HE1 TYR 47 25.621 14.166 11.289 387 HE2 TYR 47 HE2 TYR 47 21.647 13.885 9.761 388 HH TYR 47 HH TYR 47 23.950 12.327 9.412 389 H ASN 48 H ASN 48 21.942 17.300 8.327 390 HA ASN 48 HA ASN 48 19.913 19.279 7.604 391 1HB ASN 48 1HB ASN 48 20.356 16.486 6.528 392 2HB ASN 48 2HB ASN 48 19.214 17.667 5.897 393 1HD2 ASN 48 1HD2 ASN 48 20.411 19.900 5.551 394 2HD2 ASN 48 2HD2 ASN 48 21.844 19.777 4.596 395 H GLU 49 H GLU 49 17.812 19.139 8.204 396 HA GLU 49 HA GLU 49 17.127 16.997 10.100 397 1HB GLU 49 1HB GLU 49 16.332 19.869 9.874 398 2HB GLU 49 2HB GLU 49 15.211 18.738 10.616 399 1HG GLU 49 1HG GLU 49 17.084 18.062 12.154 400 2HG GLU 49 2HG GLU 49 17.992 19.430 11.512 401 HE2 GLU 49 HE2 GLU 49 15.222 21.453 12.929 402 H ARG 50 H ARG 50 15.887 15.449 9.296 403 HA ARG 50 HA ARG 50 13.975 16.136 7.164 404 1HB ARG 50 1HB ARG 50 15.958 14.256 7.092 405 2HB ARG 50 2HB ARG 50 14.579 13.288 7.598 406 1HG ARG 50 1HG ARG 50 13.453 13.612 5.626 407 2HG ARG 50 2HG ARG 50 14.278 15.132 5.278 408 1HD ARG 50 1HD ARG 50 16.298 13.211 5.334 409 2HD ARG 50 2HD ARG 50 14.961 12.437 4.485 410 HE ARG 50 HE ARG 50 15.350 13.822 2.717 411 1HH1 ARG 50 1HH1 ARG 50 16.831 15.217 5.553 412 2HH1 ARG 50 2HH1 ARG 50 17.594 16.500 4.676 413 1HH2 ARG 50 1HH2 ARG 50 16.353 15.510 1.562 414 2HH2 ARG 50 2HH2 ARG 50 17.323 16.667 2.410 415 HA PRO 51 HA PRO 51 10.505 15.311 9.753 416 1HB PRO 51 1HB PRO 51 9.436 13.727 7.472 417 2HB PRO 51 2HB PRO 51 8.696 15.065 8.358 418 1HG PRO 51 1HG PRO 51 9.683 15.436 5.913 419 2HG PRO 51 2HG PRO 51 9.866 16.675 7.168 420 1HD PRO 51 1HD PRO 51 11.874 14.735 6.110 421 2HD PRO 51 2HD PRO 51 12.094 16.418 6.629 422 H TRP 52 H TRP 52 8.892 13.244 10.034 423 HA TRP 52 HA TRP 52 10.583 10.853 10.305 424 1HB TRP 52 1HB TRP 52 9.223 12.393 12.412 425 2HB TRP 52 2HB TRP 52 8.925 10.659 12.475 426 HD1 TRP 52 HD1 TRP 52 12.095 12.874 12.018 427 HE1 TRP 52 HE1 TRP 52 13.962 11.877 13.484 428 HE3 TRP 52 HE3 TRP 52 9.554 8.892 13.974 429 HZ2 TRP 52 HZ2 TRP 52 14.311 9.691 15.236 430 HZ3 TRP 52 HZ3 TRP 52 10.726 7.397 15.537 431 HH2 TRP 52 HH2 TRP 52 13.056 7.789 16.154 432 H GLY 53 H GLY 53 9.688 9.073 9.489 433 1HA GLY 53 1HA GLY 53 6.749 9.004 9.196 434 2HA GLY 53 2HA GLY 53 7.815 8.513 7.889 435 H GLY 54 H GLY 54 5.873 7.349 10.233 436 1HA GLY 54 1HA GLY 54 6.866 4.688 9.965 437 2HA GLY 54 2HA GLY 54 7.228 5.341 11.556 438 H GLY 55 H GLY 55 5.443 3.127 10.706 439 1HA GLY 55 1HA GLY 55 3.203 3.870 12.378 440 2HA GLY 55 2HA GLY 55 2.777 3.562 10.701 441 H PHE 56 H PHE 56 1.562 2.006 12.455 442 HA PHE 56 HA PHE 56 2.689 -0.604 11.887 443 1HB PHE 56 1HB PHE 56 2.541 -1.378 14.216 444 2HB PHE 56 2HB PHE 56 3.706 -0.068 14.050 445 HD1 PHE 56 HD1 PHE 56 2.636 2.347 14.425 446 HD2 PHE 56 HD2 PHE 56 1.110 -1.300 15.999 447 HE1 PHE 56 HE1 PHE 56 1.480 3.601 16.198 448 HE2 PHE 56 HE2 PHE 56 -0.050 -0.052 17.775 449 HZ PHE 56 HZ PHE 56 0.134 2.401 17.875 450 H GLY 57 H GLY 57 1.163 -2.284 11.955 451 1HA GLY 57 1HA GLY 57 -1.544 -1.742 12.818 452 2HA GLY 57 2HA GLY 57 -1.352 -1.847 11.074 453 H LEU 58 H LEU 58 -2.991 -3.626 11.684 454 HA LEU 58 HA LEU 58 -1.481 -6.134 11.993 455 1HB LEU 58 1HB LEU 58 -4.182 -5.465 13.161 456 2HB LEU 58 2HB LEU 58 -3.502 -7.080 13.122 457 HG LEU 58 HG LEU 58 -1.998 -4.849 14.443 458 1HD1 LEU 58 1HD1 LEU 58 -4.476 -6.165 15.379 459 2HD1 LEU 58 2HD1 LEU 58 -3.826 -4.568 15.750 460 3HD1 LEU 58 3HD1 LEU 58 -3.169 -5.994 16.551 461 1HD2 LEU 58 1HD2 LEU 58 -2.067 -7.610 15.484 462 2HD2 LEU 58 2HD2 LEU 58 -0.715 -6.488 15.320 463 3HD2 LEU 58 3HD2 LEU 58 -1.292 -7.384 13.916 464 H SER 59 H SER 59 -2.622 -8.029 11.066 465 HA SER 59 HA SER 59 -4.595 -7.422 9.012 466 1HB SER 59 1HB SER 59 -3.010 -8.933 7.470 467 2HB SER 59 2HB SER 59 -2.872 -7.175 7.521 468 HG SER 59 HG SER 59 -0.873 -7.634 8.018 469 H ARG 60 H ARG 60 -5.365 -9.453 7.924 470 HA ARG 60 HA ARG 60 -4.956 -11.885 9.481 471 1HB ARG 60 1HB ARG 60 -7.633 -10.534 9.131 472 2HB ARG 60 2HB ARG 60 -7.454 -12.214 9.618 473 1HG ARG 60 1HG ARG 60 -6.499 -11.639 11.671 474 2HG ARG 60 2HG ARG 60 -6.139 -9.994 11.143 475 1HD ARG 60 1HD ARG 60 -8.501 -9.457 11.109 476 2HD ARG 60 2HD ARG 60 -8.910 -11.118 11.533 477 HE ARG 60 HE ARG 60 -8.455 -10.630 13.717 478 1HH1 ARG 60 1HH1 ARG 60 -7.029 -8.163 11.703 479 2HH1 ARG 60 2HH1 ARG 60 -6.571 -7.160 13.040 480 1HH2 ARG 60 1HH2 ARG 60 -7.853 -9.314 15.476 481 2HH2 ARG 60 2HH2 ARG 60 -7.038 -7.814 15.181 482 H TRP 61 H TRP 61 -5.452 -13.783 8.374 483 HA TRP 61 HA TRP 61 -5.529 -13.491 5.489 484 1HB TRP 61 1HB TRP 61 -4.193 -15.216 7.122 485 2HB TRP 61 2HB TRP 61 -5.561 -16.210 6.632 486 HD1 TRP 61 HD1 TRP 61 -5.902 -15.543 3.647 487 HE1 TRP 61 HE1 TRP 61 -4.077 -16.104 1.923 488 HE3 TRP 61 HE3 TRP 61 -1.884 -15.861 6.793 489 HZ2 TRP 61 HZ2 TRP 61 -1.300 -16.613 1.899 490 HZ3 TRP 61 HZ3 TRP 61 0.321 -16.389 5.838 491 HH2 TRP 61 HH2 TRP 61 0.606 -16.758 3.442 492 H ASP 62 H ASP 62 -7.166 -14.086 4.162 493 HA ASP 62 HA ASP 62 -9.694 -14.831 5.458 494 1HB ASP 62 1HB ASP 62 -8.983 -13.160 3.118 495 2HB ASP 62 2HB ASP 62 -10.443 -14.132 2.956 496 HD2 ASP 62 HD2 ASP 62 -11.716 -12.353 5.875 497 H GLU 63 H GLU 63 -10.604 -16.744 5.085 498 HA GLU 63 HA GLU 63 -9.308 -18.868 3.898 499 1HB GLU 63 1HB GLU 63 -11.345 -18.860 5.459 500 2HB GLU 63 2HB GLU 63 -12.309 -18.681 3.999 501 1HG GLU 63 1HG GLU 63 -11.152 -20.764 3.147 502 2HG GLU 63 2HG GLU 63 -10.545 -20.976 4.789 503 HE2 GLU 63 HE2 GLU 63 -14.073 -22.289 4.035 504 H LYS 64 H LYS 64 -11.159 -16.371 2.381 505 HA LYS 64 HA LYS 64 -11.457 -17.871 -0.095 506 1HB LYS 64 1HB LYS 64 -12.448 -15.239 0.919 507 2HB LYS 64 2HB LYS 64 -12.393 -15.519 -0.816 508 1HG LYS 64 1HG LYS 64 -13.650 -17.739 -0.143 509 2HG LYS 64 2HG LYS 64 -14.106 -16.769 1.259 510 1HD LYS 64 1HD LYS 64 -14.563 -15.017 -0.766 511 2HD LYS 64 2HD LYS 64 -14.945 -16.551 -1.550 512 1HE LYS 64 1HE LYS 64 -16.043 -16.211 1.158 513 2HE LYS 64 2HE LYS 64 -16.693 -15.115 -0.060 514 1HZ LYS 64 1HZ LYS 64 -18.071 -16.838 -0.428 515 2HZ LYS 64 2HZ LYS 64 -17.004 -17.991 0.200 516 3HZ LYS 64 3HZ LYS 64 -16.795 -17.417 -1.378 517 H GLY 65 H GLY 65 -8.780 -17.079 0.973 518 1HA GLY 65 1HA GLY 65 -6.780 -16.366 0.107 519 2HA GLY 65 2HA GLY 65 -7.565 -16.385 -1.465 520 H ASN 66 H ASN 66 -8.023 -14.425 1.477 521 HA ASN 66 HA ASN 66 -7.444 -12.034 -0.135 522 1HB ASN 66 1HB ASN 66 -9.904 -12.700 1.368 523 2HB ASN 66 2HB ASN 66 -9.297 -11.061 1.585 524 1HD2 ASN 66 1HD2 ASN 66 -9.205 -9.672 -0.190 525 2HD2 ASN 66 2HD2 ASN 66 -10.111 -9.975 -1.630 526 H TRP 67 H TRP 67 -6.780 -10.165 1.107 527 HA TRP 67 HA TRP 67 -5.710 -10.849 3.765 528 1HB TRP 67 1HB TRP 67 -3.971 -10.800 1.919 529 2HB TRP 67 2HB TRP 67 -4.295 -9.075 1.771 530 HD1 TRP 67 HD1 TRP 67 -2.940 -7.524 3.312 531 HE1 TRP 67 HE1 TRP 67 -1.379 -7.862 5.331 532 HE3 TRP 67 HE3 TRP 67 -3.675 -12.526 4.081 533 HZ2 TRP 67 HZ2 TRP 67 -0.566 -9.970 7.024 534 HZ3 TRP 67 HZ3 TRP 67 -2.468 -13.626 5.921 535 HH2 TRP 67 HH2 TRP 67 -0.945 -12.373 7.361 536 H HIS 68 H HIS 68 -7.213 -9.772 4.968 537 HA HIS 68 HA HIS 68 -7.619 -6.917 4.396 538 1HB HIS 68 1HB HIS 68 -9.372 -9.040 5.302 539 2HB HIS 68 2HB HIS 68 -9.403 -7.677 6.416 540 HD1 HIS 68 HD1 HIS 68 -9.973 -5.295 5.252 541 HD2 HIS 68 HD2 HIS 68 -10.890 -8.710 3.068 542 HE1 HIS 68 HE1 HIS 68 -11.595 -4.546 3.482 543 HE2 HIS 68 HE2 HIS 68 -12.069 -6.612 2.120 544 H GLY 69 H GLY 69 -7.206 -5.363 5.926 545 1HA GLY 69 1HA GLY 69 -6.731 -5.807 8.651 546 2HA GLY 69 2HA GLY 69 -5.186 -5.881 7.817 547 H LEU 70 H LEU 70 -5.808 -3.967 9.771 548 HA LEU 70 HA LEU 70 -5.878 -1.510 8.144 549 1HB LEU 70 1HB LEU 70 -6.726 -0.408 10.274 550 2HB LEU 70 2HB LEU 70 -7.852 -1.430 9.401 551 HG LEU 70 HG LEU 70 -6.295 -2.693 11.594 552 1HD1 LEU 70 1HD1 LEU 70 -6.846 -0.890 12.895 553 2HD1 LEU 70 2HD1 LEU 70 -8.291 -1.884 13.086 554 3HD1 LEU 70 3HD1 LEU 70 -8.298 -0.522 11.966 555 1HD2 LEU 70 1HD2 LEU 70 -8.230 -3.574 9.951 556 2HD2 LEU 70 2HD2 LEU 70 -9.215 -2.992 11.294 557 3HD2 LEU 70 3HD2 LEU 70 -7.968 -4.208 11.575 558 H TYR 71 H TYR 71 -4.593 0.267 8.929 559 HA TYR 71 HA TYR 71 -2.623 -0.273 10.985 560 1HB TYR 71 1HB TYR 71 -0.712 0.235 9.458 561 2HB TYR 71 2HB TYR 71 -1.517 -1.289 9.101 562 HD1 TYR 71 HD1 TYR 71 -2.694 -1.616 7.030 563 HD2 TYR 71 HD2 TYR 71 -0.986 2.168 7.960 564 HE1 TYR 71 HE1 TYR 71 -3.011 -0.906 4.698 565 HE2 TYR 71 HE2 TYR 71 -1.299 2.889 5.631 566 HH TYR 71 HH TYR 71 -3.209 1.138 3.405 567 H ALA 72 H ALA 72 -1.758 1.569 11.872 568 HA ALA 72 HA ALA 72 -2.638 4.126 10.697 569 1HB ALA 72 1HB ALA 72 -3.787 3.246 12.871 570 2HB ALA 72 2HB ALA 72 -3.326 4.944 12.736 571 3HB ALA 72 3HB ALA 72 -2.313 3.825 13.649 572 H MET 73 H MET 73 -0.944 5.254 10.030 573 HA MET 73 HA MET 73 1.603 4.981 11.478 574 1HB MET 73 1HB MET 73 2.687 5.757 9.422 575 2HB MET 73 2HB MET 73 1.713 4.325 9.124 576 1HG MET 73 1HG MET 73 0.359 6.903 8.703 577 2HG MET 73 2HG MET 73 1.669 6.526 7.586 578 1HE MET 73 1HE MET 73 1.658 4.834 5.815 579 2HE MET 73 2HE MET 73 0.493 6.049 5.289 580 3HE MET 73 3HE MET 73 0.135 4.334 5.079 581 H ALA 74 H ALA 74 3.003 7.086 11.057 582 HA ALA 74 HA ALA 74 1.351 9.475 11.460 583 1HB ALA 74 1HB ALA 74 3.726 9.279 13.199 584 2HB ALA 74 2HB ALA 74 2.373 8.226 13.611 585 3HB ALA 74 3HB ALA 74 2.136 9.971 13.519 586 H PHE 75 H PHE 75 2.209 11.350 10.666 587 HA PHE 75 HA PHE 75 4.896 11.187 9.473 588 1HB PHE 75 1HB PHE 75 2.311 11.837 8.220 589 2HB PHE 75 2HB PHE 75 3.612 12.961 7.841 590 HD1 PHE 75 HD1 PHE 75 2.980 9.289 8.016 591 HD2 PHE 75 HD2 PHE 75 4.950 12.498 6.037 592 HE1 PHE 75 HE1 PHE 75 3.837 7.716 6.330 593 HE2 PHE 75 HE2 PHE 75 5.812 10.932 4.346 594 HZ PHE 75 HZ PHE 75 5.255 8.538 4.491 595 H LYS 76 H LYS 76 6.089 13.125 9.383 596 HA LYS 76 HA LYS 76 5.113 15.207 11.225 597 1HB LYS 76 1HB LYS 76 7.327 13.706 11.561 598 2HB LYS 76 2HB LYS 76 8.009 15.029 10.626 599 1HG LYS 76 1HG LYS 76 7.775 16.522 12.304 600 2HG LYS 76 2HG LYS 76 6.284 15.787 12.897 601 1HD LYS 76 1HD LYS 76 7.766 13.849 13.673 602 2HD LYS 76 2HD LYS 76 9.123 14.944 13.404 603 1HE LYS 76 1HE LYS 76 7.992 16.584 14.915 604 2HE LYS 76 2HE LYS 76 6.801 15.338 15.283 605 1HZ LYS 76 1HZ LYS 76 8.304 15.084 16.980 606 2HZ LYS 76 2HZ LYS 76 9.644 15.459 16.019 607 3HZ LYS 76 3HZ LYS 76 8.892 13.952 15.869 608 H ASP 77 H ASP 77 5.201 17.331 10.630 609 HA ASP 77 HA ASP 77 5.601 17.844 7.793 610 1HB ASP 77 1HB ASP 77 3.635 18.672 9.369 611 2HB ASP 77 2HB ASP 77 4.762 19.985 9.698 612 HD2 ASP 77 HD2 ASP 77 3.171 19.735 6.073 613 H SER 78 H SER 78 6.524 20.160 7.348 614 HA SER 78 HA SER 78 9.238 20.119 8.304 615 1HB SER 78 1HB SER 78 7.727 21.690 6.248 616 2HB SER 78 2HB SER 78 9.293 22.280 6.806 617 HG SER 78 HG SER 78 8.934 20.548 4.949 618 H TRP 79 H TRP 79 6.352 21.984 8.903 619 HA TRP 79 HA TRP 79 7.849 23.904 10.529 620 1HB TRP 79 1HB TRP 79 5.338 23.964 9.046 621 2HB TRP 79 2HB TRP 79 5.168 24.605 10.676 622 HD1 TRP 79 HD1 TRP 79 6.914 26.679 11.307 623 HE1 TRP 79 HE1 TRP 79 7.783 28.569 9.790 624 HE3 TRP 79 HE3 TRP 79 5.952 24.573 6.749 625 HZ2 TRP 79 HZ2 TRP 79 8.028 29.098 7.029 626 HZ3 TRP 79 HZ3 TRP 79 6.534 25.835 4.719 627 HH2 TRP 79 HH2 TRP 79 7.549 28.052 4.858 628 H ASN 80 H ASN 80 7.484 21.113 11.341 629 HA ASN 80 HA ASN 80 7.008 19.910 13.210 630 1HB ASN 80 1HB ASN 80 7.965 22.227 14.129 631 2HB ASN 80 2HB ASN 80 6.334 22.348 14.783 632 1HD2 ASN 80 1HD2 ASN 80 9.320 21.525 15.595 633 2HD2 ASN 80 2HD2 ASN 80 9.013 20.292 16.766 634 H LYS 81 H LYS 81 5.128 18.951 12.439 635 HA LYS 81 HA LYS 81 2.727 19.694 13.853 636 1HB LYS 81 1HB LYS 81 2.768 19.717 10.830 637 2HB LYS 81 2HB LYS 81 1.321 19.823 11.824 638 1HG LYS 81 1HG LYS 81 2.216 21.919 12.806 639 2HG LYS 81 2HG LYS 81 3.560 21.827 11.666 640 1HD LYS 81 1HD LYS 81 2.272 22.415 9.890 641 2HD LYS 81 2HD LYS 81 0.834 21.619 10.532 642 1HE LYS 81 1HE LYS 81 0.924 23.520 12.315 643 2HE LYS 81 2HE LYS 81 1.916 24.344 11.113 644 1HZ LYS 81 1HZ LYS 81 -0.591 24.737 11.079 645 2HZ LYS 81 2HZ LYS 81 -0.706 23.196 10.393 646 3HZ LYS 81 3HZ LYS 81 0.171 24.407 9.604 647 H TRP 82 H TRP 82 3.371 17.591 14.726 648 HA TRP 82 HA TRP 82 3.346 15.249 13.126 649 1HB TRP 82 1HB TRP 82 4.213 15.744 15.608 650 2HB TRP 82 2HB TRP 82 2.638 15.069 16.010 651 HD1 TRP 82 HD1 TRP 82 5.391 13.976 13.482 652 HE1 TRP 82 HE1 TRP 82 5.804 11.457 13.816 653 HE3 TRP 82 HE3 TRP 82 2.098 13.112 17.296 654 HZ2 TRP 82 HZ2 TRP 82 4.859 9.380 15.477 655 HZ3 TRP 82 HZ3 TRP 82 1.913 10.831 18.201 656 HH2 TRP 82 HH2 TRP 82 3.266 9.005 17.308 657 H GLU 83 H GLU 83 1.648 14.386 12.150 658 HA GLU 83 HA GLU 83 -0.953 14.464 13.517 659 1HB GLU 83 1HB GLU 83 -0.526 14.891 10.554 660 2HB GLU 83 2HB GLU 83 -2.078 14.852 11.380 661 1HG GLU 83 1HG GLU 83 -1.342 16.830 12.703 662 2HG GLU 83 2HG GLU 83 0.095 16.909 11.683 663 HE2 GLU 83 HE2 GLU 83 -3.173 17.468 9.542 664 HA PRO 84 HA PRO 84 -0.740 10.102 12.652 665 1HB PRO 84 1HB PRO 84 -3.175 9.391 13.541 666 2HB PRO 84 2HB PRO 84 -1.887 9.885 14.647 667 1HG PRO 84 1HG PRO 84 -4.209 11.469 13.617 668 2HG PRO 84 2HG PRO 84 -3.547 11.393 15.260 669 1HD PRO 84 1HD PRO 84 -2.998 13.411 13.500 670 2HD PRO 84 2HD PRO 84 -1.891 12.909 14.793 671 H ILE 85 H ILE 85 -1.834 8.461 11.369 672 HA ILE 85 HA ILE 85 -3.795 9.456 9.438 673 HB ILE 85 HB ILE 85 -1.323 7.972 8.548 674 1HG1 ILE 85 1HG1 ILE 85 -1.080 10.400 7.393 675 2HG1 ILE 85 2HG1 ILE 85 -1.849 10.868 8.905 676 1HG2 ILE 85 1HG2 ILE 85 -2.744 7.539 6.853 677 2HG2 ILE 85 2HG2 ILE 85 -2.313 9.175 6.353 678 3HG2 ILE 85 3HG2 ILE 85 -3.803 8.893 7.253 679 1HD1 ILE 85 1HD1 ILE 85 0.055 9.267 9.872 680 2HD1 ILE 85 2HD1 ILE 85 0.293 10.991 9.584 681 3HD1 ILE 85 3HD1 ILE 85 0.854 9.814 8.397 682 H ALA 86 H ALA 86 -5.432 8.076 9.398 683 HA ALA 86 HA ALA 86 -4.982 5.294 10.198 684 1HB ALA 86 1HB ALA 86 -7.161 5.206 10.906 685 2HB ALA 86 2HB ALA 86 -7.707 6.404 9.732 686 3HB ALA 86 3HB ALA 86 -6.808 6.916 11.161 687 H GLY 87 H GLY 87 -4.976 3.697 8.756 688 1HA GLY 87 1HA GLY 87 -6.450 4.039 6.239 689 2HA GLY 87 2HA GLY 87 -4.737 3.656 6.163 690 H TYR 88 H TYR 88 -7.272 2.194 5.370 691 HA TYR 88 HA TYR 88 -6.389 -0.402 6.278 692 1HB TYR 88 1HB TYR 88 -8.691 -1.063 7.036 693 2HB TYR 88 2HB TYR 88 -7.879 0.089 8.092 694 HD1 TYR 88 HD1 TYR 88 -8.561 2.492 8.041 695 HD2 TYR 88 HD2 TYR 88 -10.734 -0.516 5.959 696 HE1 TYR 88 HE1 TYR 88 -10.488 4.010 7.872 697 HE2 TYR 88 HE2 TYR 88 -12.667 0.994 5.783 698 HH TYR 88 HH TYR 88 -12.926 3.664 5.799 699 H GLY 89 H GLY 89 -7.105 -2.102 4.965 700 1HA GLY 89 1HA GLY 89 -9.111 -1.862 2.993 701 2HA GLY 89 2HA GLY 89 -7.550 -1.497 2.274 702 H TRP 90 H TRP 90 -7.928 -3.365 0.924 703 HA TRP 90 HA TRP 90 -7.027 -5.820 2.246 704 1HB TRP 90 1HB TRP 90 -8.615 -7.129 0.800 705 2HB TRP 90 2HB TRP 90 -9.389 -6.167 2.056 706 HD1 TRP 90 HD1 TRP 90 -11.202 -4.485 1.293 707 HE1 TRP 90 HE1 TRP 90 -12.119 -3.717 -0.985 708 HE3 TRP 90 HE3 TRP 90 -7.753 -6.704 -1.759 709 HZ2 TRP 90 HZ2 TRP 90 -11.467 -4.012 -3.716 710 HZ3 TRP 90 HZ3 TRP 90 -7.971 -6.413 -4.192 711 HH2 TRP 90 HH2 TRP 90 -9.789 -5.094 -5.149 712 H GLU 91 H GLU 91 -5.851 -7.246 0.919 713 HA GLU 91 HA GLU 91 -5.212 -6.306 -1.782 714 1HB GLU 91 1HB GLU 91 -2.801 -6.671 -1.365 715 2HB GLU 91 2HB GLU 91 -3.467 -5.375 -0.381 716 1HG GLU 91 1HG GLU 91 -3.574 -6.858 1.538 717 2HG GLU 91 2HG GLU 91 -2.964 -8.190 0.558 718 HE2 GLU 91 HE2 GLU 91 0.284 -7.164 0.969 719 H SER 92 H SER 92 -4.570 -7.908 -3.221 720 HA SER 92 HA SER 92 -4.872 -10.668 -2.233 721 1HB SER 92 1HB SER 92 -5.341 -10.129 -5.109 722 2HB SER 92 2HB SER 92 -6.196 -11.209 -4.008 723 HG SER 92 HG SER 92 -7.033 -9.172 -3.055 724 H THR 93 H THR 93 -2.796 -11.313 -1.982 725 HA THR 93 HA THR 93 -0.828 -10.721 -4.043 726 HB THR 93 HB THR 93 -0.137 -10.482 -1.722 727 HG1 THR 93 HG1 THR 93 1.073 -12.752 -2.915 728 1HG2 THR 93 1HG2 THR 93 -1.632 -12.751 -1.217 729 2HG2 THR 93 2HG2 THR 93 -0.564 -11.914 -0.089 730 3HG2 THR 93 3HG2 THR 93 0.041 -13.278 -1.030 731 H TRP 94 H TRP 94 0.208 -12.248 -5.298 732 HA TRP 94 HA TRP 94 -0.834 -14.994 -5.176 733 1HB TRP 94 1HB TRP 94 -1.268 -13.084 -7.266 734 2HB TRP 94 2HB TRP 94 -0.264 -14.388 -7.892 735 HD1 TRP 94 HD1 TRP 94 -3.802 -13.537 -7.117 736 HE1 TRP 94 HE1 TRP 94 -5.304 -15.600 -7.452 737 HE3 TRP 94 HE3 TRP 94 -0.181 -17.122 -7.530 738 HZ2 TRP 94 HZ2 TRP 94 -4.996 -18.378 -7.841 739 HZ3 TRP 94 HZ3 TRP 94 -0.868 -19.458 -7.883 740 HH2 TRP 94 HH2 TRP 94 -3.227 -20.071 -8.034 741 H ARG 95 H ARG 95 0.613 -16.613 -5.667 742 HA ARG 95 HA ARG 95 3.395 -15.905 -5.465 743 1HB ARG 95 1HB ARG 95 2.279 -18.664 -5.947 744 2HB ARG 95 2HB ARG 95 3.814 -18.232 -5.206 745 1HG ARG 95 1HG ARG 95 2.708 -18.651 -3.299 746 2HG ARG 95 2HG ARG 95 2.112 -17.005 -3.519 747 1HD ARG 95 1HD ARG 95 0.373 -18.494 -5.040 748 2HD ARG 95 2HD ARG 95 0.694 -19.551 -3.665 749 HE ARG 95 HE ARG 95 -0.836 -17.142 -3.660 750 1HH1 ARG 95 1HH1 ARG 95 1.226 -19.158 -1.695 751 2HH1 ARG 95 2HH1 ARG 95 0.536 -18.624 -0.201 752 1HH2 ARG 95 1HH2 ARG 95 -1.745 -16.437 -1.694 753 2HH2 ARG 95 2HH2 ARG 95 -1.151 -17.080 -0.199 754 HA PRO 96 HA PRO 96 4.192 -16.055 -9.829 755 1HB PRO 96 1HB PRO 96 6.859 -15.934 -9.797 756 2HB PRO 96 2HB PRO 96 5.875 -14.572 -9.248 757 1HG PRO 96 1HG PRO 96 7.318 -16.637 -7.638 758 2HG PRO 96 2HG PRO 96 7.172 -14.894 -7.351 759 1HD PRO 96 1HD PRO 96 5.644 -16.833 -6.103 760 2HD PRO 96 2HD PRO 96 5.179 -15.128 -6.268 761 H LEU 97 H LEU 97 4.489 -18.660 -7.875 762 HA LEU 97 HA LEU 97 4.825 -20.878 -8.229 763 1HB LEU 97 1HB LEU 97 4.025 -19.839 -10.720 764 2HB LEU 97 2HB LEU 97 5.376 -20.904 -11.055 765 HG LEU 97 HG LEU 97 3.178 -22.029 -11.226 766 1HD1 LEU 97 1HD1 LEU 97 4.650 -23.195 -8.893 767 2HD1 LEU 97 2HD1 LEU 97 5.383 -23.137 -10.496 768 3HD1 LEU 97 3HD1 LEU 97 3.876 -24.018 -10.248 769 1HD2 LEU 97 1HD2 LEU 97 3.013 -21.722 -8.237 770 2HD2 LEU 97 2HD2 LEU 97 1.812 -22.415 -9.327 771 3HD2 LEU 97 3HD2 LEU 97 2.143 -20.684 -9.365 772 H ALA 98 H ALA 98 6.494 -22.450 -8.703 773 HA ALA 98 HA ALA 98 8.651 -23.168 -8.741 774 1HB ALA 98 1HB ALA 98 10.219 -21.558 -10.155 775 2HB ALA 98 2HB ALA 98 8.661 -20.933 -10.692 776 3HB ALA 98 3HB ALA 98 9.052 -22.637 -10.918 777 H ASP 99 H ASP 99 7.725 -21.388 -6.626 778 HA ASP 99 HA ASP 99 10.305 -20.760 -5.492 779 1HB ASP 99 1HB ASP 99 8.335 -18.632 -6.258 780 2HB ASP 99 2HB ASP 99 9.360 -18.408 -4.843 781 HD2 ASP 99 HD2 ASP 99 10.959 -17.262 -8.004 782 H GLU 100 H GLU 100 6.840 -20.060 -4.999 783 HA GLU 100 HA GLU 100 5.456 -20.398 -3.227 784 1HB GLU 100 1HB GLU 100 7.384 -22.665 -3.021 785 2HB GLU 100 2HB GLU 100 6.286 -22.383 -1.679 786 1HG GLU 100 1HG GLU 100 5.174 -23.933 -2.998 787 2HG GLU 100 2HG GLU 100 4.429 -22.396 -3.434 788 HE2 GLU 100 HE2 GLU 100 5.242 -22.899 -6.712 789 H ASN 101 H ASN 101 7.466 -18.410 -2.970 790 HA ASN 101 HA ASN 101 7.558 -18.234 -0.062 791 1HB ASN 101 1HB ASN 101 9.768 -19.185 -1.099 792 2HB ASN 101 2HB ASN 101 10.048 -17.511 -1.566 793 1HD2 ASN 101 1HD2 ASN 101 8.721 -19.096 1.320 794 2HD2 ASN 101 2HD2 ASN 101 9.771 -18.307 2.443 795 H PHE 102 H PHE 102 8.466 -16.597 -3.091 796 HA PHE 102 HA PHE 102 8.246 -13.979 -2.014 797 1HB PHE 102 1HB PHE 102 8.070 -14.821 -4.915 798 2HB PHE 102 2HB PHE 102 8.448 -13.212 -4.309 799 HD1 PHE 102 HD1 PHE 102 9.953 -15.546 -6.034 800 HD2 PHE 102 HD2 PHE 102 10.375 -13.761 -2.194 801 HE1 PHE 102 HE1 PHE 102 12.347 -16.115 -6.037 802 HE2 PHE 102 HE2 PHE 102 12.769 -14.326 -2.189 803 HZ PHE 102 HZ PHE 102 13.758 -15.504 -4.113 804 H HIS 103 H HIS 103 6.649 -12.385 -2.464 805 HA HIS 103 HA HIS 103 4.022 -13.441 -3.255 806 1HB HIS 103 1HB HIS 103 3.061 -11.884 -1.467 807 2HB HIS 103 2HB HIS 103 3.835 -13.360 -0.903 808 HD1 HIS 103 HD1 HIS 103 6.525 -12.916 -0.263 809 HD2 HIS 103 HD2 HIS 103 3.893 -9.704 -0.113 810 HE1 HIS 103 HE1 HIS 103 7.646 -11.195 1.187 811 HE2 HIS 103 HE2 HIS 103 5.999 -9.294 1.330 812 H LEU 104 H LEU 104 3.026 -12.252 -4.748 813 HA LEU 104 HA LEU 104 3.484 -9.388 -4.914 814 1HB LEU 104 1HB LEU 104 3.872 -9.679 -7.446 815 2HB LEU 104 2HB LEU 104 5.217 -9.934 -6.351 816 HG LEU 104 HG LEU 104 3.558 -12.253 -7.281 817 1HD1 LEU 104 1HD1 LEU 104 6.057 -11.587 -8.728 818 2HD1 LEU 104 2HD1 LEU 104 4.603 -10.680 -9.146 819 3HD1 LEU 104 3HD1 LEU 104 4.616 -12.438 -9.283 820 1HD2 LEU 104 1HD2 LEU 104 6.144 -11.812 -5.919 821 2HD2 LEU 104 2HD2 LEU 104 6.074 -13.139 -7.079 822 3HD2 LEU 104 3HD2 LEU 104 4.956 -13.100 -5.715 823 H GLY 105 H GLY 105 1.686 -8.332 -5.508 824 1HA GLY 105 1HA GLY 105 -0.233 -9.359 -7.337 825 2HA GLY 105 2HA GLY 105 -0.787 -9.575 -5.683 826 H LEU 106 H LEU 106 -2.545 -8.151 -6.411 827 HA LEU 106 HA LEU 106 -1.789 -5.338 -6.034 828 1HB LEU 106 1HB LEU 106 -3.603 -4.737 -7.668 829 2HB LEU 106 2HB LEU 106 -2.172 -5.474 -8.364 830 HG LEU 106 HG LEU 106 -4.458 -7.255 -7.686 831 1HD1 LEU 106 1HD1 LEU 106 -5.512 -5.332 -8.792 832 2HD1 LEU 106 2HD1 LEU 106 -5.560 -6.784 -9.792 833 3HD1 LEU 106 3HD1 LEU 106 -4.393 -5.511 -10.144 834 1HD2 LEU 106 1HD2 LEU 106 -2.465 -8.279 -8.516 835 2HD2 LEU 106 2HD2 LEU 106 -2.381 -7.145 -9.864 836 3HD2 LEU 106 3HD2 LEU 106 -3.679 -8.337 -9.796 837 H GLY 107 H GLY 107 -3.824 -3.981 -5.573 838 1HA GLY 107 1HA GLY 107 -6.154 -5.168 -4.537 839 2HA GLY 107 2HA GLY 107 -5.015 -4.936 -3.219 840 H PHE 108 H PHE 108 -6.653 -3.506 -2.334 841 HA PHE 108 HA PHE 108 -6.355 -0.792 -3.406 842 1HB PHE 108 1HB PHE 108 -8.875 -2.300 -2.978 843 2HB PHE 108 2HB PHE 108 -8.870 -0.616 -2.463 844 HD1 PHE 108 HD1 PHE 108 -9.766 -2.653 -5.049 845 HD2 PHE 108 HD2 PHE 108 -7.594 0.936 -4.335 846 HE1 PHE 108 HE1 PHE 108 -10.174 -1.950 -7.370 847 HE2 PHE 108 HE2 PHE 108 -7.998 1.647 -6.656 848 HZ PHE 108 HZ PHE 108 -9.290 0.203 -8.176 849 H THR 109 H THR 109 -6.315 0.844 -1.879 850 HA THR 109 HA THR 109 -6.487 0.026 0.939 851 HB THR 109 HB THR 109 -4.118 0.088 0.277 852 HG1 THR 109 HG1 THR 109 -4.773 2.313 1.903 853 1HG2 THR 109 1HG2 THR 109 -4.559 3.006 -0.307 854 2HG2 THR 109 2HG2 THR 109 -4.251 1.756 -1.513 855 3HG2 THR 109 3HG2 THR 109 -3.017 2.150 -0.315 856 H ALA 110 H ALA 110 -7.166 1.610 2.388 857 HA ALA 110 HA ALA 110 -8.335 4.002 1.126 858 1HB ALA 110 1HB ALA 110 -9.319 3.097 3.769 859 2HB ALA 110 2HB ALA 110 -9.723 2.099 2.372 860 3HB ALA 110 3HB ALA 110 -10.197 3.798 2.409 861 H GLY 111 H GLY 111 -7.476 5.894 1.661 862 1HA GLY 111 1HA GLY 111 -5.854 6.039 4.120 863 2HA GLY 111 2HA GLY 111 -5.613 7.043 2.697 864 H VAL 112 H VAL 112 -6.702 7.087 5.778 865 HA VAL 112 HA VAL 112 -8.593 9.283 5.229 866 HB VAL 112 HB VAL 112 -8.547 7.578 7.719 867 1HG1 VAL 112 1HG1 VAL 112 -11.021 8.619 7.579 868 2HG1 VAL 112 2HG1 VAL 112 -10.104 9.907 6.796 869 3HG1 VAL 112 3HG1 VAL 112 -9.685 9.395 8.431 870 1HG2 VAL 112 1HG2 VAL 112 -9.841 7.156 5.100 871 2HG2 VAL 112 2HG2 VAL 112 -10.853 6.895 6.521 872 3HG2 VAL 112 3HG2 VAL 112 -9.353 5.988 6.328 873 H THR 113 H THR 113 -7.785 11.210 5.704 874 HA THR 113 HA THR 113 -5.716 11.406 7.787 875 HB THR 113 HB THR 113 -6.346 13.467 5.676 876 HG1 THR 113 HG1 THR 113 -4.560 12.562 4.555 877 1HG2 THR 113 1HG2 THR 113 -4.095 14.250 6.062 878 2HG2 THR 113 2HG2 THR 113 -3.842 12.991 7.272 879 3HG2 THR 113 3HG2 THR 113 -5.018 14.273 7.565 880 H ALA 114 H ALA 114 -6.259 12.292 9.658 881 HA ALA 114 HA ALA 114 -8.589 14.097 9.737 882 1HB ALA 114 1HB ALA 114 -8.479 11.716 10.963 883 2HB ALA 114 2HB ALA 114 -9.383 13.089 11.599 884 3HB ALA 114 3HB ALA 114 -7.773 12.728 12.223 885 H ARG 115 H ARG 115 -8.543 15.758 11.404 886 HA ARG 115 HA ARG 115 -5.800 16.588 12.093 887 1HB ARG 115 1HB ARG 115 -8.102 18.169 11.002 888 2HB ARG 115 2HB ARG 115 -6.890 18.961 11.999 889 1HG ARG 115 1HG ARG 115 -5.244 17.769 10.307 890 2HG ARG 115 2HG ARG 115 -6.666 17.844 9.264 891 1HD ARG 115 1HD ARG 115 -6.640 20.354 10.290 892 2HD ARG 115 2HD ARG 115 -4.915 19.994 10.242 893 HE ARG 115 HE ARG 115 -4.989 20.091 7.953 894 1HH1 ARG 115 1HH1 ARG 115 -8.246 19.907 9.190 895 2HH1 ARG 115 2HH1 ARG 115 -8.981 20.215 7.652 896 1HH2 ARG 115 1HH2 ARG 115 -5.952 20.496 5.930 897 2HH2 ARG 115 2HH2 ARG 115 -7.678 20.549 5.801 898 H ASP 116 H ASP 116 -5.440 16.701 14.199 899 HA ASP 116 HA ASP 116 -7.631 16.557 16.073 900 1HB ASP 116 1HB ASP 116 -5.525 15.268 16.387 901 2HB ASP 116 2HB ASP 116 -4.665 16.786 16.621 902 HD2 ASP 116 HD2 ASP 116 -7.262 15.870 19.487 903 H ASN 117 H ASN 117 -5.428 18.973 14.873 904 HA ASN 117 HA ASN 117 -5.595 20.876 16.904 905 1HB ASN 117 1HB ASN 117 -4.939 20.908 14.015 906 2HB ASN 117 2HB ASN 117 -5.398 22.454 14.719 907 1HD2 ASN 117 1HD2 ASN 117 -2.816 21.354 13.704 908 2HD2 ASN 117 2HD2 ASN 117 -1.692 21.615 14.990 909 H TRP 118 H TRP 118 -7.727 20.295 14.139 910 HA TRP 118 HA TRP 118 -10.024 21.232 15.452 911 1HB TRP 118 1HB TRP 118 -8.652 23.397 14.953 912 2HB TRP 118 2HB TRP 118 -9.217 23.164 13.302 913 HD1 TRP 118 HD1 TRP 118 -11.800 22.085 15.748 914 HE1 TRP 118 HE1 TRP 118 -13.640 23.873 15.945 915 HE3 TRP 118 HE3 TRP 118 -9.474 25.919 13.292 916 HZ2 TRP 118 HZ2 TRP 118 -14.051 26.554 15.164 917 HZ3 TRP 118 HZ3 TRP 118 -10.660 28.062 13.061 918 HH2 TRP 118 HH2 TRP 118 -12.901 28.371 13.977 919 H ASN 119 H ASN 119 -10.931 19.393 14.582 920 HA ASN 119 HA ASN 119 -12.184 19.619 12.081 921 1HB ASN 119 1HB ASN 119 -9.821 19.139 11.328 922 2HB ASN 119 2HB ASN 119 -9.974 17.557 12.087 923 1HD2 ASN 119 1HD2 ASN 119 -9.467 18.004 9.355 924 2HD2 ASN 119 2HD2 ASN 119 -10.805 17.383 8.455 925 H TYR 120 H TYR 120 -13.994 18.473 12.243 926 HA TYR 120 HA TYR 120 -14.278 16.538 14.371 927 1HB TYR 120 1HB TYR 120 -16.014 18.299 13.677 928 2HB TYR 120 2HB TYR 120 -16.378 17.233 12.324 929 HD1 TYR 120 HD1 TYR 120 -15.906 16.941 16.026 930 HD2 TYR 120 HD2 TYR 120 -18.184 15.836 12.609 931 HE1 TYR 120 HE1 TYR 120 -17.426 15.651 17.465 932 HE2 TYR 120 HE2 TYR 120 -19.712 14.544 14.037 933 HH TYR 120 HH TYR 120 -19.463 13.366 16.406 934 H ILE 121 H ILE 121 -15.016 16.473 10.877 935 HA ILE 121 HA ILE 121 -14.699 13.559 10.932 936 HB ILE 121 HB ILE 121 -15.801 15.237 8.681 937 1HG1 ILE 121 1HG1 ILE 121 -17.151 15.512 10.733 938 2HG1 ILE 121 2HG1 ILE 121 -18.026 14.639 9.479 939 1HG2 ILE 121 1HG2 ILE 121 -14.993 13.022 8.040 940 2HG2 ILE 121 2HG2 ILE 121 -16.748 13.131 7.902 941 3HG2 ILE 121 3HG2 ILE 121 -16.022 12.289 9.271 942 1HD1 ILE 121 1HD1 ILE 121 -17.812 13.875 12.081 943 2HD1 ILE 121 2HD1 ILE 121 -16.555 12.908 11.309 944 3HD1 ILE 121 3HD1 ILE 121 -18.220 12.809 10.736 945 HA PRO 122 HA PRO 122 -10.787 14.010 8.857 946 1HB PRO 122 1HB PRO 122 -10.382 11.435 8.169 947 2HB PRO 122 2HB PRO 122 -10.261 11.990 9.843 948 1HG PRO 122 1HG PRO 122 -12.529 10.600 8.468 949 2HG PRO 122 2HG PRO 122 -11.853 10.309 10.082 950 1HD PRO 122 1HD PRO 122 -14.118 11.759 9.654 951 2HD PRO 122 2HD PRO 122 -13.025 12.048 11.021 952 H LEU 123 H LEU 123 -9.851 12.706 6.725 953 HA LEU 123 HA LEU 123 -11.837 13.164 4.597 954 1HB LEU 123 1HB LEU 123 -8.953 13.989 4.755 955 2HB LEU 123 2HB LEU 123 -9.761 13.807 3.209 956 HG LEU 123 HG LEU 123 -10.923 15.582 5.329 957 1HD1 LEU 123 1HD1 LEU 123 -9.511 17.294 4.931 958 2HD1 LEU 123 2HD1 LEU 123 -9.247 16.829 3.250 959 3HD1 LEU 123 3HD1 LEU 123 -8.387 15.992 4.542 960 1HD2 LEU 123 1HD2 LEU 123 -12.470 15.435 3.660 961 2HD2 LEU 123 2HD2 LEU 123 -11.260 15.132 2.413 962 3HD2 LEU 123 3HD2 LEU 123 -11.494 16.765 3.034 963 HA PRO 124 HA PRO 124 -10.311 8.852 4.128 964 1HB PRO 124 1HB PRO 124 -12.669 7.805 3.337 965 2HB PRO 124 2HB PRO 124 -12.283 8.078 5.040 966 1HG PRO 124 1HG PRO 124 -13.934 9.747 3.183 967 2HG PRO 124 2HG PRO 124 -14.254 9.301 4.869 968 1HD PRO 124 1HD PRO 124 -13.240 11.719 4.138 969 2HD PRO 124 2HD PRO 124 -12.880 10.948 5.696 970 H VAL 125 H VAL 125 -9.778 7.738 2.266 971 HA VAL 125 HA VAL 125 -10.894 8.518 -0.289 972 HB VAL 125 HB VAL 125 -8.667 9.011 -1.287 973 1HG1 VAL 125 1HG1 VAL 125 -8.749 11.267 -0.791 974 2HG1 VAL 125 2HG1 VAL 125 -9.127 10.987 0.909 975 3HG1 VAL 125 3HG1 VAL 125 -10.362 10.730 -0.324 976 1HG2 VAL 125 1HG2 VAL 125 -7.530 9.638 1.371 977 2HG2 VAL 125 2HG2 VAL 125 -6.733 9.098 -0.107 978 3HG2 VAL 125 3HG2 VAL 125 -7.584 7.937 0.911 979 H LEU 126 H LEU 126 -10.103 7.161 -2.062 980 HA LEU 126 HA LEU 126 -8.897 4.639 -1.144 981 1HB LEU 126 1HB LEU 126 -11.181 4.843 -3.106 982 2HB LEU 126 2HB LEU 126 -10.439 3.371 -2.508 983 HG LEU 126 HG LEU 126 -11.276 4.675 -0.200 984 1HD1 LEU 126 1HD1 LEU 126 -12.632 5.977 -2.131 985 2HD1 LEU 126 2HD1 LEU 126 -13.250 5.709 -0.501 986 3HD1 LEU 126 3HD1 LEU 126 -13.733 4.636 -1.816 987 1HD2 LEU 126 1HD2 LEU 126 -13.237 2.894 -0.574 988 2HD2 LEU 126 2HD2 LEU 126 -11.598 2.436 -0.110 989 3HD2 LEU 126 3HD2 LEU 126 -12.100 2.330 -1.798 990 H LEU 127 H LEU 127 -7.316 3.854 -2.405 991 HA LEU 127 HA LEU 127 -7.108 4.678 -5.187 992 1HB LEU 127 1HB LEU 127 -4.803 5.437 -4.958 993 2HB LEU 127 2HB LEU 127 -5.891 6.422 -3.999 994 HG LEU 127 HG LEU 127 -5.150 4.692 -2.101 995 1HD1 LEU 127 1HD1 LEU 127 -2.534 4.608 -2.576 996 2HD1 LEU 127 2HD1 LEU 127 -3.111 4.483 -4.238 997 3HD1 LEU 127 3HD1 LEU 127 -3.624 3.299 -3.035 998 1HD2 LEU 127 1HD2 LEU 127 -4.790 6.834 -1.478 999 2HD2 LEU 127 2HD2 LEU 127 -4.098 7.287 -3.036 1000 3HD2 LEU 127 3HD2 LEU 127 -3.116 6.422 -1.853 1001 HA PRO 128 HA PRO 128 -5.642 0.529 -5.581 1002 1HB PRO 128 1HB PRO 128 -4.353 0.680 -7.953 1003 2HB PRO 128 2HB PRO 128 -6.115 0.742 -7.824 1004 1HG PRO 128 1HG PRO 128 -4.160 2.986 -8.149 1005 2HG PRO 128 2HG PRO 128 -5.718 2.735 -8.956 1006 1HD PRO 128 1HD PRO 128 -5.404 4.420 -6.850 1007 2HD PRO 128 2HD PRO 128 -6.918 3.549 -7.170 1008 H LEU 129 H LEU 129 -3.738 -0.768 -5.557 1009 HA LEU 129 HA LEU 129 -1.128 0.375 -5.624 1010 1HB LEU 129 1HB LEU 129 -0.517 0.139 -3.317 1011 2HB LEU 129 2HB LEU 129 -1.919 1.186 -3.423 1012 HG LEU 129 HG LEU 129 -2.091 -1.744 -2.730 1013 1HD1 LEU 129 1HD1 LEU 129 -1.831 0.672 -0.958 1014 2HD1 LEU 129 2HD1 LEU 129 -0.830 -0.780 -0.979 1015 3HD1 LEU 129 3HD1 LEU 129 -2.493 -0.865 -0.399 1016 1HD2 LEU 129 1HD2 LEU 129 -4.226 -1.254 -3.295 1017 2HD2 LEU 129 2HD2 LEU 129 -4.014 0.478 -3.035 1018 3HD2 LEU 129 3HD2 LEU 129 -4.260 -0.597 -1.659 1019 H ALA 130 H ALA 130 0.560 -1.229 -5.143 1020 HA ALA 130 HA ALA 130 -0.429 -3.994 -5.390 1021 1HB ALA 130 1HB ALA 130 2.164 -3.327 -6.645 1022 2HB ALA 130 2HB ALA 130 0.713 -2.715 -7.440 1023 3HB ALA 130 3HB ALA 130 0.905 -4.446 -7.165 1024 H SER 131 H SER 131 0.683 -5.581 -4.293 1025 HA SER 131 HA SER 131 2.743 -4.622 -2.418 1026 1HB SER 131 1HB SER 131 0.825 -6.935 -2.053 1027 2HB SER 131 2HB SER 131 1.998 -6.359 -0.870 1028 HG SER 131 HG SER 131 0.690 -4.795 -0.345 1029 H VAL 132 H VAL 132 4.717 -5.378 -2.753 1030 HA VAL 132 HA VAL 132 5.071 -8.113 -3.729 1031 HB VAL 132 HB VAL 132 6.907 -7.299 -5.259 1032 1HG1 VAL 132 1HG1 VAL 132 4.443 -6.115 -6.355 1033 2HG1 VAL 132 2HG1 VAL 132 4.296 -7.765 -5.749 1034 3HG1 VAL 132 3HG1 VAL 132 5.479 -7.387 -7.001 1035 1HG2 VAL 132 1HG2 VAL 132 6.589 -4.909 -4.051 1036 2HG2 VAL 132 2HG2 VAL 132 5.598 -4.668 -5.488 1037 3HG2 VAL 132 3HG2 VAL 132 7.298 -5.111 -5.653 1038 H GLY 133 H GLY 133 6.647 -9.167 -2.679 1039 1HA GLY 133 1HA GLY 133 8.960 -7.798 -1.633 1040 2HA GLY 133 2HA GLY 133 7.842 -8.330 -0.386 1041 H TYR 134 H TYR 134 10.239 -9.357 -0.149 1042 HA TYR 134 HA TYR 134 9.899 -12.132 -1.038 1043 1HB TYR 134 1HB TYR 134 12.576 -10.732 -1.007 1044 2HB TYR 134 2HB TYR 134 12.226 -12.354 -1.596 1045 HD1 TYR 134 HD1 TYR 134 9.871 -11.970 -3.260 1046 HD2 TYR 134 HD2 TYR 134 13.305 -9.497 -2.827 1047 HE1 TYR 134 HE1 TYR 134 9.502 -11.072 -5.519 1048 HE2 TYR 134 HE2 TYR 134 12.946 -8.592 -5.086 1049 HH TYR 134 HH TYR 134 10.067 -9.067 -6.819 1050 H GLY 135 H GLY 135 9.681 -13.334 0.724 1051 1HA GLY 135 1HA GLY 135 9.977 -14.165 2.841 1052 2HA GLY 135 2HA GLY 135 11.621 -13.562 2.720 1053 HA PRO 136 HA PRO 136 10.218 -11.006 6.129 1054 1HB PRO 136 1HB PRO 136 12.593 -9.863 6.706 1055 2HB PRO 136 2HB PRO 136 12.223 -11.538 7.136 1056 1HG PRO 136 1HG PRO 136 13.798 -10.480 4.819 1057 2HG PRO 136 2HG PRO 136 14.159 -11.852 5.883 1058 1HD PRO 136 1HD PRO 136 13.066 -12.137 3.407 1059 2HD PRO 136 2HD PRO 136 12.753 -13.267 4.740 1060 H VAL 137 H VAL 137 12.234 -9.748 3.493 1061 HA VAL 137 HA VAL 137 11.532 -7.015 3.982 1062 HB VAL 137 HB VAL 137 12.582 -6.599 1.748 1063 1HG1 VAL 137 1HG1 VAL 137 14.873 -7.656 2.553 1064 2HG1 VAL 137 2HG1 VAL 137 13.944 -7.932 4.025 1065 3HG1 VAL 137 3HG1 VAL 137 14.130 -6.296 3.394 1066 1HG2 VAL 137 1HG2 VAL 137 13.618 -8.348 0.527 1067 2HG2 VAL 137 2HG2 VAL 137 11.964 -8.873 0.848 1068 3HG2 VAL 137 3HG2 VAL 137 13.296 -9.522 1.803 1069 H THR 138 H THR 138 9.943 -5.806 3.110 1070 HA THR 138 HA THR 138 8.323 -6.941 0.947 1071 HB THR 138 HB THR 138 7.109 -5.706 3.421 1072 HG1 THR 138 HG1 THR 138 6.589 -7.789 4.030 1073 1HG2 THR 138 1HG2 THR 138 5.020 -6.591 2.628 1074 2HG2 THR 138 2HG2 THR 138 5.818 -7.303 1.225 1075 3HG2 THR 138 3HG2 THR 138 5.728 -5.550 1.393 1076 H PHE 139 H PHE 139 7.268 -5.428 -0.357 1077 HA PHE 139 HA PHE 139 7.913 -2.605 0.163 1078 1HB PHE 139 1HB PHE 139 8.559 -4.262 -2.219 1079 2HB PHE 139 2HB PHE 139 8.028 -2.610 -2.513 1080 HD1 PHE 139 HD1 PHE 139 10.527 -4.627 -0.661 1081 HD2 PHE 139 HD2 PHE 139 9.508 -0.824 -2.276 1082 HE1 PHE 139 HE1 PHE 139 12.802 -3.819 -0.184 1083 HE2 PHE 139 HE2 PHE 139 11.781 -0.010 -1.803 1084 HZ PHE 139 HZ PHE 139 13.431 -1.508 -0.756 1085 H GLN 140 H GLN 140 6.367 -1.124 -0.408 1086 HA GLN 140 HA GLN 140 3.878 -2.194 -1.565 1087 1HB GLN 140 1HB GLN 140 4.077 -1.477 1.020 1088 2HB GLN 140 2HB GLN 140 3.693 0.090 0.318 1089 1HG GLN 140 1HG GLN 140 1.610 -0.608 -0.423 1090 2HG GLN 140 2HG GLN 140 2.045 -2.315 -0.341 1091 1HE2 GLN 140 1HE2 GLN 140 -0.101 -2.287 0.780 1092 2HE2 GLN 140 2HE2 GLN 140 -0.094 -2.050 2.491 1093 H MET 141 H MET 141 3.320 -1.224 -3.391 1094 HA MET 141 HA MET 141 4.304 1.509 -3.890 1095 1HB MET 141 1HB MET 141 5.167 -0.394 -5.357 1096 2HB MET 141 2HB MET 141 3.539 -0.485 -6.016 1097 1HG MET 141 1HG MET 141 4.752 2.194 -5.995 1098 2HG MET 141 2HG MET 141 5.517 1.014 -7.058 1099 1HE MET 141 1HE MET 141 2.816 -0.026 -9.494 1100 2HE MET 141 2HE MET 141 4.125 -0.590 -8.456 1101 3HE MET 141 3HE MET 141 4.434 0.654 -9.667 1102 H THR 142 H THR 142 2.827 3.054 -4.084 1103 HA THR 142 HA THR 142 0.041 2.260 -4.628 1104 HB THR 142 HB THR 142 -0.582 4.353 -3.387 1105 HG1 THR 142 HG1 THR 142 2.150 4.319 -2.633 1106 1HG2 THR 142 1HG2 THR 142 -0.630 2.189 -2.236 1107 2HG2 THR 142 2HG2 THR 142 -0.200 3.518 -1.159 1108 3HG2 THR 142 3HG2 THR 142 1.050 2.425 -1.755 1109 H TYR 143 H TYR 143 -1.171 3.467 -6.070 1110 HA TYR 143 HA TYR 143 0.379 5.323 -7.752 1111 1HB TYR 143 1HB TYR 143 -0.493 3.133 -8.755 1112 2HB TYR 143 2HB TYR 143 -2.098 3.844 -8.622 1113 HD1 TYR 143 HD1 TYR 143 1.278 4.534 -10.050 1114 HD2 TYR 143 HD2 TYR 143 -2.921 5.142 -10.365 1115 HE1 TYR 143 HE1 TYR 143 1.610 5.667 -12.207 1116 HE2 TYR 143 HE2 TYR 143 -2.601 6.276 -12.523 1117 HH TYR 143 HH TYR 143 -0.167 6.020 -14.393 1118 H ILE 144 H ILE 144 -0.125 7.373 -7.381 1119 HA ILE 144 HA ILE 144 -2.955 8.062 -6.932 1120 HB ILE 144 HB ILE 144 -2.074 10.019 -5.581 1121 1HG1 ILE 144 1HG1 ILE 144 0.337 8.456 -4.894 1122 2HG1 ILE 144 2HG1 ILE 144 0.369 9.230 -6.476 1123 1HG2 ILE 144 1HG2 ILE 144 -3.146 7.949 -4.662 1124 2HG2 ILE 144 2HG2 ILE 144 -2.053 8.776 -3.552 1125 3HG2 ILE 144 3HG2 ILE 144 -1.525 7.313 -4.383 1126 1HD1 ILE 144 1HD1 ILE 144 0.576 11.283 -5.604 1127 2HD1 ILE 144 2HD1 ILE 144 1.151 10.408 -4.183 1128 3HD1 ILE 144 3HD1 ILE 144 -0.528 10.943 -4.270 1129 HA PRO 145 HA PRO 145 -1.762 10.398 -10.662 1130 1HB PRO 145 1HB PRO 145 -4.295 10.777 -11.547 1131 2HB PRO 145 2HB PRO 145 -3.405 9.274 -11.814 1132 1HG PRO 145 1HG PRO 145 -5.467 9.909 -9.739 1133 2HG PRO 145 2HG PRO 145 -5.287 8.446 -10.726 1134 1HD PRO 145 1HD PRO 145 -4.450 8.584 -8.153 1135 2HD PRO 145 2HD PRO 145 -3.632 7.586 -9.372 1136 H GLY 146 H GLY 146 -1.537 12.555 -10.872 1137 1HA GLY 146 1HA GLY 146 -3.466 14.427 -9.884 1138 2HA GLY 146 2HA GLY 146 -2.041 14.348 -8.858 1139 H THR 147 H THR 147 -0.100 15.187 -9.581 1140 HA THR 147 HA THR 147 -0.342 17.078 -11.774 1141 HB THR 147 HB THR 147 2.080 17.625 -10.938 1142 HG1 THR 147 HG1 THR 147 2.438 17.004 -8.823 1143 1HG2 THR 147 1HG2 THR 147 -0.518 18.394 -9.905 1144 2HG2 THR 147 2HG2 THR 147 0.896 19.380 -10.277 1145 3HG2 THR 147 3HG2 THR 147 0.773 18.564 -8.717 1146 H TYR 148 H TYR 148 1.869 17.358 -13.027 1147 HA TYR 148 HA TYR 148 2.438 14.731 -14.207 1148 1HB TYR 148 1HB TYR 148 2.502 17.533 -15.280 1149 2HB TYR 148 2HB TYR 148 3.426 16.261 -16.071 1150 HD1 TYR 148 HD1 TYR 148 1.984 14.029 -16.481 1151 HD2 TYR 148 HD2 TYR 148 0.391 17.954 -16.096 1152 HE1 TYR 148 HE1 TYR 148 -0.029 13.325 -17.706 1153 HE2 TYR 148 HE2 TYR 148 -1.627 17.263 -17.319 1154 HH TYR 148 HH TYR 148 -1.826 14.302 -19.010 1155 H ASN 149 H ASN 149 4.628 14.269 -14.908 1156 HA ASN 149 HA ASN 149 6.814 15.836 -13.923 1157 1HB ASN 149 1HB ASN 149 5.998 14.668 -11.853 1158 2HB ASN 149 2HB ASN 149 6.381 13.136 -12.631 1159 1HD2 ASN 149 1HD2 ASN 149 7.574 15.800 -10.888 1160 2HD2 ASN 149 2HD2 ASN 149 9.239 15.338 -10.863 1161 H ASN 150 H ASN 150 6.161 12.382 -14.550 1162 HA ASN 150 HA ASN 150 7.851 12.514 -16.924 1163 1HB ASN 150 1HB ASN 150 9.029 11.733 -14.621 1164 2HB ASN 150 2HB ASN 150 8.393 10.186 -15.174 1165 1HD2 ASN 150 1HD2 ASN 150 9.181 9.278 -17.063 1166 2HD2 ASN 150 2HD2 ASN 150 10.641 9.822 -17.810 1167 H GLY 151 H GLY 151 5.027 12.203 -16.579 1168 1HA GLY 151 1HA GLY 151 3.563 10.962 -17.961 1169 2HA GLY 151 2HA GLY 151 4.720 9.639 -17.956 1170 H ASN 152 H ASN 152 4.948 9.975 -14.946 1171 HA ASN 152 HA ASN 152 2.444 9.465 -13.771 1172 1HB ASN 152 1HB ASN 152 2.749 7.011 -13.341 1173 2HB ASN 152 2HB ASN 152 2.395 7.414 -15.018 1174 1HD2 ASN 152 1HD2 ASN 152 3.399 5.034 -14.698 1175 2HD2 ASN 152 2HD2 ASN 152 5.067 4.955 -15.139 1176 H VAL 153 H VAL 153 2.585 9.127 -11.533 1177 HA VAL 153 HA VAL 153 5.316 9.282 -10.430 1178 HB VAL 153 HB VAL 153 4.414 10.649 -8.590 1179 1HG1 VAL 153 1HG1 VAL 153 4.753 12.575 -9.715 1180 2HG1 VAL 153 2HG1 VAL 153 3.553 12.192 -10.949 1181 3HG1 VAL 153 3HG1 VAL 153 5.166 11.482 -11.037 1182 1HG2 VAL 153 1HG2 VAL 153 2.207 10.485 -8.240 1183 2HG2 VAL 153 2HG2 VAL 153 1.885 10.003 -9.905 1184 3HG2 VAL 153 3HG2 VAL 153 2.059 11.710 -9.500 1185 H TYR 154 H TYR 154 5.757 7.400 -9.486 1186 HA TYR 154 HA TYR 154 3.619 6.017 -8.015 1187 1HB TYR 154 1HB TYR 154 5.238 4.046 -8.147 1188 2HB TYR 154 2HB TYR 154 4.491 4.556 -9.657 1189 HD1 TYR 154 HD1 TYR 154 5.804 5.361 -11.468 1190 HD2 TYR 154 HD2 TYR 154 7.614 4.646 -7.685 1191 HE1 TYR 154 HE1 TYR 154 8.027 5.604 -12.492 1192 HE2 TYR 154 HE2 TYR 154 9.842 4.887 -8.698 1193 HH TYR 154 HH TYR 154 10.875 5.920 -10.651 1194 H PHE 155 H PHE 155 3.779 5.665 -5.873 1195 HA PHE 155 HA PHE 155 6.182 6.698 -4.526 1196 1HB PHE 155 1HB PHE 155 3.310 6.474 -3.628 1197 2HB PHE 155 2HB PHE 155 4.627 6.803 -2.506 1198 HD1 PHE 155 HD1 PHE 155 2.992 8.077 -5.584 1199 HD2 PHE 155 HD2 PHE 155 5.392 8.975 -2.188 1200 HE1 PHE 155 HE1 PHE 155 2.835 10.474 -6.113 1201 HE2 PHE 155 HE2 PHE 155 5.240 11.375 -2.709 1202 HZ PHE 155 HZ PHE 155 3.959 12.128 -4.674 1203 H ALA 156 H ALA 156 7.529 5.201 -3.801 1204 HA ALA 156 HA ALA 156 6.489 2.538 -3.140 1205 1HB ALA 156 1HB ALA 156 8.729 1.721 -3.421 1206 2HB ALA 156 2HB ALA 156 9.360 3.364 -3.543 1207 3HB ALA 156 3HB ALA 156 8.318 2.723 -4.813 1208 H TRP 157 H TRP 157 6.936 1.541 -1.180 1209 HA TRP 157 HA TRP 157 8.304 3.104 0.878 1210 1HB TRP 157 1HB TRP 157 5.463 2.098 1.069 1211 2HB TRP 157 2HB TRP 157 6.416 2.548 2.479 1212 HD1 TRP 157 HD1 TRP 157 7.652 5.229 1.817 1213 HE1 TRP 157 HE1 TRP 157 6.243 7.314 1.274 1214 HE3 TRP 157 HE3 TRP 157 3.306 2.931 0.411 1215 HZ2 TRP 157 HZ2 TRP 157 3.635 7.906 0.371 1216 HZ3 TRP 157 HZ3 TRP 157 1.402 4.330 -0.278 1217 HH2 TRP 157 HH2 TRP 157 1.564 6.765 -0.296 1218 H MET 158 H MET 158 8.734 1.816 2.848 1219 HA MET 158 HA MET 158 9.172 -1.005 2.138 1220 1HB MET 158 1HB MET 158 11.112 0.661 2.705 1221 2HB MET 158 2HB MET 158 10.623 0.369 4.369 1222 1HG MET 158 1HG MET 158 11.119 -1.960 2.586 1223 2HG MET 158 2HG MET 158 12.493 -1.065 3.232 1224 1HE MET 158 1HE MET 158 13.258 -3.496 4.465 1225 2HE MET 158 2HE MET 158 13.110 -3.150 6.187 1226 3HE MET 158 3HE MET 158 13.661 -1.894 5.081 1227 H ARG 159 H ARG 159 8.665 -2.633 3.588 1228 HA ARG 159 HA ARG 159 7.500 -1.970 6.158 1229 1HB ARG 159 1HB ARG 159 5.447 -3.395 5.569 1230 2HB ARG 159 2HB ARG 159 5.501 -1.748 4.956 1231 1HG ARG 159 1HG ARG 159 5.585 -2.409 2.812 1232 2HG ARG 159 2HG ARG 159 6.643 -3.777 3.166 1233 1HD ARG 159 1HD ARG 159 4.382 -4.427 2.350 1234 2HD ARG 159 2HD ARG 159 4.795 -5.094 3.929 1235 HE ARG 159 HE ARG 159 3.463 -2.824 4.549 1236 1HH1 ARG 159 1HH1 ARG 159 2.719 -5.538 2.484 1237 2HH1 ARG 159 2HH1 ARG 159 1.009 -5.413 2.726 1238 1HH2 ARG 159 1HH2 ARG 159 1.214 -2.659 4.869 1239 2HH2 ARG 159 2HH2 ARG 159 0.154 -3.779 4.080 1240 H PHE 160 H PHE 160 7.305 -3.764 7.559 1241 HA PHE 160 HA PHE 160 8.621 -6.219 6.597 1242 1HB PHE 160 1HB PHE 160 9.431 -4.420 8.697 1243 2HB PHE 160 2HB PHE 160 9.085 -6.009 9.372 1244 HD1 PHE 160 HD1 PHE 160 10.866 -4.497 6.461 1245 HD2 PHE 160 HD2 PHE 160 10.796 -7.531 9.445 1246 HE1 PHE 160 HE1 PHE 160 13.065 -5.296 5.697 1247 HE2 PHE 160 HE2 PHE 160 12.994 -8.335 8.687 1248 HZ PHE 160 HZ PHE 160 14.132 -7.216 6.810 1249 H GLN 161 H GLN 161 7.894 -8.176 7.439 1250 HA GLN 161 HA GLN 161 5.260 -8.030 8.740 1251 1HB GLN 161 1HB GLN 161 5.600 -9.149 6.436 1252 2HB GLN 161 2HB GLN 161 6.353 -10.456 7.341 1253 1HG GLN 161 1HG GLN 161 4.306 -11.309 7.485 1254 2HG GLN 161 2HG GLN 161 4.018 -10.073 8.709 1255 1HE2 GLN 161 1HE2 GLN 161 1.883 -9.758 8.307 1256 2HE2 GLN 161 2HE2 GLN 161 1.269 -9.094 6.835 1257 H PHE 162 H PHE 162 5.065 -8.703 10.768 1258 HA PHE 162 HA PHE 162 7.308 -10.113 12.002 1259 1HB PHE 162 1HB PHE 162 5.598 -8.052 12.866 1260 2HB PHE 162 2HB PHE 162 5.175 -9.458 13.836 1261 HD1 PHE 162 HD1 PHE 162 7.940 -7.218 12.866 1262 HD2 PHE 162 HD2 PHE 162 6.602 -10.243 15.543 1263 HE1 PHE 162 HE1 PHE 162 9.897 -6.807 14.301 1264 HE2 PHE 162 HE2 PHE 162 8.555 -9.837 16.983 1265 HZ PHE 162 HZ PHE 162 10.206 -8.118 16.363 1266 H LEU 163 H LEU 163 7.102 -12.060 13.084 1267 HA LEU 163 HA LEU 163 4.541 -13.405 13.195 1268 1HB LEU 163 1HB LEU 163 6.600 -14.034 11.178 1269 2HB LEU 163 2HB LEU 163 5.952 -15.417 12.040 1270 HG LEU 163 HG LEU 163 4.004 -13.478 10.905 1271 1HD1 LEU 163 1HD1 LEU 163 4.239 -15.130 8.812 1272 2HD1 LEU 163 2HD1 LEU 163 5.927 -15.059 9.316 1273 3HD1 LEU 163 3HD1 LEU 163 5.065 -13.575 8.911 1274 1HD2 LEU 163 1HD2 LEU 163 3.769 -16.397 10.558 1275 2HD2 LEU 163 2HD2 LEU 163 2.564 -15.209 11.059 1276 3HD2 LEU 163 3HD2 LEU 163 3.746 -15.811 12.222 1277 H GLU 164 H GLU 164 4.534 -14.096 15.226 1278 HA GLU 164 HA GLU 164 7.031 -15.021 16.444 1279 1HB GLU 164 1HB GLU 164 4.533 -13.813 17.447 1280 2HB GLU 164 2HB GLU 164 5.211 -15.077 18.465 1281 1HG GLU 164 1HG GLU 164 6.869 -12.787 17.469 1282 2HG GLU 164 2HG GLU 164 5.902 -12.676 18.941 1283 HE2 GLU 164 HE2 GLU 164 9.289 -14.659 19.035 1284 H HIS 165 H HIS 165 7.402 -17.120 16.110 1285 HA HIS 165 HA HIS 165 5.162 -18.999 16.077 1286 1HB HIS 165 1HB HIS 165 7.249 -18.863 14.413 1287 2HB HIS 165 2HB HIS 165 7.958 -19.916 15.632 1288 HD1 HIS 165 HD1 HIS 165 7.948 -21.739 13.681 1289 HD2 HIS 165 HD2 HIS 165 4.217 -20.559 15.078 1290 HE1 HIS 165 HE1 HIS 165 6.341 -23.493 12.868 1291 HE2 HIS 165 HE2 HIS 165 4.077 -22.713 13.653 1292 H HIS 166 H HIS 166 5.943 -21.273 17.015 1293 HA HIS 166 HA HIS 166 7.039 -20.781 19.705 1294 1HB HIS 166 1HB HIS 166 4.416 -21.624 19.033 1295 2HB HIS 166 2HB HIS 166 5.237 -23.012 19.738 1296 HD1 HIS 166 HD1 HIS 166 5.631 -22.988 22.234 1297 HD2 HIS 166 HD2 HIS 166 4.200 -19.366 20.783 1298 HE1 HIS 166 HE1 HIS 166 5.066 -21.624 24.270 1299 HE2 HIS 166 HE2 HIS 166 4.121 -19.470 23.366 1300 H HIS 167 H HIS 167 8.642 -22.093 20.325 1301 HA HIS 167 HA HIS 167 9.562 -24.121 18.473 1302 1HB HIS 167 1HB HIS 167 10.772 -23.298 21.119 1303 2HB HIS 167 2HB HIS 167 11.559 -24.209 19.835 1304 HD1 HIS 167 HD1 HIS 167 10.118 -20.750 20.441 1305 HD2 HIS 167 HD2 HIS 167 12.907 -22.675 18.037 1306 HE1 HIS 167 HE1 HIS 167 11.281 -18.922 19.165 1307 HE2 HIS 167 HE2 HIS 167 13.022 -20.104 17.779 1308 H HIS 168 H HIS 168 9.070 -26.200 18.615 1309 HA HIS 168 HA HIS 168 8.037 -27.226 21.172 1310 1HB HIS 168 1HB HIS 168 6.657 -27.247 18.939 1311 2HB HIS 168 2HB HIS 168 7.647 -28.655 18.568 1312 HD1 HIS 168 HD1 HIS 168 7.695 -29.926 21.402 1313 HD2 HIS 168 HD2 HIS 168 4.289 -28.489 19.505 1314 HE1 HIS 168 HE1 HIS 168 5.768 -31.137 22.472 1315 HE2 HIS 168 HE2 HIS 168 3.726 -30.315 21.248 1316 H HIS 169 H HIS 169 9.680 -28.544 18.290 1317 HA HIS 169 HA HIS 169 11.607 -29.860 20.066 1318 1HB HIS 169 1HB HIS 169 9.635 -31.163 18.315 1319 2HB HIS 169 2HB HIS 169 11.282 -31.755 18.119 1320 HD1 HIS 169 HD1 HIS 169 9.751 -30.686 21.405 1321 HD2 HIS 169 HD2 HIS 169 11.010 -34.134 19.458 1322 HE1 HIS 169 HE1 HIS 169 9.646 -32.509 23.133 1323 HE2 HIS 169 HE2 HIS 169 10.492 -34.568 21.956 1324 H HIS 170 H HIS 170 10.742 -29.175 16.685 1325 HA HIS 170 HA HIS 170 13.436 -28.219 16.193 1326 1HB HIS 170 1HB HIS 170 12.268 -30.555 14.668 1327 2HB HIS 170 2HB HIS 170 13.697 -29.657 14.168 1328 HD1 HIS 170 HD1 HIS 170 12.769 -32.603 15.944 1329 HD2 HIS 170 HD2 HIS 170 15.766 -29.757 16.365 1330 HE1 HIS 170 HE1 HIS 170 14.535 -33.692 17.364 1331 HE2 HIS 170 HE2 HIS 170 16.299 -31.920 17.678 Start of MODEL 14 1 1H MET 1 1H MET 1 -29.607 -6.633 20.778 2 2H MET 1 2H MET 1 -30.047 -6.838 19.132 3 H MET 1 H MET 1 -28.943 -7.805 20.002 4 3H MET 1 3H MET 1 -29.053 -8.001 19.909 5 HA MET 1 HA MET 1 -30.755 -8.781 21.210 6 1HB MET 1 1HB MET 1 -31.560 -6.470 21.761 7 2HB MET 1 2HB MET 1 -32.418 -6.454 20.226 8 1HG MET 1 1HG MET 1 -34.012 -7.014 21.853 9 2HG MET 1 2HG MET 1 -33.626 -8.519 21.020 10 1HE MET 1 1HE MET 1 -34.554 -8.923 24.850 11 2HE MET 1 2HE MET 1 -35.072 -7.804 23.589 12 3HE MET 1 3HE MET 1 -34.012 -7.245 24.883 13 H ASN 2 H ASN 2 -30.287 -10.280 19.455 14 HA ASN 2 HA ASN 2 -32.590 -11.018 18.025 15 1HB ASN 2 1HB ASN 2 -31.316 -8.971 16.732 16 2HB ASN 2 2HB ASN 2 -30.582 -10.378 15.970 17 1HD2 ASN 2 1HD2 ASN 2 -33.445 -8.508 16.372 18 2HD2 ASN 2 2HD2 ASN 2 -34.407 -9.332 15.196 19 H ALA 3 H ALA 3 -32.362 -13.022 16.951 20 HA ALA 3 HA ALA 3 -30.471 -14.766 18.066 21 1HB ALA 3 1HB ALA 3 -32.586 -15.606 17.324 22 2HB ALA 3 2HB ALA 3 -31.319 -16.402 16.389 23 3HB ALA 3 3HB ALA 3 -32.263 -15.098 15.666 24 H ASP 4 H ASP 4 -30.226 -12.652 15.382 25 HA ASP 4 HA ASP 4 -28.213 -14.123 13.962 26 1HB ASP 4 1HB ASP 4 -29.137 -11.250 13.767 27 2HB ASP 4 2HB ASP 4 -27.933 -11.968 12.701 28 HD2 ASP 4 HD2 ASP 4 -31.539 -12.341 11.601 29 H GLU 5 H GLU 5 -28.159 -11.089 15.830 30 HA GLU 5 HA GLU 5 -25.335 -10.913 15.902 31 1HB GLU 5 1HB GLU 5 -27.599 -9.536 17.249 32 2HB GLU 5 2HB GLU 5 -26.017 -9.407 18.007 33 1HG GLU 5 1HG GLU 5 -25.185 -8.686 15.694 34 2HG GLU 5 2HG GLU 5 -26.889 -8.449 15.308 35 HE2 GLU 5 HE2 GLU 5 -25.168 -5.533 17.015 36 H TRP 6 H TRP 6 -27.668 -12.617 17.816 37 HA TRP 6 HA TRP 6 -25.976 -13.024 20.091 38 1HB TRP 6 1HB TRP 6 -28.605 -13.216 19.818 39 2HB TRP 6 2HB TRP 6 -28.216 -14.895 19.456 40 HD1 TRP 6 HD1 TRP 6 -25.735 -14.942 21.653 41 HE1 TRP 6 HE1 TRP 6 -26.380 -15.203 24.131 42 HE3 TRP 6 HE3 TRP 6 -30.618 -13.450 21.383 43 HZ2 TRP 6 HZ2 TRP 6 -28.657 -14.827 25.757 44 HZ3 TRP 6 HZ3 TRP 6 -31.960 -13.430 23.446 45 HH2 TRP 6 HH2 TRP 6 -30.999 -14.105 25.586 46 H MET 7 H MET 7 -26.788 -14.881 17.199 47 HA MET 7 HA MET 7 -25.257 -17.175 17.986 48 1HB MET 7 1HB MET 7 -26.575 -16.336 15.412 49 2HB MET 7 2HB MET 7 -25.594 -17.792 15.519 50 1HG MET 7 1HG MET 7 -27.845 -17.344 17.429 51 2HG MET 7 2HG MET 7 -28.156 -17.951 15.804 52 1HE MET 7 1HE MET 7 -29.305 -19.912 17.590 53 2HE MET 7 2HE MET 7 -28.471 -19.202 18.973 54 3HE MET 7 3HE MET 7 -28.272 -20.916 18.608 55 H THR 8 H THR 8 -24.665 -14.262 16.158 56 HA THR 8 HA THR 8 -22.355 -15.015 14.778 57 HB THR 8 HB THR 8 -21.806 -12.520 14.917 58 HG1 THR 8 HG1 THR 8 -23.275 -11.212 15.863 59 1HG2 THR 8 1HG2 THR 8 -24.322 -13.621 13.772 60 2HG2 THR 8 2HG2 THR 8 -22.882 -13.011 12.957 61 3HG2 THR 8 3HG2 THR 8 -24.018 -11.886 13.703 62 H THR 9 H THR 9 -22.849 -14.173 18.121 63 HA THR 9 HA THR 9 -20.249 -13.505 18.874 64 HB THR 9 HB THR 9 -20.914 -14.110 21.141 65 HG1 THR 9 HG1 THR 9 -23.015 -15.454 19.819 66 1HG2 THR 9 1HG2 THR 9 -23.174 -12.867 19.597 67 2HG2 THR 9 2HG2 THR 9 -21.838 -12.031 20.389 68 3HG2 THR 9 3HG2 THR 9 -23.042 -12.885 21.356 69 H PHE 10 H PHE 10 -21.752 -16.636 18.365 70 HA PHE 10 HA PHE 10 -19.589 -18.145 19.476 71 1HB PHE 10 1HB PHE 10 -22.196 -18.687 18.349 72 2HB PHE 10 2HB PHE 10 -20.999 -19.803 17.703 73 HD1 PHE 10 HD1 PHE 10 -21.988 -18.322 20.983 74 HD2 PHE 10 HD2 PHE 10 -20.653 -21.754 18.851 75 HE1 PHE 10 HE1 PHE 10 -22.125 -19.653 23.048 76 HE2 PHE 10 HE2 PHE 10 -20.788 -23.091 20.911 77 HZ PHE 10 HZ PHE 10 -21.524 -22.041 23.013 78 H ARG 11 H ARG 11 -20.629 -17.323 16.185 79 HA ARG 11 HA ARG 11 -18.635 -18.760 14.824 80 1HB ARG 11 1HB ARG 11 -20.814 -17.408 14.030 81 2HB ARG 11 2HB ARG 11 -19.588 -16.206 13.646 82 1HG ARG 11 1HG ARG 11 -19.079 -17.282 11.784 83 2HG ARG 11 2HG ARG 11 -18.701 -18.742 12.700 84 1HD ARG 11 1HD ARG 11 -20.382 -19.562 11.405 85 2HD ARG 11 2HD ARG 11 -21.347 -18.939 12.743 86 HE ARG 11 HE ARG 11 -20.975 -16.961 10.739 87 1HH1 ARG 11 1HH1 ARG 11 -22.794 -19.849 11.470 88 2HH1 ARG 11 2HH1 ARG 11 -24.131 -19.413 10.461 89 1HH2 ARG 11 1HH2 ARG 11 -22.734 -16.385 9.412 90 2HH2 ARG 11 2HH2 ARG 11 -24.098 -17.447 9.293 91 H GLU 12 H GLU 12 -18.665 -15.545 16.236 92 HA GLU 12 HA GLU 12 -16.252 -14.634 15.062 93 1HB GLU 12 1HB GLU 12 -18.089 -13.734 17.178 94 2HB GLU 12 2HB GLU 12 -16.418 -13.230 17.400 95 1HG GLU 12 1HG GLU 12 -16.972 -11.508 16.102 96 2HG GLU 12 2HG GLU 12 -16.819 -12.656 14.772 97 HE2 GLU 12 HE2 GLU 12 -20.071 -11.944 13.983 98 H ASN 13 H ASN 13 -16.996 -16.335 18.062 99 HA ASN 13 HA ASN 13 -14.439 -16.166 19.227 100 1HB ASN 13 1HB ASN 13 -16.862 -17.834 19.629 101 2HB ASN 13 2HB ASN 13 -15.351 -18.473 20.268 102 1HD2 ASN 13 1HD2 ASN 13 -15.214 -18.070 22.345 103 2HD2 ASN 13 2HD2 ASN 13 -15.650 -16.596 23.132 104 H ILE 14 H ILE 14 -15.924 -18.676 17.198 105 HA ILE 14 HA ILE 14 -13.612 -20.344 17.173 106 HB ILE 14 HB ILE 14 -15.848 -20.337 15.148 107 1HG1 ILE 14 1HG1 ILE 14 -16.819 -20.454 17.377 108 2HG1 ILE 14 2HG1 ILE 14 -16.927 -22.030 16.599 109 1HG2 ILE 14 1HG2 ILE 14 -14.523 -22.823 16.022 110 2HG2 ILE 14 2HG2 ILE 14 -13.549 -21.717 15.054 111 3HG2 ILE 14 3HG2 ILE 14 -15.077 -22.331 14.422 112 1HD1 ILE 14 1HD1 ILE 14 -16.300 -22.324 18.887 113 2HD1 ILE 14 2HD1 ILE 14 -14.962 -21.188 18.712 114 3HD1 ILE 14 3HD1 ILE 14 -14.923 -22.735 17.866 115 H ALA 15 H ALA 15 -14.761 -17.705 15.193 116 HA ALA 15 HA ALA 15 -12.991 -18.166 13.001 117 1HB ALA 15 1HB ALA 15 -13.658 -15.920 12.269 118 2HB ALA 15 2HB ALA 15 -14.478 -15.669 13.810 119 3HB ALA 15 3HB ALA 15 -15.050 -16.914 12.699 120 H GLN 16 H GLN 16 -12.867 -16.212 15.932 121 HA GLN 16 HA GLN 16 -10.480 -14.821 15.247 122 1HB GLN 16 1HB GLN 16 -12.150 -15.144 17.685 123 2HB GLN 16 2HB GLN 16 -10.485 -14.626 17.916 124 1HG GLN 16 1HG GLN 16 -11.092 -12.891 16.052 125 2HG GLN 16 2HG GLN 16 -12.741 -13.224 16.578 126 1HE2 GLN 16 1HE2 GLN 16 -13.256 -12.868 18.817 127 2HE2 GLN 16 2HE2 GLN 16 -12.398 -11.666 19.715 128 H THR 17 H THR 17 -11.185 -17.801 16.980 129 HA THR 17 HA THR 17 -8.567 -18.229 17.977 130 HB THR 17 HB THR 17 -9.518 -20.724 17.903 131 HG1 THR 17 HG1 THR 17 -11.354 -19.912 16.627 132 1HG2 THR 17 1HG2 THR 17 -9.543 -20.322 20.072 133 2HG2 THR 17 2HG2 THR 17 -11.132 -19.581 19.880 134 3HG2 THR 17 3HG2 THR 17 -9.679 -18.586 19.793 135 H TRP 18 H TRP 18 -10.148 -18.959 14.948 136 HA TRP 18 HA TRP 18 -8.028 -20.688 14.025 137 1HB TRP 18 1HB TRP 18 -10.686 -19.903 13.114 138 2HB TRP 18 2HB TRP 18 -9.518 -19.957 11.798 139 HD1 TRP 18 HD1 TRP 18 -11.910 -22.115 13.420 140 HE1 TRP 18 HE1 TRP 18 -11.362 -24.603 13.053 141 HE3 TRP 18 HE3 TRP 18 -7.089 -21.654 11.780 142 HZ2 TRP 18 HZ2 TRP 18 -9.176 -26.163 12.184 143 HZ3 TRP 18 HZ3 TRP 18 -5.840 -23.692 11.203 144 HH2 TRP 18 HH2 TRP 18 -6.863 -25.900 11.401 145 H GLN 19 H GLN 19 -9.074 -17.358 13.507 146 HA GLN 19 HA GLN 19 -7.170 -16.786 11.469 147 1HB GLN 19 1HB GLN 19 -9.087 -15.229 13.115 148 2HB GLN 19 2HB GLN 19 -7.737 -14.341 12.420 149 1HG GLN 19 1HG GLN 19 -9.425 -14.123 10.843 150 2HG GLN 19 2HG GLN 19 -8.412 -15.416 10.202 151 1HE2 GLN 19 1HE2 GLN 19 -11.516 -14.486 10.836 152 2HE2 GLN 19 2HE2 GLN 19 -12.284 -16.034 10.821 153 H GLN 20 H GLN 20 -7.318 -15.911 14.920 154 HA GLN 20 HA GLN 20 -5.701 -15.369 16.424 155 1HB GLN 20 1HB GLN 20 -4.222 -17.145 14.518 156 2HB GLN 20 2HB GLN 20 -3.340 -16.323 15.798 157 1HG GLN 20 1HG GLN 20 -5.755 -17.679 16.717 158 2HG GLN 20 2HG GLN 20 -4.551 -18.757 16.011 159 1HE2 GLN 20 1HE2 GLN 20 -4.963 -16.176 18.386 160 2HE2 GLN 20 2HE2 GLN 20 -3.738 -16.733 19.470 161 HA PRO 21 HA PRO 21 -4.213 -12.010 13.432 162 1HB PRO 21 1HB PRO 21 -5.809 -10.008 14.332 163 2HB PRO 21 2HB PRO 21 -6.288 -11.106 13.032 164 1HG PRO 21 1HG PRO 21 -7.019 -11.174 15.934 165 2HG PRO 21 2HG PRO 21 -8.049 -11.435 14.516 166 1HD PRO 21 1HD PRO 21 -7.060 -13.478 15.992 167 2HD PRO 21 2HD PRO 21 -7.339 -13.612 14.244 168 H GLU 22 H GLU 22 -2.281 -11.496 14.265 169 HA GLU 22 HA GLU 22 -2.075 -9.611 16.387 170 1HB GLU 22 1HB GLU 22 -2.409 -11.897 17.539 171 2HB GLU 22 2HB GLU 22 -0.774 -12.253 16.998 172 1HG GLU 22 1HG GLU 22 -0.711 -11.466 19.260 173 2HG GLU 22 2HG GLU 22 0.030 -10.263 18.205 174 HE2 GLU 22 HE2 GLU 22 -3.057 -9.227 20.354 175 H HIS 23 H HIS 23 -1.245 -9.903 13.641 176 HA HIS 23 HA HIS 23 1.656 -10.196 13.797 177 1HB HIS 23 1HB HIS 23 -0.358 -10.197 11.618 178 2HB HIS 23 2HB HIS 23 1.228 -9.546 11.219 179 HD1 HIS 23 HD1 HIS 23 3.202 -11.197 11.142 180 HD2 HIS 23 HD2 HIS 23 -0.430 -12.958 12.125 181 HE1 HIS 23 HE1 HIS 23 3.585 -13.675 10.957 182 HE2 HIS 23 HE2 HIS 23 1.348 -14.716 11.465 183 H TYR 24 H TYR 24 3.070 -8.542 13.674 184 HA TYR 24 HA TYR 24 1.937 -5.830 13.476 185 1HB TYR 24 1HB TYR 24 3.854 -7.049 15.305 186 2HB TYR 24 2HB TYR 24 4.472 -5.568 14.583 187 HD1 TYR 24 HD1 TYR 24 2.532 -6.908 17.200 188 HD2 TYR 24 HD2 TYR 24 2.823 -3.524 14.637 189 HE1 TYR 24 HE1 TYR 24 1.219 -5.586 18.806 190 HE2 TYR 24 HE2 TYR 24 1.512 -2.193 16.236 191 HH TYR 24 HH TYR 24 0.961 -3.115 19.382 192 H ASP 25 H ASP 25 2.312 -4.905 11.581 193 HA ASP 25 HA ASP 25 4.765 -5.599 10.119 194 1HB ASP 25 1HB ASP 25 2.418 -5.880 9.082 195 2HB ASP 25 2HB ASP 25 2.415 -4.125 8.950 196 HD2 ASP 25 HD2 ASP 25 5.366 -4.588 6.789 197 H LEU 26 H LEU 26 6.271 -4.098 9.651 198 HA LEU 26 HA LEU 26 5.808 -1.384 10.676 199 1HB LEU 26 1HB LEU 26 8.408 -2.790 10.056 200 2HB LEU 26 2HB LEU 26 8.254 -1.181 10.736 201 HG LEU 26 HG LEU 26 6.891 -2.491 12.604 202 1HD1 LEU 26 1HD1 LEU 26 8.382 -4.638 12.939 203 2HD1 LEU 26 2HD1 LEU 26 8.475 -4.564 11.179 204 3HD1 LEU 26 3HD1 LEU 26 6.906 -4.685 11.975 205 1HD2 LEU 26 1HD2 LEU 26 9.762 -1.883 12.244 206 2HD2 LEU 26 2HD2 LEU 26 9.336 -2.932 13.596 207 3HD2 LEU 26 3HD2 LEU 26 8.626 -1.322 13.470 208 H TYR 27 H TYR 27 6.009 0.385 9.398 209 HA TYR 27 HA TYR 27 6.660 -0.086 6.562 210 1HB TYR 27 1HB TYR 27 4.515 1.597 7.827 211 2HB TYR 27 2HB TYR 27 5.114 1.970 6.214 212 HD1 TYR 27 HD1 TYR 27 3.808 1.179 4.498 213 HD2 TYR 27 HD2 TYR 27 4.052 -1.095 8.086 214 HE1 TYR 27 HE1 TYR 27 2.272 -0.486 3.540 215 HE2 TYR 27 HE2 TYR 27 2.518 -2.767 7.137 216 HH TYR 27 HH TYR 27 1.728 -3.542 5.003 217 H ILE 28 H ILE 28 8.413 0.941 5.888 218 HA ILE 28 HA ILE 28 9.039 3.586 6.973 219 HB ILE 28 HB ILE 28 10.374 1.998 8.283 220 1HG1 ILE 28 1HG1 ILE 28 12.224 3.400 6.362 221 2HG1 ILE 28 2HG1 ILE 28 11.229 4.292 7.508 222 1HG2 ILE 28 1HG2 ILE 28 10.463 0.270 6.455 223 2HG2 ILE 28 2HG2 ILE 28 11.971 0.535 7.328 224 3HG2 ILE 28 3HG2 ILE 28 11.748 1.229 5.721 225 1HD1 ILE 28 1HD1 ILE 28 12.782 4.002 9.048 226 2HD1 ILE 28 2HD1 ILE 28 13.745 3.048 7.918 227 3HD1 ILE 28 3HD1 ILE 28 12.551 2.257 8.948 228 HA PRO 29 HA PRO 29 9.604 4.215 2.580 229 1HB PRO 29 1HB PRO 29 10.418 6.796 2.692 230 2HB PRO 29 2HB PRO 29 8.731 6.317 2.920 231 1HG PRO 29 1HG PRO 29 10.809 6.971 4.977 232 2HG PRO 29 2HG PRO 29 9.109 7.473 4.906 233 1HD PRO 29 1HD PRO 29 9.962 5.440 6.477 234 2HD PRO 29 2HD PRO 29 8.350 5.460 5.736 235 H ALA 30 H ALA 30 11.293 3.419 1.510 236 HA ALA 30 HA ALA 30 13.968 3.593 2.580 237 1HB ALA 30 1HB ALA 30 12.631 2.103 0.406 238 2HB ALA 30 2HB ALA 30 13.784 1.551 1.621 239 3HB ALA 30 3HB ALA 30 14.352 2.429 0.201 240 H ILE 31 H ILE 31 15.711 4.665 1.693 241 HA ILE 31 HA ILE 31 15.020 6.869 -0.112 242 HB ILE 31 HB ILE 31 17.241 7.805 0.589 243 1HG1 ILE 31 1HG1 ILE 31 17.261 6.006 2.949 244 2HG1 ILE 31 2HG1 ILE 31 17.833 5.317 1.434 245 1HG2 ILE 31 1HG2 ILE 31 16.455 8.567 2.760 246 2HG2 ILE 31 2HG2 ILE 31 15.286 7.247 2.817 247 3HG2 ILE 31 3HG2 ILE 31 15.125 8.517 1.604 248 1HD1 ILE 31 1HD1 ILE 31 19.657 6.225 2.767 249 2HD1 ILE 31 2HD1 ILE 31 18.894 7.814 2.733 250 3HD1 ILE 31 3HD1 ILE 31 19.485 7.088 1.239 251 H THR 32 H THR 32 16.103 7.250 -2.018 252 HA THR 32 HA THR 32 18.120 5.278 -2.842 253 HB THR 32 HB THR 32 17.072 5.203 -5.094 254 HG1 THR 32 HG1 THR 32 15.083 6.095 -5.412 255 1HG2 THR 32 1HG2 THR 32 14.751 4.380 -3.577 256 2HG2 THR 32 2HG2 THR 32 16.259 3.808 -2.862 257 3HG2 THR 32 3HG2 THR 32 15.877 3.423 -4.540 258 H TRP 33 H TRP 33 19.920 6.289 -3.404 259 HA TRP 33 HA TRP 33 21.380 7.845 -4.188 260 1HB TRP 33 1HB TRP 33 19.515 7.554 -6.154 261 2HB TRP 33 2HB TRP 33 19.413 9.284 -5.847 262 HD1 TRP 33 HD1 TRP 33 22.356 10.113 -5.457 263 HE1 TRP 33 HE1 TRP 33 24.071 9.920 -7.366 264 HE3 TRP 33 HE3 TRP 33 19.980 6.617 -8.336 265 HZ2 TRP 33 HZ2 TRP 33 24.377 8.478 -9.773 266 HZ3 TRP 33 HZ3 TRP 33 21.052 5.886 -10.426 267 HH2 TRP 33 HH2 TRP 33 23.204 6.799 -11.130 268 H HIS 34 H HIS 34 22.026 9.309 -2.759 269 HA HIS 34 HA HIS 34 20.218 11.553 -2.144 270 1HB HIS 34 1HB HIS 34 21.235 11.635 0.111 271 2HB HIS 34 2HB HIS 34 20.398 10.115 -0.193 272 HD1 HIS 34 HD1 HIS 34 21.815 7.977 -0.276 273 HD2 HIS 34 HD2 HIS 34 24.038 11.435 0.336 274 HE1 HIS 34 HE1 HIS 34 24.107 7.193 0.397 275 HE2 HIS 34 HE2 HIS 34 25.459 9.301 0.674 276 H ALA 35 H ALA 35 21.117 13.597 -1.984 277 HA ALA 35 HA ALA 35 22.548 15.299 -2.464 278 1HB ALA 35 1HB ALA 35 24.552 15.225 -1.425 279 2HB ALA 35 2HB ALA 35 24.986 13.670 -2.137 280 3HB ALA 35 3HB ALA 35 23.897 13.733 -0.751 281 H ARG 36 H ARG 36 24.598 15.833 -3.868 282 HA ARG 36 HA ARG 36 24.056 14.710 -6.489 283 1HB ARG 36 1HB ARG 36 25.558 17.087 -5.463 284 2HB ARG 36 2HB ARG 36 25.898 16.492 -7.082 285 1HG ARG 36 1HG ARG 36 23.249 16.599 -7.255 286 2HG ARG 36 2HG ARG 36 23.485 17.834 -6.017 287 1HD ARG 36 1HD ARG 36 24.977 17.796 -8.633 288 2HD ARG 36 2HD ARG 36 23.464 18.669 -8.391 289 HE ARG 36 HE ARG 36 25.443 19.341 -6.440 290 1HH1 ARG 36 1HH1 ARG 36 24.360 19.984 -9.694 291 2HH1 ARG 36 2HH1 ARG 36 25.056 21.568 -9.747 292 1HH2 ARG 36 1HH2 ARG 36 26.360 21.426 -6.507 293 2HH2 ARG 36 2HH2 ARG 36 26.191 22.387 -7.938 294 H PHE 37 H PHE 37 27.141 15.589 -4.943 295 HA PHE 37 HA PHE 37 28.236 12.983 -5.042 296 1HB PHE 37 1HB PHE 37 29.924 13.404 -6.838 297 2HB PHE 37 2HB PHE 37 28.272 13.272 -7.433 298 HD1 PHE 37 HD1 PHE 37 31.131 15.473 -6.957 299 HD2 PHE 37 HD2 PHE 37 27.088 15.232 -8.261 300 HE1 PHE 37 HE1 PHE 37 31.366 17.652 -8.072 301 HE2 PHE 37 HE2 PHE 37 27.315 17.411 -9.380 302 HZ PHE 37 HZ PHE 37 29.457 18.624 -9.288 303 H ALA 38 H ALA 38 29.073 16.424 -5.351 304 HA ALA 38 HA ALA 38 31.327 16.028 -3.525 305 1HB ALA 38 1HB ALA 38 30.711 18.662 -4.780 306 2HB ALA 38 2HB ALA 38 31.372 17.367 -5.778 307 3HB ALA 38 3HB ALA 38 32.270 17.943 -4.374 308 H TYR 39 H TYR 39 31.508 17.079 -1.567 309 HA TYR 39 HA TYR 39 29.038 18.348 -0.583 310 1HB TYR 39 1HB TYR 39 31.087 16.636 0.816 311 2HB TYR 39 2HB TYR 39 29.954 17.647 1.706 312 HD1 TYR 39 HD1 TYR 39 30.500 14.423 0.623 313 HD2 TYR 39 HD2 TYR 39 27.412 17.347 0.762 314 HE1 TYR 39 HE1 TYR 39 28.813 12.639 0.487 315 HE2 TYR 39 HE2 TYR 39 25.717 15.570 0.627 316 HH TYR 39 HH TYR 39 26.477 12.268 1.035 317 H ASP 40 H ASP 40 29.192 20.460 -0.280 318 HA ASP 40 HA ASP 40 31.584 21.918 -0.425 319 1HB ASP 40 1HB ASP 40 28.974 22.582 -0.582 320 2HB ASP 40 2HB ASP 40 29.323 23.140 1.051 321 HD2 ASP 40 HD2 ASP 40 31.357 24.914 -1.870 322 H LYS 41 H LYS 41 32.377 23.420 1.308 323 HA LYS 41 HA LYS 41 33.210 21.926 3.557 324 1HB LYS 41 1HB LYS 41 33.480 24.782 2.702 325 2HB LYS 41 2HB LYS 41 33.930 24.328 4.341 326 1HG LYS 41 1HG LYS 41 35.351 22.500 3.190 327 2HG LYS 41 2HG LYS 41 35.162 23.501 1.749 328 1HD LYS 41 1HD LYS 41 37.007 24.535 2.524 329 2HD LYS 41 2HD LYS 41 35.864 25.372 3.576 330 1HE LYS 41 1HE LYS 41 37.307 24.643 5.169 331 2HE LYS 41 2HE LYS 41 36.284 23.211 5.074 332 1HZ LYS 41 1HZ LYS 41 38.307 22.246 4.847 333 2HZ LYS 41 2HZ LYS 41 39.022 23.604 4.137 334 3HZ LYS 41 3HZ LYS 41 38.028 22.594 3.215 335 H GLU 42 H GLU 42 30.606 24.195 3.027 336 HA GLU 42 HA GLU 42 29.367 23.402 5.506 337 1HB GLU 42 1HB GLU 42 30.625 26.076 5.161 338 2HB GLU 42 2HB GLU 42 29.065 26.012 5.971 339 1HG GLU 42 1HG GLU 42 30.427 24.023 7.237 340 2HG GLU 42 2HG GLU 42 31.708 25.188 6.904 341 HE2 GLU 42 HE2 GLU 42 30.582 27.302 9.354 342 H LYS 43 H LYS 43 29.171 26.134 3.217 343 HA LYS 43 HA LYS 43 26.372 26.234 3.154 344 1HB LYS 43 1HB LYS 43 28.333 27.817 2.190 345 2HB LYS 43 2HB LYS 43 27.820 27.038 0.699 346 1HG LYS 43 1HG LYS 43 26.535 28.969 0.790 347 2HG LYS 43 2HG LYS 43 25.448 27.715 1.390 348 1HD LYS 43 1HD LYS 43 26.072 28.364 3.708 349 2HD LYS 43 2HD LYS 43 27.016 29.696 3.037 350 1HE LYS 43 1HE LYS 43 25.111 30.860 3.322 351 2HE LYS 43 2HE LYS 43 24.648 30.097 1.802 352 1HZ LYS 43 1HZ LYS 43 23.876 28.231 3.509 353 2HZ LYS 43 2HZ LYS 43 22.867 29.500 3.025 354 3HZ LYS 43 3HZ LYS 43 23.689 29.589 4.501 355 H THR 44 H THR 44 24.946 24.869 2.328 356 HA THR 44 HA THR 44 25.759 23.189 0.048 357 HB THR 44 HB THR 44 24.264 21.424 0.957 358 HG1 THR 44 HG1 THR 44 22.905 22.147 2.384 359 1HG2 THR 44 1HG2 THR 44 26.770 21.654 1.571 360 2HG2 THR 44 2HG2 THR 44 25.750 20.521 2.458 361 3HG2 THR 44 3HG2 THR 44 26.152 22.087 3.164 362 H ASP 45 H ASP 45 23.529 22.086 -0.785 363 HA ASP 45 HA ASP 45 21.496 24.186 -1.023 364 1HB ASP 45 1HB ASP 45 22.980 22.848 -3.273 365 2HB ASP 45 2HB ASP 45 21.367 23.514 -3.516 366 HD2 ASP 45 HD2 ASP 45 24.421 25.985 -3.169 367 H ARG 46 H ARG 46 21.505 21.757 0.502 368 HA ARG 46 HA ARG 46 19.133 20.516 -0.664 369 1HB ARG 46 1HB ARG 46 21.402 19.227 -1.103 370 2HB ARG 46 2HB ARG 46 21.157 18.687 0.552 371 1HG ARG 46 1HG ARG 46 19.883 17.072 -0.271 372 2HG ARG 46 2HG ARG 46 18.689 18.314 -0.658 373 1HD ARG 46 1HD ARG 46 20.882 18.010 -2.599 374 2HD ARG 46 2HD ARG 46 19.787 16.635 -2.474 375 HE ARG 46 HE ARG 46 18.445 19.165 -2.723 376 1HH1 ARG 46 1HH1 ARG 46 19.917 16.524 -4.466 377 2HH1 ARG 46 2HH1 ARG 46 19.013 16.811 -5.914 378 1HH2 ARG 46 1HH2 ARG 46 17.255 19.545 -4.628 379 2HH2 ARG 46 2HH2 ARG 46 17.503 18.527 -6.007 380 H TYR 47 H TYR 47 17.852 19.330 0.890 381 HA TYR 47 HA TYR 47 18.319 20.266 3.643 382 1HB TYR 47 1HB TYR 47 16.031 20.446 1.950 383 2HB TYR 47 2HB TYR 47 15.628 19.386 3.295 384 HD1 TYR 47 HD1 TYR 47 14.574 20.445 5.042 385 HD2 TYR 47 HD2 TYR 47 17.521 22.586 2.843 386 HE1 TYR 47 HE1 TYR 47 14.213 22.407 6.480 387 HE2 TYR 47 HE2 TYR 47 17.169 24.554 4.276 388 HH TYR 47 HH TYR 47 14.528 24.868 6.352 389 H ASN 48 H ASN 48 17.954 18.853 5.374 390 HA ASN 48 HA ASN 48 18.478 16.082 4.760 391 1HB ASN 48 1HB ASN 48 18.675 17.827 7.109 392 2HB ASN 48 2HB ASN 48 18.119 16.198 7.488 393 1HD2 ASN 48 1HD2 ASN 48 19.758 15.055 8.202 394 2HD2 ASN 48 2HD2 ASN 48 21.347 15.018 7.527 395 H GLU 49 H GLU 49 17.259 14.355 5.960 396 HA GLU 49 HA GLU 49 14.415 14.752 5.500 397 1HB GLU 49 1HB GLU 49 15.982 12.681 4.875 398 2HB GLU 49 2HB GLU 49 15.481 12.152 6.476 399 1HG GLU 49 1HG GLU 49 13.149 12.303 5.818 400 2HG GLU 49 2HG GLU 49 13.625 12.888 4.223 401 HE2 GLU 49 HE2 GLU 49 14.790 9.155 4.805 402 H ARG 50 H ARG 50 13.361 15.684 7.142 403 HA ARG 50 HA ARG 50 14.126 15.432 9.867 404 1HB ARG 50 1HB ARG 50 11.650 16.511 8.527 405 2HB ARG 50 2HB ARG 50 11.856 16.512 10.273 406 1HG ARG 50 1HG ARG 50 13.911 17.756 8.490 407 2HG ARG 50 2HG ARG 50 12.450 18.633 8.948 408 1HD ARG 50 1HD ARG 50 14.021 19.268 10.556 409 2HD ARG 50 2HD ARG 50 13.065 18.022 11.358 410 HE ARG 50 HE ARG 50 14.957 16.767 11.524 411 1HH1 ARG 50 1HH1 ARG 50 15.418 19.092 8.964 412 2HH1 ARG 50 2HH1 ARG 50 17.071 18.653 8.692 413 1HH2 ARG 50 1HH2 ARG 50 17.132 16.188 11.169 414 2HH2 ARG 50 2HH2 ARG 50 18.044 17.005 9.945 415 HA PRO 51 HA PRO 51 12.171 11.823 11.437 416 1HB PRO 51 1HB PRO 51 10.515 13.563 13.204 417 2HB PRO 51 2HB PRO 51 11.538 12.184 13.621 418 1HG PRO 51 1HG PRO 51 12.346 14.669 14.123 419 2HG PRO 51 2HG PRO 51 13.488 13.438 13.550 420 1HD PRO 51 1HD PRO 51 12.241 15.707 12.067 421 2HD PRO 51 2HD PRO 51 13.865 15.011 11.908 422 H TRP 52 H TRP 52 10.631 10.641 10.506 423 HA TRP 52 HA TRP 52 8.117 11.966 9.731 424 1HB TRP 52 1HB TRP 52 9.951 10.521 8.165 425 2HB TRP 52 2HB TRP 52 8.562 9.459 8.365 426 HD1 TRP 52 HD1 TRP 52 9.503 12.901 6.932 427 HE1 TRP 52 HE1 TRP 52 7.702 13.589 5.227 428 HE3 TRP 52 HE3 TRP 52 6.173 9.097 7.689 429 HZ2 TRP 52 HZ2 TRP 52 5.200 12.644 4.322 430 HZ3 TRP 52 HZ3 TRP 52 4.100 9.063 6.363 431 HH2 TRP 52 HH2 TRP 52 3.625 10.801 4.715 432 H GLY 53 H GLY 53 8.735 10.723 12.321 433 1HA GLY 53 1HA GLY 53 7.713 9.356 13.856 434 2HA GLY 53 2HA GLY 53 6.324 9.389 12.781 435 H GLY 54 H GLY 54 5.701 7.508 11.947 436 1HA GLY 54 1HA GLY 54 7.422 5.546 10.907 437 2HA GLY 54 2HA GLY 54 6.997 5.091 12.551 438 H GLY 55 H GLY 55 6.347 3.767 10.017 439 1HA GLY 55 1HA GLY 55 3.411 4.058 10.010 440 2HA GLY 55 2HA GLY 55 4.360 3.395 8.688 441 H PHE 56 H PHE 56 2.069 2.251 10.122 442 HA PHE 56 HA PHE 56 3.347 -0.271 10.923 443 1HB PHE 56 1HB PHE 56 1.355 1.354 12.438 444 2HB PHE 56 2HB PHE 56 1.230 -0.400 12.519 445 HD1 PHE 56 HD1 PHE 56 2.917 2.508 13.732 446 HD2 PHE 56 HD2 PHE 56 3.255 -1.710 13.285 447 HE1 PHE 56 HE1 PHE 56 4.667 2.469 15.461 448 HE2 PHE 56 HE2 PHE 56 5.005 -1.758 15.014 449 HZ PHE 56 HZ PHE 56 5.713 0.334 16.104 450 H GLY 57 H GLY 57 1.673 -2.092 10.978 451 1HA GLY 57 1HA GLY 57 -0.620 -1.758 9.255 452 2HA GLY 57 2HA GLY 57 0.696 -2.658 8.516 453 H LEU 58 H LEU 58 -2.074 -3.425 9.376 454 HA LEU 58 HA LEU 58 -1.362 -5.593 11.238 455 1HB LEU 58 1HB LEU 58 -3.217 -3.835 11.763 456 2HB LEU 58 2HB LEU 58 -4.183 -4.781 10.647 457 HG LEU 58 HG LEU 58 -3.831 -6.778 12.061 458 1HD1 LEU 58 1HD1 LEU 58 -2.206 -4.835 13.647 459 2HD1 LEU 58 2HD1 LEU 58 -1.827 -6.492 13.175 460 3HD1 LEU 58 3HD1 LEU 58 -3.010 -6.186 14.447 461 1HD2 LEU 58 1HD2 LEU 58 -5.121 -5.841 14.081 462 2HD2 LEU 58 2HD2 LEU 58 -5.854 -5.711 12.484 463 3HD2 LEU 58 3HD2 LEU 58 -5.074 -4.307 13.212 464 H SER 59 H SER 59 -2.296 -7.689 10.858 465 HA SER 59 HA SER 59 -2.749 -8.197 7.995 466 1HB SER 59 1HB SER 59 -0.803 -9.269 9.508 467 2HB SER 59 2HB SER 59 -2.080 -10.445 9.819 468 HG SER 59 HG SER 59 -1.415 -11.254 7.990 469 H ARG 60 H ARG 60 -4.485 -9.393 7.318 470 HA ARG 60 HA ARG 60 -6.275 -10.568 9.290 471 1HB ARG 60 1HB ARG 60 -6.830 -8.087 7.801 472 2HB ARG 60 2HB ARG 60 -8.115 -9.286 7.735 473 1HG ARG 60 1HG ARG 60 -8.130 -9.371 10.195 474 2HG ARG 60 2HG ARG 60 -6.896 -8.108 10.224 475 1HD ARG 60 1HD ARG 60 -8.427 -6.516 9.953 476 2HD ARG 60 2HD ARG 60 -9.106 -7.332 8.546 477 HE ARG 60 HE ARG 60 -9.903 -8.505 11.042 478 1HH1 ARG 60 1HH1 ARG 60 -10.606 -6.003 8.714 479 2HH1 ARG 60 2HH1 ARG 60 -12.273 -5.879 9.165 480 1HH2 ARG 60 1HH2 ARG 60 -12.096 -8.343 11.636 481 2HH2 ARG 60 2HH2 ARG 60 -13.119 -7.207 10.823 482 H TRP 61 H TRP 61 -6.729 -12.532 8.576 483 HA TRP 61 HA TRP 61 -6.530 -13.122 5.729 484 1HB TRP 61 1HB TRP 61 -5.998 -14.563 8.129 485 2HB TRP 61 2HB TRP 61 -7.250 -15.431 7.246 486 HD1 TRP 61 HD1 TRP 61 -3.563 -14.819 7.288 487 HE1 TRP 61 HE1 TRP 61 -2.454 -16.014 5.296 488 HE3 TRP 61 HE3 TRP 61 -7.759 -16.054 4.642 489 HZ2 TRP 61 HZ2 TRP 61 -3.252 -17.309 2.918 490 HZ3 TRP 61 HZ3 TRP 61 -7.500 -17.270 2.519 491 HH2 TRP 61 HH2 TRP 61 -5.293 -17.883 1.676 492 H ASP 62 H ASP 62 -8.206 -13.667 4.441 493 HA ASP 62 HA ASP 62 -10.889 -13.549 5.640 494 1HB ASP 62 1HB ASP 62 -9.801 -12.148 3.481 495 2HB ASP 62 2HB ASP 62 -10.844 -13.360 2.743 496 HD2 ASP 62 HD2 ASP 62 -13.602 -11.514 3.523 497 H GLU 63 H GLU 63 -12.013 -15.361 5.751 498 HA GLU 63 HA GLU 63 -11.118 -17.847 4.901 499 1HB GLU 63 1HB GLU 63 -13.716 -16.764 5.860 500 2HB GLU 63 2HB GLU 63 -13.738 -18.344 5.086 501 1HG GLU 63 1HG GLU 63 -12.428 -19.312 6.729 502 2HG GLU 63 2HG GLU 63 -11.787 -17.763 7.272 503 HE2 GLU 63 HE2 GLU 63 -14.276 -17.440 9.598 504 H LYS 64 H LYS 64 -12.738 -15.386 3.109 505 HA LYS 64 HA LYS 64 -13.548 -17.229 1.002 506 1HB LYS 64 1HB LYS 64 -14.639 -14.886 1.941 507 2HB LYS 64 2HB LYS 64 -13.827 -14.359 0.473 508 1HG LYS 64 1HG LYS 64 -15.267 -15.445 -0.875 509 2HG LYS 64 2HG LYS 64 -15.443 -16.809 0.231 510 1HD LYS 64 1HD LYS 64 -17.542 -15.794 0.271 511 2HD LYS 64 2HD LYS 64 -16.750 -15.166 1.718 512 1HE LYS 64 1HE LYS 64 -17.511 -13.198 0.886 513 2HE LYS 64 2HE LYS 64 -15.997 -13.282 -0.012 514 1HZ LYS 64 1HZ LYS 64 -17.393 -14.483 -1.768 515 2HZ LYS 64 2HZ LYS 64 -17.575 -12.808 -1.622 516 3HZ LYS 64 3HZ LYS 64 -18.735 -13.846 -0.958 517 H GLY 65 H GLY 65 -10.684 -16.691 1.652 518 1HA GLY 65 1HA GLY 65 -8.731 -16.521 0.457 519 2HA GLY 65 2HA GLY 65 -9.710 -16.572 -1.001 520 H ASN 66 H ASN 66 -9.408 -14.235 1.676 521 HA ASN 66 HA ASN 66 -8.638 -12.203 -0.304 522 1HB ASN 66 1HB ASN 66 -11.122 -12.298 0.971 523 2HB ASN 66 2HB ASN 66 -10.216 -11.076 1.858 524 1HD2 ASN 66 1HD2 ASN 66 -12.485 -11.100 -0.192 525 2HD2 ASN 66 2HD2 ASN 66 -12.014 -9.884 -1.326 526 H TRP 67 H TRP 67 -7.441 -10.413 0.549 527 HA TRP 67 HA TRP 67 -6.162 -10.989 3.141 528 1HB TRP 67 1HB TRP 67 -4.997 -10.509 0.491 529 2HB TRP 67 2HB TRP 67 -4.293 -9.515 1.762 530 HD1 TRP 67 HD1 TRP 67 -5.473 -13.063 2.548 531 HE1 TRP 67 HE1 TRP 67 -3.419 -14.515 3.093 532 HE3 TRP 67 HE3 TRP 67 -1.783 -9.751 1.302 533 HZ2 TRP 67 HZ2 TRP 67 -0.606 -14.286 3.008 534 HZ3 TRP 67 HZ3 TRP 67 0.563 -10.445 1.565 535 HH2 TRP 67 HH2 TRP 67 1.138 -12.666 2.400 536 H HIS 68 H HIS 68 -6.679 -9.505 4.593 537 HA HIS 68 HA HIS 68 -7.181 -6.749 3.683 538 1HB HIS 68 1HB HIS 68 -8.297 -8.369 5.954 539 2HB HIS 68 2HB HIS 68 -8.321 -6.609 6.019 540 HD1 HIS 68 HD1 HIS 68 -10.407 -9.302 5.099 541 HD2 HIS 68 HD2 HIS 68 -9.585 -5.590 3.424 542 HE1 HIS 68 HE1 HIS 68 -12.341 -8.812 3.570 543 HE2 HIS 68 HE2 HIS 68 -11.775 -6.603 2.496 544 H GLY 69 H GLY 69 -5.948 -5.124 4.426 545 1HA GLY 69 1HA GLY 69 -4.212 -5.630 6.748 546 2HA GLY 69 2HA GLY 69 -3.500 -5.066 5.245 547 H LEU 70 H LEU 70 -4.241 -4.023 8.166 548 HA LEU 70 HA LEU 70 -5.563 -1.538 7.470 549 1HB LEU 70 1HB LEU 70 -4.437 -2.541 10.084 550 2HB LEU 70 2HB LEU 70 -5.297 -1.025 9.890 551 HG LEU 70 HG LEU 70 -6.512 -3.719 9.284 552 1HD1 LEU 70 1HD1 LEU 70 -6.350 -3.949 11.534 553 2HD1 LEU 70 2HD1 LEU 70 -7.803 -2.950 11.480 554 3HD1 LEU 70 3HD1 LEU 70 -6.238 -2.211 11.816 555 1HD2 LEU 70 1HD2 LEU 70 -8.142 -1.354 9.955 556 2HD2 LEU 70 2HD2 LEU 70 -8.426 -2.636 8.777 557 3HD2 LEU 70 3HD2 LEU 70 -7.321 -1.316 8.395 558 H TYR 71 H TYR 71 -4.645 0.545 7.847 559 HA TYR 71 HA TYR 71 -1.701 0.592 7.833 560 1HB TYR 71 1HB TYR 71 -3.514 2.363 6.179 561 2HB TYR 71 2HB TYR 71 -1.753 2.405 6.198 562 HD1 TYR 71 HD1 TYR 71 -0.463 0.812 4.957 563 HD2 TYR 71 HD2 TYR 71 -4.699 0.461 5.144 564 HE1 TYR 71 HE1 TYR 71 -0.400 -0.837 3.135 565 HE2 TYR 71 HE2 TYR 71 -4.648 -1.192 3.323 566 HH TYR 71 HH TYR 71 -1.852 -1.762 1.437 567 H ALA 72 H ALA 72 -0.953 1.657 9.531 568 HA ALA 72 HA ALA 72 -2.424 4.021 10.480 569 1HB ALA 72 1HB ALA 72 -3.004 2.535 12.146 570 2HB ALA 72 2HB ALA 72 -1.545 3.267 12.812 571 3HB ALA 72 3HB ALA 72 -1.467 1.673 12.059 572 H MET 73 H MET 73 -1.142 5.694 10.046 573 HA MET 73 HA MET 73 1.747 5.414 10.558 574 1HB MET 73 1HB MET 73 0.635 6.049 8.190 575 2HB MET 73 2HB MET 73 0.769 7.658 8.885 576 1HG MET 73 1HG MET 73 2.824 7.648 8.032 577 2HG MET 73 2HG MET 73 3.232 6.627 9.409 578 1HE MET 73 1HE MET 73 3.163 5.532 5.018 579 2HE MET 73 2HE MET 73 3.984 6.889 5.788 580 3HE MET 73 3HE MET 73 2.222 6.841 5.733 581 H ALA 74 H ALA 74 2.842 7.444 11.222 582 HA ALA 74 HA ALA 74 1.153 9.365 12.622 583 1HB ALA 74 1HB ALA 74 2.075 9.039 14.752 584 2HB ALA 74 2HB ALA 74 3.383 8.034 14.129 585 3HB ALA 74 3HB ALA 74 1.733 7.412 14.164 586 H PHE 75 H PHE 75 2.024 11.379 12.722 587 HA PHE 75 HA PHE 75 4.834 11.692 11.909 588 1HB PHE 75 1HB PHE 75 3.202 12.157 10.033 589 2HB PHE 75 2HB PHE 75 2.606 13.510 10.987 590 HD1 PHE 75 HD1 PHE 75 3.548 15.590 10.693 591 HD2 PHE 75 HD2 PHE 75 5.780 12.132 9.608 592 HE1 PHE 75 HE1 PHE 75 5.314 17.026 9.761 593 HE2 PHE 75 HE2 PHE 75 7.551 13.563 8.676 594 HZ PHE 75 HZ PHE 75 7.319 16.014 8.753 595 H LYS 76 H LYS 76 5.876 13.601 12.659 596 HA LYS 76 HA LYS 76 4.714 14.603 15.153 597 1HB LYS 76 1HB LYS 76 7.069 13.568 14.974 598 2HB LYS 76 2HB LYS 76 7.533 15.086 14.218 599 1HG LYS 76 1HG LYS 76 6.463 16.158 16.331 600 2HG LYS 76 2HG LYS 76 6.689 14.553 17.028 601 1HD LYS 76 1HD LYS 76 8.932 14.773 17.129 602 2HD LYS 76 2HD LYS 76 9.018 15.635 15.590 603 1HE LYS 76 1HE LYS 76 9.711 17.090 17.397 604 2HE LYS 76 2HE LYS 76 8.196 17.666 16.704 605 1HZ LYS 76 1HZ LYS 76 7.138 16.291 18.590 606 2HZ LYS 76 2HZ LYS 76 7.814 17.797 18.960 607 3HZ LYS 76 3HZ LYS 76 8.666 16.378 19.311 608 H ASP 77 H ASP 77 3.443 16.319 14.735 609 HA ASP 77 HA ASP 77 3.815 18.173 12.659 610 1HB ASP 77 1HB ASP 77 2.123 18.005 15.090 611 2HB ASP 77 2HB ASP 77 2.354 19.612 14.406 612 HD2 ASP 77 HD2 ASP 77 0.883 17.300 11.610 613 H SER 78 H SER 78 4.374 20.435 12.809 614 HA SER 78 HA SER 78 6.823 20.847 14.195 615 1HB SER 78 1HB SER 78 6.249 21.868 11.979 616 2HB SER 78 2HB SER 78 5.113 22.927 12.814 617 HG SER 78 HG SER 78 6.959 23.631 14.085 618 H TRP 79 H TRP 79 3.494 21.666 14.832 619 HA TRP 79 HA TRP 79 3.845 23.699 16.718 620 1HB TRP 79 1HB TRP 79 1.692 22.193 15.695 621 2HB TRP 79 2HB TRP 79 1.630 22.002 17.445 622 HD1 TRP 79 HD1 TRP 79 1.961 24.946 14.925 623 HE1 TRP 79 HE1 TRP 79 0.606 26.929 15.853 624 HE3 TRP 79 HE3 TRP 79 0.400 22.873 19.330 625 HZ2 TRP 79 HZ2 TRP 79 -0.922 27.533 18.148 626 HZ3 TRP 79 HZ3 TRP 79 -1.005 24.220 20.836 627 HH2 TRP 79 HH2 TRP 79 -1.651 26.503 20.255 628 H ASN 80 H ASN 80 3.030 20.308 17.475 629 HA ASN 80 HA ASN 80 5.102 19.910 19.323 630 1HB ASN 80 1HB ASN 80 3.469 21.689 20.428 631 2HB ASN 80 2HB ASN 80 2.550 20.244 20.837 632 1HD2 ASN 80 1HD2 ASN 80 3.004 19.409 22.730 633 2HD2 ASN 80 2HD2 ASN 80 4.511 19.524 23.566 634 H LYS 81 H LYS 81 1.609 19.190 19.425 635 HA LYS 81 HA LYS 81 1.919 16.482 20.066 636 1HB LYS 81 1HB LYS 81 -0.352 17.992 18.777 637 2HB LYS 81 2HB LYS 81 -0.463 16.287 19.192 638 1HG LYS 81 1HG LYS 81 -0.002 16.858 21.545 639 2HG LYS 81 2HG LYS 81 0.011 18.566 21.101 640 1HD LYS 81 1HD LYS 81 -2.154 18.139 21.940 641 2HD LYS 81 2HD LYS 81 -2.325 18.200 20.185 642 1HE LYS 81 1HE LYS 81 -3.569 16.326 20.811 643 2HE LYS 81 2HE LYS 81 -2.036 15.658 20.256 644 1HZ LYS 81 1HZ LYS 81 -3.095 15.851 22.990 645 2HZ LYS 81 2HZ LYS 81 -1.420 15.849 22.758 646 3HZ LYS 81 3HZ LYS 81 -2.349 14.543 22.217 647 H TRP 82 H TRP 82 0.818 14.762 18.529 648 HA TRP 82 HA TRP 82 2.219 14.942 15.944 649 1HB TRP 82 1HB TRP 82 1.457 12.419 17.426 650 2HB TRP 82 2HB TRP 82 2.474 12.544 15.994 651 HD1 TRP 82 HD1 TRP 82 2.639 14.213 19.509 652 HE1 TRP 82 HE1 TRP 82 5.056 13.993 20.365 653 HE3 TRP 82 HE3 TRP 82 4.673 11.685 15.558 654 HZ2 TRP 82 HZ2 TRP 82 7.502 12.893 19.483 655 HZ3 TRP 82 HZ3 TRP 82 7.058 11.087 15.642 656 HH2 TRP 82 HH2 TRP 82 8.442 11.679 17.565 657 H GLU 83 H GLU 83 1.184 14.205 14.075 658 HA GLU 83 HA GLU 83 -1.712 14.359 14.196 659 1HB GLU 83 1HB GLU 83 0.356 14.681 12.112 660 2HB GLU 83 2HB GLU 83 -1.169 13.998 11.564 661 1HG GLU 83 1HG GLU 83 -2.061 16.077 13.036 662 2HG GLU 83 2HG GLU 83 -0.523 16.719 12.458 663 HE2 GLU 83 HE2 GLU 83 -2.367 17.609 9.678 664 HA PRO 84 HA PRO 84 -1.961 9.892 14.002 665 1HB PRO 84 1HB PRO 84 -4.621 9.662 14.211 666 2HB PRO 84 2HB PRO 84 -3.628 10.166 15.585 667 1HG PRO 84 1HG PRO 84 -5.282 11.832 13.729 668 2HG PRO 84 2HG PRO 84 -5.108 11.954 15.489 669 1HD PRO 84 1HD PRO 84 -3.767 13.544 13.690 670 2HD PRO 84 2HD PRO 84 -3.192 13.192 15.330 671 H ILE 85 H ILE 85 -2.493 8.327 12.487 672 HA ILE 85 HA ILE 85 -3.978 9.145 10.103 673 HB ILE 85 HB ILE 85 -1.296 7.783 9.885 674 1HG1 ILE 85 1HG1 ILE 85 -2.005 10.688 9.413 675 2HG1 ILE 85 2HG1 ILE 85 -0.989 10.070 10.712 676 1HG2 ILE 85 1HG2 ILE 85 -1.524 8.316 7.503 677 2HG2 ILE 85 2HG2 ILE 85 -3.113 9.014 7.818 678 3HG2 ILE 85 3HG2 ILE 85 -2.840 7.290 8.075 679 1HD1 ILE 85 1HD1 ILE 85 0.809 9.988 9.403 680 2HD1 ILE 85 2HD1 ILE 85 -0.112 11.013 8.303 681 3HD1 ILE 85 3HD1 ILE 85 -0.085 9.265 8.065 682 H ALA 86 H ALA 86 -5.516 7.679 9.816 683 HA ALA 86 HA ALA 86 -4.884 4.851 10.362 684 1HB ALA 86 1HB ALA 86 -7.577 6.131 10.797 685 2HB ALA 86 2HB ALA 86 -6.387 5.877 12.073 686 3HB ALA 86 3HB ALA 86 -7.082 4.494 11.229 687 H GLY 87 H GLY 87 -6.127 3.295 9.121 688 1HA GLY 87 1HA GLY 87 -7.837 3.949 7.004 689 2HA GLY 87 2HA GLY 87 -6.198 3.914 6.372 690 H TYR 88 H TYR 88 -8.176 2.181 5.469 691 HA TYR 88 HA TYR 88 -6.990 -0.377 6.236 692 1HB TYR 88 1HB TYR 88 -9.233 -1.445 6.339 693 2HB TYR 88 2HB TYR 88 -8.975 -0.265 7.621 694 HD1 TYR 88 HD1 TYR 88 -10.774 -0.958 4.490 695 HD2 TYR 88 HD2 TYR 88 -10.273 1.758 7.727 696 HE1 TYR 88 HE1 TYR 88 -12.842 0.199 3.832 697 HE2 TYR 88 HE2 TYR 88 -12.339 2.922 7.078 698 HH TYR 88 HH TYR 88 -13.728 2.754 4.227 699 H GLY 89 H GLY 89 -6.651 -1.698 4.540 700 1HA GLY 89 1HA GLY 89 -8.099 -1.148 2.036 701 2HA GLY 89 2HA GLY 89 -6.343 -1.204 2.030 702 H TRP 90 H TRP 90 -7.647 -2.862 0.362 703 HA TRP 90 HA TRP 90 -7.205 -5.489 1.605 704 1HB TRP 90 1HB TRP 90 -9.077 -6.419 0.325 705 2HB TRP 90 2HB TRP 90 -9.625 -5.135 1.397 706 HD1 TRP 90 HD1 TRP 90 -9.211 -5.979 -2.301 707 HE1 TRP 90 HE1 TRP 90 -10.493 -4.238 -3.697 708 HE3 TRP 90 HE3 TRP 90 -10.431 -2.692 1.420 709 HZ2 TRP 90 HZ2 TRP 90 -11.845 -1.795 -3.277 710 HZ3 TRP 90 HZ3 TRP 90 -11.720 -0.678 0.838 711 HH2 TRP 90 HH2 TRP 90 -12.411 -0.240 -1.462 712 H GLU 91 H GLU 91 -6.367 -7.098 0.240 713 HA GLU 91 HA GLU 91 -5.657 -6.337 -2.486 714 1HB GLU 91 1HB GLU 91 -3.742 -6.729 -0.247 715 2HB GLU 91 2HB GLU 91 -3.300 -7.410 -1.806 716 1HG GLU 91 1HG GLU 91 -3.343 -5.289 -2.850 717 2HG GLU 91 2HG GLU 91 -4.123 -4.543 -1.455 718 HE2 GLU 91 HE2 GLU 91 -1.034 -4.654 0.327 719 H SER 92 H SER 92 -5.076 -8.112 -3.829 720 HA SER 92 HA SER 92 -6.106 -10.671 -2.823 721 1HB SER 92 1HB SER 92 -5.849 -9.562 -5.622 722 2HB SER 92 2HB SER 92 -6.277 -11.240 -5.288 723 HG SER 92 HG SER 92 -8.035 -10.335 -3.992 724 H THR 93 H THR 93 -4.841 -12.425 -2.683 725 HA THR 93 HA THR 93 -2.013 -12.132 -3.105 726 HB THR 93 HB THR 93 -2.229 -14.717 -2.456 727 HG1 THR 93 HG1 THR 93 -4.052 -14.985 -1.120 728 1HG2 THR 93 1HG2 THR 93 -1.467 -14.100 -0.465 729 2HG2 THR 93 2HG2 THR 93 -2.908 -13.148 -0.110 730 3HG2 THR 93 3HG2 THR 93 -1.599 -12.445 -1.061 731 H TRP 94 H TRP 94 -0.788 -12.924 -4.718 732 HA TRP 94 HA TRP 94 -1.832 -14.925 -6.539 733 1HB TRP 94 1HB TRP 94 -2.356 -12.353 -7.214 734 2HB TRP 94 2HB TRP 94 -0.772 -12.554 -7.955 735 HD1 TRP 94 HD1 TRP 94 -0.711 -15.103 -9.428 736 HE1 TRP 94 HE1 TRP 94 -2.432 -15.803 -11.208 737 HE3 TRP 94 HE3 TRP 94 -4.582 -12.056 -8.059 738 HZ2 TRP 94 HZ2 TRP 94 -5.080 -15.152 -11.936 739 HZ3 TRP 94 HZ3 TRP 94 -6.674 -12.156 -9.350 740 HH2 TRP 94 HH2 TRP 94 -6.916 -13.672 -11.248 741 H ARG 95 H ARG 95 -0.247 -16.120 -7.489 742 HA ARG 95 HA ARG 95 2.531 -15.268 -6.995 743 1HB ARG 95 1HB ARG 95 1.592 -18.132 -7.107 744 2HB ARG 95 2HB ARG 95 3.155 -17.531 -6.569 745 1HG ARG 95 1HG ARG 95 2.341 -16.831 -4.537 746 2HG ARG 95 2HG ARG 95 0.687 -16.671 -5.134 747 1HD ARG 95 1HD ARG 95 1.877 -19.383 -5.160 748 2HD ARG 95 2HD ARG 95 1.485 -18.697 -3.584 749 HE ARG 95 HE ARG 95 -0.346 -19.734 -5.470 750 1HH1 ARG 95 1HH1 ARG 95 0.022 -17.138 -3.168 751 2HH1 ARG 95 2HH1 ARG 95 -1.679 -16.978 -2.886 752 1HH2 ARG 95 1HH2 ARG 95 -2.584 -19.526 -5.101 753 2HH2 ARG 95 2HH2 ARG 95 -3.159 -18.335 -3.983 754 HA PRO 96 HA PRO 96 2.340 -15.362 -11.548 755 1HB PRO 96 1HB PRO 96 5.150 -14.495 -11.114 756 2HB PRO 96 2HB PRO 96 3.904 -13.795 -12.152 757 1HG PRO 96 1HG PRO 96 4.604 -12.606 -9.873 758 2HG PRO 96 2HG PRO 96 2.912 -12.639 -10.404 759 1HD PRO 96 1HD PRO 96 4.274 -14.271 -8.302 760 2HD PRO 96 2HD PRO 96 2.638 -13.580 -8.310 761 H LEU 97 H LEU 97 5.151 -16.441 -9.640 762 HA LEU 97 HA LEU 97 5.227 -18.881 -11.268 763 1HB LEU 97 1HB LEU 97 7.355 -16.859 -10.928 764 2HB LEU 97 2HB LEU 97 7.863 -18.530 -10.779 765 HG LEU 97 HG LEU 97 6.190 -17.909 -13.135 766 1HD1 LEU 97 1HD1 LEU 97 8.742 -16.533 -12.572 767 2HD1 LEU 97 2HD1 LEU 97 7.391 -16.053 -13.599 768 3HD1 LEU 97 3HD1 LEU 97 8.562 -17.236 -14.179 769 1HD2 LEU 97 1HD2 LEU 97 8.803 -19.258 -13.337 770 2HD2 LEU 97 2HD2 LEU 97 7.236 -19.703 -14.013 771 3HD2 LEU 97 3HD2 LEU 97 7.598 -20.055 -12.324 772 H ALA 98 H ALA 98 7.060 -20.365 -10.175 773 HA ALA 98 HA ALA 98 6.791 -20.236 -7.259 774 1HB ALA 98 1HB ALA 98 6.046 -22.603 -8.967 775 2HB ALA 98 2HB ALA 98 4.997 -21.681 -7.890 776 3HB ALA 98 3HB ALA 98 6.285 -22.684 -7.222 777 H ASP 99 H ASP 99 9.045 -19.574 -8.760 778 HA ASP 99 HA ASP 99 10.832 -21.880 -8.376 779 1HB ASP 99 1HB ASP 99 10.575 -20.378 -10.603 780 2HB ASP 99 2HB ASP 99 11.831 -19.465 -9.773 781 HD2 ASP 99 HD2 ASP 99 13.261 -22.204 -11.781 782 H GLU 100 H GLU 100 10.710 -18.350 -7.915 783 HA GLU 100 HA GLU 100 12.668 -18.655 -5.737 784 1HB GLU 100 1HB GLU 100 12.940 -17.079 -7.902 785 2HB GLU 100 2HB GLU 100 12.100 -15.962 -6.835 786 1HG GLU 100 1HG GLU 100 13.868 -15.729 -5.463 787 2HG GLU 100 2HG GLU 100 14.374 -17.406 -5.649 788 HE2 GLU 100 HE2 GLU 100 16.821 -16.420 -7.814 789 H ASN 101 H ASN 101 9.740 -19.040 -5.585 790 HA ASN 101 HA ASN 101 7.995 -18.528 -4.218 791 1HB ASN 101 1HB ASN 101 10.404 -17.684 -2.690 792 2HB ASN 101 2HB ASN 101 8.839 -17.146 -2.086 793 1HD2 ASN 101 1HD2 ASN 101 11.086 -19.482 -1.811 794 2HD2 ASN 101 2HD2 ASN 101 10.103 -20.784 -1.245 795 H PHE 102 H PHE 102 8.654 -16.681 -6.370 796 HA PHE 102 HA PHE 102 8.458 -13.997 -5.616 797 1HB PHE 102 1HB PHE 102 8.067 -15.551 -8.088 798 2HB PHE 102 2HB PHE 102 7.172 -14.037 -8.026 799 HD1 PHE 102 HD1 PHE 102 8.442 -11.904 -7.587 800 HD2 PHE 102 HD2 PHE 102 10.363 -15.580 -8.535 801 HE1 PHE 102 HE1 PHE 102 10.475 -10.672 -8.221 802 HE2 PHE 102 HE2 PHE 102 12.401 -14.356 -9.170 803 HZ PHE 102 HZ PHE 102 12.458 -11.899 -9.014 804 H HIS 103 H HIS 103 6.863 -12.830 -4.778 805 HA HIS 103 HA HIS 103 4.128 -13.924 -4.888 806 1HB HIS 103 1HB HIS 103 5.630 -12.513 -2.713 807 2HB HIS 103 2HB HIS 103 3.876 -12.374 -2.783 808 HD1 HIS 103 HD1 HIS 103 3.227 -15.296 -3.610 809 HD2 HIS 103 HD2 HIS 103 5.873 -14.220 -0.592 810 HE1 HIS 103 HE1 HIS 103 3.349 -17.288 -2.081 811 HE2 HIS 103 HE2 HIS 103 4.887 -16.580 -0.214 812 H LEU 104 H LEU 104 2.386 -12.431 -5.076 813 HA LEU 104 HA LEU 104 3.027 -9.682 -5.787 814 1HB LEU 104 1HB LEU 104 3.223 -10.921 -7.897 815 2HB LEU 104 2HB LEU 104 1.601 -11.550 -7.681 816 HG LEU 104 HG LEU 104 1.951 -8.592 -7.727 817 1HD1 LEU 104 1HD1 LEU 104 3.202 -8.910 -9.627 818 2HD1 LEU 104 2HD1 LEU 104 1.570 -8.888 -10.296 819 3HD1 LEU 104 3HD1 LEU 104 2.396 -10.424 -10.037 820 1HD2 LEU 104 1HD2 LEU 104 -0.213 -8.890 -9.051 821 2HD2 LEU 104 2HD2 LEU 104 -0.249 -9.297 -7.335 822 3HD2 LEU 104 3HD2 LEU 104 -0.148 -10.578 -8.544 823 H GLY 105 H GLY 105 1.343 -8.257 -5.482 824 1HA GLY 105 1HA GLY 105 -1.273 -9.373 -4.751 825 2HA GLY 105 2HA GLY 105 -0.444 -8.345 -3.594 826 H LEU 106 H LEU 106 -2.980 -8.161 -5.345 827 HA LEU 106 HA LEU 106 -2.489 -5.387 -6.180 828 1HB LEU 106 1HB LEU 106 -2.744 -7.357 -8.008 829 2HB LEU 106 2HB LEU 106 -4.432 -6.938 -7.782 830 HG LEU 106 HG LEU 106 -3.565 -5.706 -9.655 831 1HD1 LEU 106 1HD1 LEU 106 -5.035 -4.612 -7.771 832 2HD1 LEU 106 2HD1 LEU 106 -4.414 -3.653 -9.114 833 3HD1 LEU 106 3HD1 LEU 106 -3.605 -3.606 -7.547 834 1HD2 LEU 106 1HD2 LEU 106 -1.750 -3.903 -8.940 835 2HD2 LEU 106 2HD2 LEU 106 -1.303 -5.505 -9.528 836 3HD2 LEU 106 3HD2 LEU 106 -1.317 -5.173 -7.795 837 H GLY 107 H GLY 107 -4.050 -3.955 -5.628 838 1HA GLY 107 1HA GLY 107 -6.758 -4.458 -5.259 839 2HA GLY 107 2HA GLY 107 -5.988 -4.716 -3.702 840 H PHE 108 H PHE 108 -7.478 -2.914 -3.130 841 HA PHE 108 HA PHE 108 -6.162 -0.331 -3.653 842 1HB PHE 108 1HB PHE 108 -9.130 -0.712 -3.232 843 2HB PHE 108 2HB PHE 108 -8.301 0.782 -3.657 844 HD1 PHE 108 HD1 PHE 108 -9.228 -2.573 -4.889 845 HD2 PHE 108 HD2 PHE 108 -7.813 1.310 -5.898 846 HE1 PHE 108 HE1 PHE 108 -9.557 -3.078 -7.275 847 HE2 PHE 108 HE2 PHE 108 -8.140 0.813 -8.286 848 HZ PHE 108 HZ PHE 108 -9.012 -1.383 -8.976 849 H THR 109 H THR 109 -6.457 1.275 -1.944 850 HA THR 109 HA THR 109 -7.035 0.105 0.688 851 HB THR 109 HB THR 109 -5.072 1.039 1.659 852 HG1 THR 109 HG1 THR 109 -4.781 2.371 -0.815 853 1HG2 THR 109 1HG2 THR 109 -4.128 -0.033 -0.984 854 2HG2 THR 109 2HG2 THR 109 -4.693 -1.044 0.346 855 3HG2 THR 109 3HG2 THR 109 -3.264 -0.032 0.553 856 H ALA 110 H ALA 110 -7.841 1.523 2.239 857 HA ALA 110 HA ALA 110 -8.738 4.118 1.171 858 1HB ALA 110 1HB ALA 110 -10.732 3.152 1.625 859 2HB ALA 110 2HB ALA 110 -10.389 3.743 3.250 860 3HB ALA 110 3HB ALA 110 -10.054 2.062 2.834 861 H GLY 111 H GLY 111 -7.612 5.776 1.944 862 1HA GLY 111 1HA GLY 111 -6.445 5.567 4.636 863 2HA GLY 111 2HA GLY 111 -5.912 6.669 3.376 864 H VAL 112 H VAL 112 -7.315 6.631 6.275 865 HA VAL 112 HA VAL 112 -9.059 8.933 5.680 866 HB VAL 112 HB VAL 112 -10.186 8.428 7.852 867 1HG1 VAL 112 1HG1 VAL 112 -10.265 6.684 5.461 868 2HG1 VAL 112 2HG1 VAL 112 -11.521 7.701 6.167 869 3HG1 VAL 112 3HG1 VAL 112 -11.145 6.135 6.887 870 1HG2 VAL 112 1HG2 VAL 112 -9.875 6.253 8.881 871 2HG2 VAL 112 2HG2 VAL 112 -8.349 7.136 8.857 872 3HG2 VAL 112 3HG2 VAL 112 -8.637 5.843 7.692 873 H THR 113 H THR 113 -8.577 10.842 6.574 874 HA THR 113 HA THR 113 -6.718 10.921 8.844 875 HB THR 113 HB THR 113 -5.666 12.960 7.708 876 HG1 THR 113 HG1 THR 113 -6.027 13.266 5.616 877 1HG2 THR 113 1HG2 THR 113 -4.135 11.301 7.694 878 2HG2 THR 113 2HG2 THR 113 -4.456 11.373 5.962 879 3HG2 THR 113 3HG2 THR 113 -5.233 10.137 6.953 880 H ALA 114 H ALA 114 -6.829 12.850 10.113 881 HA ALA 114 HA ALA 114 -9.419 14.223 9.851 882 1HB ALA 114 1HB ALA 114 -9.670 14.171 12.098 883 2HB ALA 114 2HB ALA 114 -7.946 14.388 12.405 884 3HB ALA 114 3HB ALA 114 -8.569 12.799 11.962 885 H ARG 115 H ARG 115 -9.509 16.482 10.513 886 HA ARG 115 HA ARG 115 -7.387 17.993 9.340 887 1HB ARG 115 1HB ARG 115 -10.035 18.436 9.642 888 2HB ARG 115 2HB ARG 115 -9.414 19.399 10.975 889 1HG ARG 115 1HG ARG 115 -8.534 20.957 9.615 890 2HG ARG 115 2HG ARG 115 -8.031 19.772 8.409 891 1HD ARG 115 1HD ARG 115 -10.370 19.575 7.663 892 2HD ARG 115 2HD ARG 115 -10.831 20.809 8.835 893 HE ARG 115 HE ARG 115 -9.559 21.220 6.293 894 1HH1 ARG 115 1HH1 ARG 115 -10.057 22.545 9.484 895 2HH1 ARG 115 2HH1 ARG 115 -9.764 24.178 8.987 896 1HH2 ARG 115 1HH2 ARG 115 -9.174 23.367 5.638 897 2HH2 ARG 115 2HH2 ARG 115 -9.265 24.645 6.804 898 H ASP 116 H ASP 116 -7.046 20.223 10.794 899 HA ASP 116 HA ASP 116 -5.671 19.231 13.196 900 1HB ASP 116 1HB ASP 116 -4.410 20.388 11.249 901 2HB ASP 116 2HB ASP 116 -5.106 21.876 11.884 902 HD2 ASP 116 HD2 ASP 116 -2.359 21.988 13.935 903 H ASN 117 H ASN 117 -8.462 19.824 13.230 904 HA ASN 117 HA ASN 117 -8.454 21.842 15.331 905 1HB ASN 117 1HB ASN 117 -9.020 22.958 13.112 906 2HB ASN 117 2HB ASN 117 -10.498 22.001 13.116 907 1HD2 ASN 117 1HD2 ASN 117 -9.085 24.867 14.052 908 2HD2 ASN 117 2HD2 ASN 117 -10.286 25.404 15.172 909 H TRP 118 H TRP 118 -8.681 19.718 16.436 910 HA TRP 118 HA TRP 118 -9.938 18.287 17.677 911 1HB TRP 118 1HB TRP 118 -11.586 20.549 17.294 912 2HB TRP 118 2HB TRP 118 -12.610 19.141 17.033 913 HD1 TRP 118 HD1 TRP 118 -11.876 17.154 19.175 914 HE1 TRP 118 HE1 TRP 118 -12.067 17.669 21.689 915 HE3 TRP 118 HE3 TRP 118 -11.763 22.261 18.969 916 HZ2 TRP 118 HZ2 TRP 118 -12.158 19.939 23.364 917 HZ3 TRP 118 HZ3 TRP 118 -11.907 23.529 21.073 918 HH2 TRP 118 HH2 TRP 118 -12.101 22.392 23.224 919 H ASN 119 H ASN 119 -12.293 18.915 15.090 920 HA ASN 119 HA ASN 119 -13.312 17.532 13.598 921 1HB ASN 119 1HB ASN 119 -10.465 16.773 13.559 922 2HB ASN 119 2HB ASN 119 -11.561 15.557 12.909 923 1HD2 ASN 119 1HD2 ASN 119 -11.869 19.069 12.821 924 2HD2 ASN 119 2HD2 ASN 119 -11.820 19.209 11.099 925 H TYR 120 H TYR 120 -13.443 14.924 13.098 926 HA TYR 120 HA TYR 120 -13.441 13.297 15.451 927 1HB TYR 120 1HB TYR 120 -15.695 14.924 15.095 928 2HB TYR 120 2HB TYR 120 -16.195 13.326 14.552 929 HD1 TYR 120 HD1 TYR 120 -14.975 15.282 17.419 930 HD2 TYR 120 HD2 TYR 120 -16.430 11.506 16.105 931 HE1 TYR 120 HE1 TYR 120 -15.293 14.597 19.759 932 HE2 TYR 120 HE2 TYR 120 -16.753 10.811 18.442 933 HH TYR 120 HH TYR 120 -17.123 11.973 20.675 934 H ILE 121 H ILE 121 -14.827 13.760 12.220 935 HA ILE 121 HA ILE 121 -14.386 10.894 11.694 936 HB ILE 121 HB ILE 121 -16.209 12.735 10.150 937 1HG1 ILE 121 1HG1 ILE 121 -17.897 11.068 11.441 938 2HG1 ILE 121 2HG1 ILE 121 -16.628 11.206 12.655 939 1HG2 ILE 121 1HG2 ILE 121 -17.134 10.663 9.259 940 2HG2 ILE 121 2HG2 ILE 121 -15.988 9.729 10.220 941 3HG2 ILE 121 3HG2 ILE 121 -15.406 10.777 8.928 942 1HD1 ILE 121 1HD1 ILE 121 -17.740 13.014 13.324 943 2HD1 ILE 121 2HD1 ILE 121 -18.639 13.137 11.811 944 3HD1 ILE 121 3HD1 ILE 121 -17.012 13.807 11.928 945 HA PRO 122 HA PRO 122 -11.114 12.707 9.112 946 1HB PRO 122 1HB PRO 122 -9.903 10.329 8.559 947 2HB PRO 122 2HB PRO 122 -9.622 11.237 10.047 948 1HG PRO 122 1HG PRO 122 -11.419 8.893 9.570 949 2HG PRO 122 2HG PRO 122 -10.340 9.216 10.939 950 1HD PRO 122 1HD PRO 122 -13.000 9.644 11.073 951 2HD PRO 122 2HD PRO 122 -11.834 10.667 11.937 952 H LEU 123 H LEU 123 -10.857 12.867 6.918 953 HA LEU 123 HA LEU 123 -12.960 11.770 5.291 954 1HB LEU 123 1HB LEU 123 -10.748 13.729 4.897 955 2HB LEU 123 2HB LEU 123 -11.473 12.996 3.478 956 HG LEU 123 HG LEU 123 -13.722 13.775 4.612 957 1HD1 LEU 123 1HD1 LEU 123 -12.705 14.568 6.672 958 2HD1 LEU 123 2HD1 LEU 123 -13.446 15.903 5.791 959 3HD1 LEU 123 3HD1 LEU 123 -11.697 15.690 5.759 960 1HD2 LEU 123 1HD2 LEU 123 -12.795 14.487 2.422 961 2HD2 LEU 123 2HD2 LEU 123 -11.888 15.747 3.258 962 3HD2 LEU 123 3HD2 LEU 123 -13.651 15.770 3.276 963 HA PRO 124 HA PRO 124 -10.426 8.255 4.119 964 1HB PRO 124 1HB PRO 124 -12.292 6.932 2.715 965 2HB PRO 124 2HB PRO 124 -12.351 7.024 4.479 966 1HG PRO 124 1HG PRO 124 -13.879 8.603 2.447 967 2HG PRO 124 2HG PRO 124 -14.449 7.879 3.961 968 1HD PRO 124 1HD PRO 124 -13.801 10.527 3.685 969 2HD PRO 124 2HD PRO 124 -13.714 9.644 5.222 970 H VAL 125 H VAL 125 -9.732 7.226 2.091 971 HA VAL 125 HA VAL 125 -10.274 8.651 -0.378 972 HB VAL 125 HB VAL 125 -7.431 8.470 0.620 973 1HG1 VAL 125 1HG1 VAL 125 -7.370 10.302 -1.320 974 2HG1 VAL 125 2HG1 VAL 125 -8.726 9.332 -1.897 975 3HG1 VAL 125 3HG1 VAL 125 -7.154 8.578 -1.628 976 1HG2 VAL 125 1HG2 VAL 125 -9.320 10.819 0.593 977 2HG2 VAL 125 2HG2 VAL 125 -7.576 10.949 0.826 978 3HG2 VAL 125 3HG2 VAL 125 -8.560 10.073 1.999 979 H LEU 126 H LEU 126 -10.511 7.158 -1.895 980 HA LEU 126 HA LEU 126 -9.285 4.530 -1.518 981 1HB LEU 126 1HB LEU 126 -11.806 5.192 -2.218 982 2HB LEU 126 2HB LEU 126 -11.090 5.019 -3.809 983 HG LEU 126 HG LEU 126 -10.312 2.721 -3.090 984 1HD1 LEU 126 1HD1 LEU 126 -12.417 2.737 -1.005 985 2HD1 LEU 126 2HD1 LEU 126 -10.862 3.462 -0.598 986 3HD1 LEU 126 3HD1 LEU 126 -10.940 1.781 -1.122 987 1HD2 LEU 126 1HD2 LEU 126 -12.049 2.491 -4.521 988 2HD2 LEU 126 2HD2 LEU 126 -13.087 3.590 -3.612 989 3HD2 LEU 126 3HD2 LEU 126 -12.869 1.928 -3.064 990 H LEU 127 H LEU 127 -7.543 3.928 -2.615 991 HA LEU 127 HA LEU 127 -7.056 4.970 -5.288 992 1HB LEU 127 1HB LEU 127 -4.756 5.627 -4.770 993 2HB LEU 127 2HB LEU 127 -5.923 6.585 -3.879 994 HG LEU 127 HG LEU 127 -4.735 4.193 -2.549 995 1HD1 LEU 127 1HD1 LEU 127 -3.004 5.855 -3.727 996 2HD1 LEU 127 2HD1 LEU 127 -2.696 5.094 -2.166 997 3HD1 LEU 127 3HD1 LEU 127 -3.292 6.752 -2.237 998 1HD2 LEU 127 1HD2 LEU 127 -5.591 6.924 -1.596 999 2HD2 LEU 127 2HD2 LEU 127 -4.987 5.622 -0.571 1000 3HD2 LEU 127 3HD2 LEU 127 -6.510 5.426 -1.439 1001 HA PRO 128 HA PRO 128 -5.651 0.818 -5.870 1002 1HB PRO 128 1HB PRO 128 -4.186 1.112 -8.123 1003 2HB PRO 128 2HB PRO 128 -5.951 1.202 -8.120 1004 1HG PRO 128 1HG PRO 128 -3.939 3.420 -8.131 1005 2HG PRO 128 2HG PRO 128 -5.434 3.262 -9.071 1006 1HD PRO 128 1HD PRO 128 -5.260 4.785 -6.830 1007 2HD PRO 128 2HD PRO 128 -6.757 3.968 -7.324 1008 H LEU 129 H LEU 129 -3.945 -0.467 -5.331 1009 HA LEU 129 HA LEU 129 -1.260 0.649 -5.215 1010 1HB LEU 129 1HB LEU 129 -2.869 -0.166 -2.831 1011 2HB LEU 129 2HB LEU 129 -1.136 -0.430 -2.826 1012 HG LEU 129 HG LEU 129 -1.151 2.148 -3.552 1013 1HD1 LEU 129 1HD1 LEU 129 -3.293 2.862 -3.511 1014 2HD1 LEU 129 2HD1 LEU 129 -2.961 3.036 -1.788 1015 3HD1 LEU 129 3HD1 LEU 129 -3.807 1.607 -2.383 1016 1HD2 LEU 129 1HD2 LEU 129 -1.095 2.586 -0.979 1017 2HD2 LEU 129 2HD2 LEU 129 0.156 1.601 -1.737 1018 3HD2 LEU 129 3HD2 LEU 129 -1.174 0.827 -0.876 1019 H ALA 130 H ALA 130 0.383 -1.005 -4.763 1020 HA ALA 130 HA ALA 130 -0.527 -3.745 -5.312 1021 1HB ALA 130 1HB ALA 130 0.212 -3.399 -7.418 1022 2HB ALA 130 2HB ALA 130 1.782 -3.737 -6.688 1023 3HB ALA 130 3HB ALA 130 1.269 -2.069 -6.946 1024 H SER 131 H SER 131 1.689 -5.164 -5.254 1025 HA SER 131 HA SER 131 3.627 -4.392 -3.337 1026 1HB SER 131 1HB SER 131 2.967 -5.546 -1.406 1027 2HB SER 131 2HB SER 131 1.471 -4.795 -1.957 1028 HG SER 131 HG SER 131 0.878 -6.776 -2.879 1029 H VAL 132 H VAL 132 5.160 -6.099 -2.869 1030 HA VAL 132 HA VAL 132 4.898 -8.534 -4.462 1031 HB VAL 132 HB VAL 132 7.280 -8.209 -5.280 1032 1HG1 VAL 132 1HG1 VAL 132 6.466 -7.519 -7.266 1033 2HG1 VAL 132 2HG1 VAL 132 5.706 -6.085 -6.578 1034 3HG1 VAL 132 3HG1 VAL 132 4.912 -7.653 -6.445 1035 1HG2 VAL 132 1HG2 VAL 132 7.339 -6.081 -3.627 1036 2HG2 VAL 132 2HG2 VAL 132 6.927 -5.285 -5.146 1037 3HG2 VAL 132 3HG2 VAL 132 8.393 -6.260 -5.029 1038 H GLY 133 H GLY 133 5.478 -10.223 -3.269 1039 1HA GLY 133 1HA GLY 133 7.030 -9.763 -0.834 1040 2HA GLY 133 2HA GLY 133 6.105 -11.207 -1.217 1041 H TYR 134 H TYR 134 9.165 -9.929 -0.964 1042 HA TYR 134 HA TYR 134 10.286 -12.178 -2.496 1043 1HB TYR 134 1HB TYR 134 10.576 -9.926 -3.633 1044 2HB TYR 134 2HB TYR 134 11.615 -9.475 -2.285 1045 HD1 TYR 134 HD1 TYR 134 13.865 -9.605 -2.740 1046 HD2 TYR 134 HD2 TYR 134 11.253 -12.430 -4.557 1047 HE1 TYR 134 HE1 TYR 134 15.785 -10.645 -3.870 1048 HE2 TYR 134 HE2 TYR 134 13.166 -13.478 -5.691 1049 HH TYR 134 HH TYR 134 16.237 -12.026 -5.840 1050 H GLY 135 H GLY 135 11.219 -13.534 -1.121 1051 1HA GLY 135 1HA GLY 135 12.405 -14.350 0.667 1052 2HA GLY 135 2HA GLY 135 13.342 -12.868 0.560 1053 HA PRO 136 HA PRO 136 11.328 -12.713 4.679 1054 1HB PRO 136 1HB PRO 136 13.347 -11.398 5.911 1055 2HB PRO 136 2HB PRO 136 13.358 -13.148 5.669 1056 1HG PRO 136 1HG PRO 136 14.728 -11.009 4.086 1057 2HG PRO 136 2HG PRO 136 15.356 -12.577 4.624 1058 1HD PRO 136 1HD PRO 136 14.462 -12.140 2.100 1059 2HD PRO 136 2HD PRO 136 14.335 -13.717 2.905 1060 H VAL 137 H VAL 137 12.356 -10.368 2.419 1061 HA VAL 137 HA VAL 137 11.168 -8.181 3.981 1062 HB VAL 137 HB VAL 137 12.179 -6.695 2.229 1063 1HG1 VAL 137 1HG1 VAL 137 13.333 -6.824 4.273 1064 2HG1 VAL 137 2HG1 VAL 137 14.560 -7.093 3.034 1065 3HG1 VAL 137 3HG1 VAL 137 13.907 -8.458 3.940 1066 1HG2 VAL 137 1HG2 VAL 137 12.338 -8.586 0.540 1067 2HG2 VAL 137 2HG2 VAL 137 13.777 -9.109 1.416 1068 3HG2 VAL 137 3HG2 VAL 137 13.734 -7.516 0.661 1069 H THR 138 H THR 138 9.686 -6.728 2.948 1070 HA THR 138 HA THR 138 8.363 -7.779 0.548 1071 HB THR 138 HB THR 138 6.197 -6.920 1.861 1072 HG1 THR 138 HG1 THR 138 7.829 -7.975 3.923 1073 1HG2 THR 138 1HG2 THR 138 5.672 -9.026 1.455 1074 2HG2 THR 138 2HG2 THR 138 6.499 -9.470 2.947 1075 3HG2 THR 138 3HG2 THR 138 7.371 -9.496 1.414 1076 H PHE 139 H PHE 139 8.061 -6.252 -0.931 1077 HA PHE 139 HA PHE 139 8.247 -3.441 -0.089 1078 1HB PHE 139 1HB PHE 139 9.671 -4.793 -2.024 1079 2HB PHE 139 2HB PHE 139 8.430 -3.973 -2.965 1080 HD1 PHE 139 HD1 PHE 139 11.616 -3.673 -1.535 1081 HD2 PHE 139 HD2 PHE 139 8.096 -1.436 -2.378 1082 HE1 PHE 139 HE1 PHE 139 12.918 -1.589 -1.421 1083 HE2 PHE 139 HE2 PHE 139 9.392 0.652 -2.268 1084 HZ PHE 139 HZ PHE 139 11.807 0.578 -1.790 1085 H GLN 140 H GLN 140 6.670 -1.992 -0.585 1086 HA GLN 140 HA GLN 140 4.335 -3.008 -2.067 1087 1HB GLN 140 1HB GLN 140 4.332 -2.514 0.607 1088 2HB GLN 140 2HB GLN 140 3.832 -0.948 -0.015 1089 1HG GLN 140 1HG GLN 140 2.430 -3.179 -1.255 1090 2HG GLN 140 2HG GLN 140 2.189 -3.078 0.489 1091 1HE2 GLN 140 1HE2 GLN 140 -0.039 -2.648 -0.168 1092 2HE2 GLN 140 2HE2 GLN 140 -0.497 -1.026 -0.546 1093 H MET 141 H MET 141 3.626 -1.765 -3.687 1094 HA MET 141 HA MET 141 4.838 0.897 -3.992 1095 1HB MET 141 1HB MET 141 3.655 -0.948 -6.075 1096 2HB MET 141 2HB MET 141 4.320 0.646 -6.401 1097 1HG MET 141 1HG MET 141 6.405 -0.485 -5.131 1098 2HG MET 141 2HG MET 141 5.682 -1.907 -5.881 1099 1HE MET 141 1HE MET 141 8.581 -0.930 -6.416 1100 2HE MET 141 2HE MET 141 8.760 -0.909 -8.170 1101 3HE MET 141 3HE MET 141 7.977 -2.278 -7.379 1102 H THR 142 H THR 142 3.533 2.613 -4.872 1103 HA THR 142 HA THR 142 0.643 2.258 -4.454 1104 HB THR 142 HB THR 142 2.170 4.733 -3.644 1105 HG1 THR 142 HG1 THR 142 2.792 3.559 -2.025 1106 1HG2 THR 142 1HG2 THR 142 0.225 5.642 -3.126 1107 2HG2 THR 142 2HG2 THR 142 -0.263 4.213 -2.213 1108 3HG2 THR 142 3HG2 THR 142 -0.562 4.297 -3.949 1109 H TYR 143 H TYR 143 -0.664 3.184 -5.942 1110 HA TYR 143 HA TYR 143 0.650 4.718 -8.088 1111 1HB TYR 143 1HB TYR 143 -0.485 2.382 -8.498 1112 2HB TYR 143 2HB TYR 143 -1.972 3.324 -8.482 1113 HD1 TYR 143 HD1 TYR 143 0.201 1.864 -10.630 1114 HD2 TYR 143 HD2 TYR 143 -1.520 5.688 -9.915 1115 HE1 TYR 143 HE1 TYR 143 0.564 2.462 -12.988 1116 HE2 TYR 143 HE2 TYR 143 -1.162 6.297 -12.270 1117 HH TYR 143 HH TYR 143 -0.903 4.674 -14.571 1118 H ILE 144 H ILE 144 0.097 6.780 -8.259 1119 HA ILE 144 HA ILE 144 -2.340 7.709 -6.916 1120 HB ILE 144 HB ILE 144 -0.083 9.401 -7.984 1121 1HG1 ILE 144 1HG1 ILE 144 0.220 9.501 -5.298 1122 2HG1 ILE 144 2HG1 ILE 144 -0.347 7.844 -5.479 1123 1HG2 ILE 144 1HG2 ILE 144 -1.126 10.867 -6.043 1124 2HG2 ILE 144 2HG2 ILE 144 -2.559 9.913 -6.429 1125 3HG2 ILE 144 3HG2 ILE 144 -1.785 10.886 -7.679 1126 1HD1 ILE 144 1HD1 ILE 144 1.478 7.300 -6.904 1127 2HD1 ILE 144 2HD1 ILE 144 2.124 8.110 -5.477 1128 3HD1 ILE 144 3HD1 ILE 144 1.977 8.989 -7.000 1129 HA PRO 145 HA PRO 145 -3.798 8.000 -11.224 1130 1HB PRO 145 1HB PRO 145 -6.431 7.962 -10.632 1131 2HB PRO 145 2HB PRO 145 -5.452 6.491 -10.670 1132 1HG PRO 145 1HG PRO 145 -6.321 8.128 -8.318 1133 2HG PRO 145 2HG PRO 145 -6.297 6.364 -8.506 1134 1HD PRO 145 1HD PRO 145 -4.365 7.742 -7.173 1135 2HD PRO 145 2HD PRO 145 -4.052 6.219 -8.029 1136 H GLY 146 H GLY 146 -3.860 9.906 -12.229 1137 1HA GLY 146 1HA GLY 146 -5.635 12.001 -11.403 1138 2HA GLY 146 2HA GLY 146 -3.954 12.388 -11.073 1139 H THR 147 H THR 147 -5.218 14.055 -12.712 1140 HA THR 147 HA THR 147 -4.508 13.235 -15.444 1141 HB THR 147 HB THR 147 -6.758 13.952 -15.402 1142 HG1 THR 147 HG1 THR 147 -5.454 14.957 -17.044 1143 1HG2 THR 147 1HG2 THR 147 -7.262 16.347 -14.575 1144 2HG2 THR 147 2HG2 THR 147 -5.803 16.135 -13.607 1145 3HG2 THR 147 3HG2 THR 147 -7.162 15.029 -13.408 1146 H TYR 148 H TYR 148 -2.234 13.573 -14.925 1147 HA TYR 148 HA TYR 148 -1.456 16.393 -14.686 1148 1HB TYR 148 1HB TYR 148 -0.194 13.815 -13.940 1149 2HB TYR 148 2HB TYR 148 0.892 15.081 -14.503 1150 HD1 TYR 148 HD1 TYR 148 1.974 16.012 -12.689 1151 HD2 TYR 148 HD2 TYR 148 -2.182 15.158 -12.376 1152 HE1 TYR 148 HE1 TYR 148 1.937 17.041 -10.456 1153 HE2 TYR 148 HE2 TYR 148 -2.231 16.186 -10.143 1154 HH TYR 148 HH TYR 148 0.354 16.726 -8.309 1155 H ASN 149 H ASN 149 0.857 16.663 -15.849 1156 HA ASN 149 HA ASN 149 0.265 16.575 -18.637 1157 1HB ASN 149 1HB ASN 149 2.474 17.619 -16.944 1158 2HB ASN 149 2HB ASN 149 2.842 17.305 -18.636 1159 1HD2 ASN 149 1HD2 ASN 149 0.211 18.739 -16.732 1160 2HD2 ASN 149 2HD2 ASN 149 0.013 20.129 -17.738 1161 H ASN 150 H ASN 150 2.293 14.701 -16.472 1162 HA ASN 150 HA ASN 150 3.166 13.043 -18.738 1163 1HB ASN 150 1HB ASN 150 4.771 14.145 -16.937 1164 2HB ASN 150 2HB ASN 150 4.328 12.716 -16.008 1165 1HD2 ASN 150 1HD2 ASN 150 6.407 13.969 -18.288 1166 2HD2 ASN 150 2HD2 ASN 150 7.075 12.491 -18.880 1167 H GLY 151 H GLY 151 1.938 12.802 -15.407 1168 1HA GLY 151 1HA GLY 151 0.553 11.243 -14.437 1169 2HA GLY 151 2HA GLY 151 0.166 10.680 -16.057 1170 H ASN 152 H ASN 152 3.409 10.772 -14.713 1171 HA ASN 152 HA ASN 152 3.370 7.836 -14.510 1172 1HB ASN 152 1HB ASN 152 4.964 9.507 -16.273 1173 2HB ASN 152 2HB ASN 152 5.981 8.511 -15.237 1174 1HD2 ASN 152 1HD2 ASN 152 2.889 8.064 -16.927 1175 2HD2 ASN 152 2HD2 ASN 152 3.334 6.587 -17.703 1176 H VAL 153 H VAL 153 3.233 7.869 -12.276 1177 HA VAL 153 HA VAL 153 5.698 8.685 -10.913 1178 HB VAL 153 HB VAL 153 4.320 9.459 -8.960 1179 1HG1 VAL 153 1HG1 VAL 153 3.516 11.591 -10.375 1180 2HG1 VAL 153 2HG1 VAL 153 4.596 10.845 -11.553 1181 3HG1 VAL 153 3HG1 VAL 153 5.203 11.287 -9.957 1182 1HG2 VAL 153 1HG2 VAL 153 1.982 10.314 -9.857 1183 2HG2 VAL 153 2HG2 VAL 153 2.176 8.701 -9.171 1184 3HG2 VAL 153 3HG2 VAL 153 2.153 8.918 -10.921 1185 H TYR 154 H TYR 154 6.447 7.204 -9.517 1186 HA TYR 154 HA TYR 154 4.633 5.029 -8.702 1187 1HB TYR 154 1HB TYR 154 7.569 4.747 -9.374 1188 2HB TYR 154 2HB TYR 154 6.475 3.450 -8.906 1189 HD1 TYR 154 HD1 TYR 154 5.182 2.326 -10.517 1190 HD2 TYR 154 HD2 TYR 154 7.137 5.958 -11.560 1191 HE1 TYR 154 HE1 TYR 154 4.614 1.947 -12.880 1192 HE2 TYR 154 HE2 TYR 154 6.574 5.590 -13.925 1193 HH TYR 154 HH TYR 154 5.446 2.630 -15.107 1194 H PHE 155 H PHE 155 4.602 4.529 -6.588 1195 HA PHE 155 HA PHE 155 6.449 5.997 -4.837 1196 1HB PHE 155 1HB PHE 155 3.653 5.691 -4.779 1197 2HB PHE 155 2HB PHE 155 4.263 4.736 -3.433 1198 HD1 PHE 155 HD1 PHE 155 5.483 7.936 -4.891 1199 HD2 PHE 155 HD2 PHE 155 3.833 5.940 -1.515 1200 HE1 PHE 155 HE1 PHE 155 5.738 9.989 -3.558 1201 HE2 PHE 155 HE2 PHE 155 4.083 7.989 -0.175 1202 HZ PHE 155 HZ PHE 155 5.037 10.017 -1.197 1203 H ALA 156 H ALA 156 7.682 4.968 -3.325 1204 HA ALA 156 HA ALA 156 7.609 2.021 -3.357 1205 1HB ALA 156 1HB ALA 156 9.644 2.320 -4.302 1206 2HB ALA 156 2HB ALA 156 10.138 2.485 -2.616 1207 3HB ALA 156 3HB ALA 156 9.858 3.923 -3.597 1208 H TRP 157 H TRP 157 7.595 0.960 -1.445 1209 HA TRP 157 HA TRP 157 8.224 2.358 1.021 1210 1HB TRP 157 1HB TRP 157 5.491 1.851 0.130 1211 2HB TRP 157 2HB TRP 157 5.826 1.145 1.708 1212 HD1 TRP 157 HD1 TRP 157 7.764 3.462 2.796 1213 HE1 TRP 157 HE1 TRP 157 6.738 5.727 3.464 1214 HE3 TRP 157 HE3 TRP 157 3.400 3.189 0.146 1215 HZ2 TRP 157 HZ2 TRP 157 4.388 7.201 2.936 1216 HZ3 TRP 157 HZ3 TRP 157 1.818 5.068 0.282 1217 HH2 TRP 157 HH2 TRP 157 2.304 7.032 1.649 1218 H MET 158 H MET 158 9.456 1.023 2.151 1219 HA MET 158 HA MET 158 9.288 -1.851 1.671 1220 1HB MET 158 1HB MET 158 11.449 -0.281 1.845 1221 2HB MET 158 2HB MET 158 11.300 -0.719 3.542 1222 1HG MET 158 1HG MET 158 11.007 -3.124 2.226 1223 2HG MET 158 2HG MET 158 12.239 -2.281 1.288 1224 1HE MET 158 1HE MET 158 15.334 -2.488 3.209 1225 2HE MET 158 2HE MET 158 14.424 -1.765 1.883 1226 3HE MET 158 3HE MET 158 14.638 -3.514 1.954 1227 H ARG 159 H ARG 159 8.809 -3.353 3.224 1228 HA ARG 159 HA ARG 159 8.243 -2.449 5.941 1229 1HB ARG 159 1HB ARG 159 6.035 -3.452 5.977 1230 2HB ARG 159 2HB ARG 159 6.115 -2.242 4.705 1231 1HG ARG 159 1HG ARG 159 6.797 -4.937 3.808 1232 2HG ARG 159 2HG ARG 159 5.150 -4.778 4.424 1233 1HD ARG 159 1HD ARG 159 4.939 -2.744 2.924 1234 2HD ARG 159 2HD ARG 159 6.453 -3.256 2.179 1235 HE ARG 159 HE ARG 159 5.289 -4.852 1.042 1236 1HH1 ARG 159 1HH1 ARG 159 3.382 -3.853 3.790 1237 2HH1 ARG 159 2HH1 ARG 159 2.005 -4.799 3.335 1238 1HH2 ARG 159 1HH2 ARG 159 3.478 -6.096 0.444 1239 2HH2 ARG 159 2HH2 ARG 159 2.058 -6.071 1.436 1240 H PHE 160 H PHE 160 8.130 -4.163 7.489 1241 HA PHE 160 HA PHE 160 9.022 -6.789 6.537 1242 1HB PHE 160 1HB PHE 160 10.910 -5.193 7.410 1243 2HB PHE 160 2HB PHE 160 10.277 -5.624 8.997 1244 HD1 PHE 160 HD1 PHE 160 12.573 -6.486 6.500 1245 HD2 PHE 160 HD2 PHE 160 9.964 -8.208 9.387 1246 HE1 PHE 160 HE1 PHE 160 13.902 -8.556 6.459 1247 HE2 PHE 160 HE2 PHE 160 11.288 -10.281 9.352 1248 HZ PHE 160 HZ PHE 160 13.261 -10.458 7.887 1249 H GLN 161 H GLN 161 7.965 -8.424 7.463 1250 HA GLN 161 HA GLN 161 5.930 -7.886 9.408 1251 1HB GLN 161 1HB GLN 161 5.389 -10.258 9.202 1252 2HB GLN 161 2HB GLN 161 5.591 -9.529 7.615 1253 1HG GLN 161 1HG GLN 161 8.074 -10.412 7.965 1254 2HG GLN 161 2HG GLN 161 7.229 -11.568 8.993 1255 1HE2 GLN 161 1HE2 GLN 161 6.540 -10.015 5.874 1256 2HE2 GLN 161 2HE2 GLN 161 6.204 -11.482 5.024 1257 H PHE 162 H PHE 162 6.040 -8.060 11.551 1258 HA PHE 162 HA PHE 162 8.316 -9.523 12.719 1259 1HB PHE 162 1HB PHE 162 8.173 -6.860 12.815 1260 2HB PHE 162 2HB PHE 162 7.147 -7.220 14.201 1261 HD1 PHE 162 HD1 PHE 162 10.470 -8.102 12.768 1262 HD2 PHE 162 HD2 PHE 162 8.120 -7.515 16.266 1263 HE1 PHE 162 HE1 PHE 162 12.473 -8.417 14.162 1264 HE2 PHE 162 HE2 PHE 162 10.118 -7.828 17.666 1265 HZ PHE 162 HZ PHE 162 12.299 -8.280 16.615 1266 H LEU 163 H LEU 163 7.941 -10.672 14.611 1267 HA LEU 163 HA LEU 163 5.099 -11.096 15.243 1268 1HB LEU 163 1HB LEU 163 6.862 -12.945 14.409 1269 2HB LEU 163 2HB LEU 163 7.137 -13.049 16.137 1270 HG LEU 163 HG LEU 163 4.370 -13.113 15.908 1271 1HD1 LEU 163 1HD1 LEU 163 4.179 -15.128 14.312 1272 2HD1 LEU 163 2HD1 LEU 163 5.670 -14.509 13.604 1273 3HD1 LEU 163 3HD1 LEU 163 4.221 -13.504 13.628 1274 1HD2 LEU 163 1HD2 LEU 163 4.738 -15.589 16.390 1275 2HD2 LEU 163 2HD2 LEU 163 5.459 -14.434 17.510 1276 3HD2 LEU 163 3HD2 LEU 163 6.462 -15.230 16.298 1277 H GLU 164 H GLU 164 4.541 -11.548 17.472 1278 HA GLU 164 HA GLU 164 6.256 -10.052 19.333 1279 1HB GLU 164 1HB GLU 164 3.645 -9.624 18.771 1280 2HB GLU 164 2HB GLU 164 3.489 -10.733 20.125 1281 1HG GLU 164 1HG GLU 164 3.442 -8.612 21.086 1282 2HG GLU 164 2HG GLU 164 5.083 -9.190 21.368 1283 HE2 GLU 164 HE2 GLU 164 6.392 -6.505 19.711 1284 H HIS 165 H HIS 165 6.869 -10.914 21.285 1285 HA HIS 165 HA HIS 165 6.208 -13.754 21.718 1286 1HB HIS 165 1HB HIS 165 8.801 -12.388 21.558 1287 2HB HIS 165 2HB HIS 165 8.627 -13.416 22.977 1288 HD1 HIS 165 HD1 HIS 165 9.974 -15.421 22.367 1289 HD2 HIS 165 HD2 HIS 165 7.385 -14.281 19.324 1290 HE1 HIS 165 HE1 HIS 165 10.146 -17.227 20.627 1291 HE2 HIS 165 HE2 HIS 165 8.505 -16.560 18.836 1292 H HIS 166 H HIS 166 6.138 -14.476 23.906 1293 HA HIS 166 HA HIS 166 5.219 -12.397 25.726 1294 1HB HIS 166 1HB HIS 166 5.206 -15.386 26.168 1295 2HB HIS 166 2HB HIS 166 4.274 -14.173 27.039 1296 HD1 HIS 166 HD1 HIS 166 4.447 -15.896 23.691 1297 HD2 HIS 166 HD2 HIS 166 1.873 -13.473 25.875 1298 HE1 HIS 166 HE1 HIS 166 2.284 -15.884 22.408 1299 HE2 HIS 166 HE2 HIS 166 0.771 -14.340 23.703 1300 H HIS 167 H HIS 167 6.010 -12.145 27.849 1301 HA HIS 167 HA HIS 167 8.797 -13.024 28.164 1302 1HB HIS 167 1HB HIS 167 7.288 -10.620 29.159 1303 2HB HIS 167 2HB HIS 167 8.791 -11.125 29.925 1304 HD1 HIS 167 HD1 HIS 167 7.623 -8.903 27.429 1305 HD2 HIS 167 HD2 HIS 167 10.928 -11.396 27.773 1306 HE1 HIS 167 HE1 HIS 167 9.304 -8.020 25.780 1307 HE2 HIS 167 HE2 HIS 167 11.262 -9.598 25.944 1308 H HIS 168 H HIS 168 9.317 -14.409 29.723 1309 HA HIS 168 HA HIS 168 7.313 -14.966 31.809 1310 1HB HIS 168 1HB HIS 168 9.144 -16.707 30.243 1311 2HB HIS 168 2HB HIS 168 8.862 -17.149 31.924 1312 HD1 HIS 168 HD1 HIS 168 7.576 -19.277 31.178 1313 HD2 HIS 168 HD2 HIS 168 5.863 -15.708 29.916 1314 HE1 HIS 168 HE1 HIS 168 5.267 -19.883 30.384 1315 HE2 HIS 168 HE2 HIS 168 4.220 -17.695 29.705 1316 H HIS 169 H HIS 169 10.840 -15.245 31.333 1317 HA HIS 169 HA HIS 169 11.190 -14.157 34.049 1318 1HB HIS 169 1HB HIS 169 12.308 -16.599 32.805 1319 2HB HIS 169 2HB HIS 169 13.436 -15.633 33.750 1320 HD1 HIS 169 HD1 HIS 169 13.504 -17.675 35.431 1321 HD2 HIS 169 HD2 HIS 169 9.850 -15.716 35.152 1322 HE1 HIS 169 HE1 HIS 169 12.184 -18.425 37.436 1323 HE2 HIS 169 HE2 HIS 169 10.010 -17.160 37.292 1324 H HIS 170 H HIS 170 11.382 -12.084 32.983 1325 HA HIS 170 HA HIS 170 14.031 -11.706 31.748 1326 1HB HIS 170 1HB HIS 170 11.722 -11.292 30.428 1327 2HB HIS 170 2HB HIS 170 11.907 -9.714 31.185 1328 HD1 HIS 170 HD1 HIS 170 14.755 -11.804 29.849 1329 HD2 HIS 170 HD2 HIS 170 12.697 -8.305 28.966 1330 HE1 HIS 170 HE1 HIS 170 16.054 -10.710 27.994 1331 HE2 HIS 170 HE2 HIS 170 14.740 -8.640 27.416 Start of MODEL 15 1 1H MET 1 1H MET 1 -5.136 -47.328 23.809 2 2H MET 1 2H MET 1 -4.601 -46.025 24.790 3 H MET 1 H MET 1 -5.255 -47.051 24.251 4 3H MET 1 3H MET 1 -3.462 -46.970 23.918 5 HA MET 1 HA MET 1 -4.657 -46.242 21.869 6 1HB MET 1 1HB MET 1 -5.761 -44.346 23.945 7 2HB MET 1 2HB MET 1 -5.794 -44.005 22.221 8 1HG MET 1 1HG MET 1 -7.463 -45.460 21.823 9 2HG MET 1 2HG MET 1 -6.900 -46.608 23.036 10 1HE MET 1 1HE MET 1 -7.504 -45.644 26.090 11 2HE MET 1 2HE MET 1 -7.660 -47.014 24.991 12 3HE MET 1 3HE MET 1 -9.091 -46.350 25.781 13 H ASN 2 H ASN 2 -3.695 -44.469 20.696 14 HA ASN 2 HA ASN 2 -1.205 -43.575 21.950 15 1HB ASN 2 1HB ASN 2 -1.991 -44.359 19.255 16 2HB ASN 2 2HB ASN 2 -1.108 -42.836 19.272 17 1HD2 ASN 2 1HD2 ASN 2 -0.988 -46.222 20.136 18 2HD2 ASN 2 2HD2 ASN 2 0.735 -46.337 20.221 19 H ALA 3 H ALA 3 -3.807 -42.325 22.494 20 HA ALA 3 HA ALA 3 -4.132 -39.909 21.111 21 1HB ALA 3 1HB ALA 3 -5.790 -39.490 22.581 22 2HB ALA 3 2HB ALA 3 -4.797 -39.892 23.983 23 3HB ALA 3 3HB ALA 3 -5.535 -41.177 23.026 24 H ASP 4 H ASP 4 -1.749 -40.871 23.385 25 HA ASP 4 HA ASP 4 -1.085 -38.240 24.317 26 1HB ASP 4 1HB ASP 4 -0.635 -40.494 25.493 27 2HB ASP 4 2HB ASP 4 0.755 -40.620 24.419 28 HD2 ASP 4 HD2 ASP 4 2.576 -38.597 26.473 29 H GLU 5 H GLU 5 0.595 -40.582 22.219 30 HA GLU 5 HA GLU 5 2.537 -38.711 21.334 31 1HB GLU 5 1HB GLU 5 1.652 -41.364 20.191 32 2HB GLU 5 2HB GLU 5 3.019 -40.442 19.582 33 1HG GLU 5 1HG GLU 5 4.251 -41.609 21.012 34 2HG GLU 5 2HG GLU 5 3.541 -40.598 22.271 35 HE2 GLU 5 HE2 GLU 5 2.757 -44.391 22.308 36 H TRP 6 H TRP 6 -0.682 -39.498 20.319 37 HA TRP 6 HA TRP 6 -0.494 -38.432 17.681 38 1HB TRP 6 1HB TRP 6 -2.676 -39.370 19.467 39 2HB TRP 6 2HB TRP 6 -3.128 -38.268 18.170 40 HD1 TRP 6 HD1 TRP 6 -1.025 -39.463 15.998 41 HE1 TRP 6 HE1 TRP 6 -1.574 -41.725 14.900 42 HE3 TRP 6 HE3 TRP 6 -4.310 -41.277 19.471 43 HZ2 TRP 6 HZ2 TRP 6 -3.186 -43.980 15.435 44 HZ3 TRP 6 HZ3 TRP 6 -5.309 -43.494 19.103 45 HH2 TRP 6 HH2 TRP 6 -4.760 -44.816 17.126 46 H MET 7 H MET 7 -1.151 -37.092 20.833 47 HA MET 7 HA MET 7 -2.374 -34.688 20.096 48 1HB MET 7 1HB MET 7 -2.099 -35.638 22.432 49 2HB MET 7 2HB MET 7 -0.456 -35.013 22.402 50 1HG MET 7 1HG MET 7 -1.643 -33.367 23.512 51 2HG MET 7 2HG MET 7 -1.536 -32.752 21.863 52 1HE MET 7 1HE MET 7 -3.707 -32.251 24.514 53 2HE MET 7 2HE MET 7 -5.093 -31.763 23.538 54 3HE MET 7 3HE MET 7 -3.486 -31.142 23.161 55 H THR 8 H THR 8 0.966 -35.688 20.001 56 HA THR 8 HA THR 8 2.224 -33.199 19.853 57 HB THR 8 HB THR 8 4.088 -34.367 18.826 58 HG1 THR 8 HG1 THR 8 2.180 -36.402 18.356 59 1HG2 THR 8 1HG2 THR 8 2.688 -35.580 21.099 60 2HG2 THR 8 2HG2 THR 8 4.357 -35.033 20.946 61 3HG2 THR 8 3HG2 THR 8 3.882 -36.606 20.307 62 H THR 9 H THR 9 0.602 -35.109 17.387 63 HA THR 9 HA THR 9 1.434 -33.449 15.207 64 HB THR 9 HB THR 9 -0.894 -35.375 15.294 65 HG1 THR 9 HG1 THR 9 1.855 -35.827 14.800 66 1HG2 THR 9 1HG2 THR 9 -0.571 -33.779 13.302 67 2HG2 THR 9 2HG2 THR 9 -0.802 -35.500 12.989 68 3HG2 THR 9 3HG2 THR 9 0.815 -34.799 12.914 69 H PHE 10 H PHE 10 -1.480 -33.728 17.192 70 HA PHE 10 HA PHE 10 -2.977 -31.783 15.758 71 1HB PHE 10 1HB PHE 10 -3.258 -33.024 18.488 72 2HB PHE 10 2HB PHE 10 -4.347 -31.756 17.939 73 HD1 PHE 10 HD1 PHE 10 -5.830 -32.150 16.008 74 HD2 PHE 10 HD2 PHE 10 -3.434 -35.247 17.674 75 HE1 PHE 10 HE1 PHE 10 -7.213 -33.832 14.861 76 HE2 PHE 10 HE2 PHE 10 -4.811 -36.934 16.529 77 HZ PHE 10 HZ PHE 10 -6.702 -36.227 15.119 78 H ARG 11 H ARG 11 -0.686 -31.642 18.388 79 HA ARG 11 HA ARG 11 -1.254 -29.137 19.450 80 1HB ARG 11 1HB ARG 11 0.371 -30.751 20.401 81 2HB ARG 11 2HB ARG 11 1.478 -30.377 19.088 82 1HG ARG 11 1HG ARG 11 2.056 -28.362 19.959 83 2HG ARG 11 2HG ARG 11 0.481 -28.111 20.713 84 1HD ARG 11 1HD ARG 11 1.214 -30.119 22.219 85 2HD ARG 11 2HD ARG 11 2.835 -29.664 21.697 86 HE ARG 11 HE ARG 11 1.390 -27.407 22.634 87 1HH1 ARG 11 1HH1 ARG 11 3.113 -30.237 23.731 88 2HH1 ARG 11 2HH1 ARG 11 3.542 -29.538 25.255 89 1HH2 ARG 11 1HH2 ARG 11 1.953 -26.487 24.640 90 2HH2 ARG 11 2HH2 ARG 11 2.884 -27.409 25.773 91 H GLU 12 H GLU 12 0.359 -30.010 16.482 92 HA GLU 12 HA GLU 12 1.561 -27.495 15.963 93 1HB GLU 12 1HB GLU 12 1.793 -29.931 14.839 94 2HB GLU 12 2HB GLU 12 0.720 -29.175 13.669 95 1HG GLU 12 1HG GLU 12 2.798 -27.341 14.247 96 2HG GLU 12 2HG GLU 12 3.531 -28.914 13.939 97 HE2 GLU 12 HE2 GLU 12 1.301 -27.617 10.926 98 H ASN 13 H ASN 13 -1.539 -28.935 15.044 99 HA ASN 13 HA ASN 13 -2.378 -26.801 13.381 100 1HB ASN 13 1HB ASN 13 -3.602 -29.214 14.563 101 2HB ASN 13 2HB ASN 13 -4.723 -27.902 14.214 102 1HD2 ASN 13 1HD2 ASN 13 -1.819 -29.111 12.575 103 2HD2 ASN 13 2HD2 ASN 13 -2.582 -29.369 11.047 104 H ILE 14 H ILE 14 -2.884 -27.535 16.805 105 HA ILE 14 HA ILE 14 -4.620 -25.325 17.284 106 HB ILE 14 HB ILE 14 -2.955 -26.794 19.327 107 1HG1 ILE 14 1HG1 ILE 14 -4.246 -28.392 17.985 108 2HG1 ILE 14 2HG1 ILE 14 -4.890 -28.278 19.620 109 1HG2 ILE 14 1HG2 ILE 14 -5.649 -25.790 19.961 110 2HG2 ILE 14 2HG2 ILE 14 -4.417 -24.560 19.679 111 3HG2 ILE 14 3HG2 ILE 14 -4.174 -25.779 20.929 112 1HD1 ILE 14 1HD1 ILE 14 -6.279 -28.022 17.215 113 2HD1 ILE 14 2HD1 ILE 14 -6.208 -26.399 17.901 114 3HD1 ILE 14 3HD1 ILE 14 -6.885 -27.725 18.846 115 H ALA 15 H ALA 15 -1.160 -25.787 17.329 116 HA ALA 15 HA ALA 15 -0.426 -23.541 18.847 117 1HB ALA 15 1HB ALA 15 1.681 -23.777 17.212 118 2HB ALA 15 2HB ALA 15 0.926 -25.347 16.938 119 3HB ALA 15 3HB ALA 15 1.389 -24.865 18.570 120 H GLN 16 H GLN 16 -0.590 -23.927 15.305 121 HA GLN 16 HA GLN 16 -0.060 -21.205 14.742 122 1HB GLN 16 1HB GLN 16 -0.835 -21.745 12.461 123 2HB GLN 16 2HB GLN 16 0.316 -22.926 13.071 124 1HG GLN 16 1HG GLN 16 -1.879 -24.183 13.799 125 2HG GLN 16 2HG GLN 16 -2.583 -23.214 12.506 126 1HE2 GLN 16 1HE2 GLN 16 -2.976 -25.344 11.560 127 2HE2 GLN 16 2HE2 GLN 16 -1.724 -26.080 10.624 128 H THR 17 H THR 17 -3.073 -23.066 14.954 129 HA THR 17 HA THR 17 -4.834 -21.035 14.184 130 HB THR 17 HB THR 17 -5.359 -23.259 16.163 131 HG1 THR 17 HG1 THR 17 -5.938 -24.463 14.372 132 1HG2 THR 17 1HG2 THR 17 -7.450 -22.399 14.291 133 2HG2 THR 17 2HG2 THR 17 -7.067 -21.266 15.585 134 3HG2 THR 17 3HG2 THR 17 -7.565 -22.912 15.975 135 H TRP 18 H TRP 18 -3.460 -21.833 17.334 136 HA TRP 18 HA TRP 18 -5.024 -20.070 18.874 137 1HB TRP 18 1HB TRP 18 -3.582 -21.934 19.757 138 2HB TRP 18 2HB TRP 18 -2.180 -20.914 19.451 139 HD1 TRP 18 HD1 TRP 18 -5.354 -21.000 21.649 140 HE1 TRP 18 HE1 TRP 18 -4.906 -19.596 23.758 141 HE3 TRP 18 HE3 TRP 18 -0.749 -19.144 20.426 142 HZ2 TRP 18 HZ2 TRP 18 -2.870 -17.922 24.770 143 HZ3 TRP 18 HZ3 TRP 18 0.380 -17.648 22.020 144 HH2 TRP 18 HH2 TRP 18 -0.660 -17.050 24.147 145 H GLN 19 H GLN 19 -2.121 -19.610 16.973 146 HA GLN 19 HA GLN 19 -1.387 -17.084 18.005 147 1HB GLN 19 1HB GLN 19 -0.133 -18.783 16.408 148 2HB GLN 19 2HB GLN 19 -0.845 -17.777 15.154 149 1HG GLN 19 1HG GLN 19 0.220 -15.806 16.138 150 2HG GLN 19 2HG GLN 19 0.944 -16.826 17.380 151 1HE2 GLN 19 1HE2 GLN 19 2.967 -17.343 17.010 152 2HE2 GLN 19 2HE2 GLN 19 3.714 -17.520 15.461 153 H GLN 20 H GLN 20 -3.492 -18.070 15.347 154 HA GLN 20 HA GLN 20 -5.038 -16.942 14.119 155 1HB GLN 20 1HB GLN 20 -5.056 -15.670 16.753 156 2HB GLN 20 2HB GLN 20 -5.626 -14.610 15.472 157 1HG GLN 20 1HG GLN 20 -7.605 -15.566 15.781 158 2HG GLN 20 2HG GLN 20 -6.932 -16.952 14.927 159 1HE2 GLN 20 1HE2 GLN 20 -6.509 -15.647 18.199 160 2HE2 GLN 20 2HE2 GLN 20 -6.902 -17.114 19.022 161 HA PRO 21 HA PRO 21 -3.072 -13.860 11.666 162 1HB PRO 21 1HB PRO 21 -5.084 -12.208 10.901 163 2HB PRO 21 2HB PRO 21 -4.904 -13.851 10.277 164 1HG PRO 21 1HG PRO 21 -6.703 -12.835 12.443 165 2HG PRO 21 2HG PRO 21 -7.062 -13.977 11.135 166 1HD PRO 21 1HD PRO 21 -6.530 -14.779 13.667 167 2HD PRO 21 2HD PRO 21 -6.090 -15.748 12.245 168 H GLU 22 H GLU 22 -1.782 -12.901 13.316 169 HA GLU 22 HA GLU 22 -2.686 -10.205 14.050 170 1HB GLU 22 1HB GLU 22 -1.723 -12.373 15.846 171 2HB GLU 22 2HB GLU 22 -1.186 -10.736 16.196 172 1HG GLU 22 1HG GLU 22 -4.054 -10.963 15.682 173 2HG GLU 22 2HG GLU 22 -3.494 -11.863 17.091 174 HE2 GLU 22 HE2 GLU 22 -2.535 -8.047 17.390 175 H HIS 23 H HIS 23 -0.963 -11.158 11.912 176 HA HIS 23 HA HIS 23 1.762 -10.785 12.543 177 1HB HIS 23 1HB HIS 23 0.150 -10.845 10.035 178 2HB HIS 23 2HB HIS 23 1.777 -10.175 9.954 179 HD1 HIS 23 HD1 HIS 23 3.679 -11.806 9.854 180 HD2 HIS 23 HD2 HIS 23 0.082 -13.612 10.887 181 HE1 HIS 23 HE1 HIS 23 4.136 -14.279 9.827 182 HE2 HIS 23 HE2 HIS 23 1.970 -15.346 10.548 183 H TYR 24 H TYR 24 3.049 -9.011 12.577 184 HA TYR 24 HA TYR 24 1.696 -6.410 12.349 185 1HB TYR 24 1HB TYR 24 4.123 -7.268 13.927 186 2HB TYR 24 2HB TYR 24 3.649 -5.585 13.733 187 HD1 TYR 24 HD1 TYR 24 2.205 -8.856 14.820 188 HD2 TYR 24 HD2 TYR 24 2.293 -4.635 15.347 189 HE1 TYR 24 HE1 TYR 24 0.688 -9.070 16.744 190 HE2 TYR 24 HE2 TYR 24 0.777 -4.837 17.273 191 HH TYR 24 HH TYR 24 -0.883 -6.402 18.153 192 H ASP 25 H ASP 25 2.178 -5.177 10.664 193 HA ASP 25 HA ASP 25 4.755 -5.606 9.300 194 1HB ASP 25 1HB ASP 25 2.181 -4.619 8.055 195 2HB ASP 25 2HB ASP 25 3.686 -4.984 7.215 196 HD2 ASP 25 HD2 ASP 25 2.978 -8.484 8.173 197 H LEU 26 H LEU 26 6.117 -3.984 9.605 198 HA LEU 26 HA LEU 26 5.047 -1.298 10.115 199 1HB LEU 26 1HB LEU 26 6.527 -2.170 11.836 200 2HB LEU 26 2HB LEU 26 7.777 -2.471 10.644 201 HG LEU 26 HG LEU 26 6.824 0.323 10.841 202 1HD1 LEU 26 1HD1 LEU 26 8.752 -0.650 12.910 203 2HD1 LEU 26 2HD1 LEU 26 7.016 -0.663 13.220 204 3HD1 LEU 26 3HD1 LEU 26 7.834 0.855 12.856 205 1HD2 LEU 26 1HD2 LEU 26 8.964 0.833 10.168 206 2HD2 LEU 26 2HD2 LEU 26 8.737 -0.748 9.419 207 3HD2 LEU 26 3HD2 LEU 26 9.658 -0.604 10.917 208 H TYR 27 H TYR 27 5.065 0.107 8.501 209 HA TYR 27 HA TYR 27 7.051 -0.239 6.353 210 1HB TYR 27 1HB TYR 27 5.398 1.062 4.949 211 2HB TYR 27 2HB TYR 27 4.872 -0.546 5.439 212 HD1 TYR 27 HD1 TYR 27 3.042 -0.835 6.996 213 HD2 TYR 27 HD2 TYR 27 4.360 3.057 5.895 214 HE1 TYR 27 HE1 TYR 27 0.990 0.124 7.955 215 HE2 TYR 27 HE2 TYR 27 2.313 4.027 6.851 216 HH TYR 27 HH TYR 27 0.293 2.396 8.912 217 H ILE 28 H ILE 28 8.038 1.616 5.466 218 HA ILE 28 HA ILE 28 7.613 4.189 6.732 219 HB ILE 28 HB ILE 28 9.997 4.462 7.350 220 1HG1 ILE 28 1HG1 ILE 28 10.430 1.534 7.429 221 2HG1 ILE 28 2HG1 ILE 28 10.467 2.270 5.829 222 1HG2 ILE 28 1HG2 ILE 28 8.322 3.907 9.038 223 2HG2 ILE 28 2HG2 ILE 28 9.883 3.184 9.425 224 3HG2 ILE 28 3HG2 ILE 28 8.593 2.189 8.748 225 1HD1 ILE 28 1HD1 ILE 28 12.420 3.304 6.211 226 2HD1 ILE 28 2HD1 ILE 28 12.604 2.052 7.440 227 3HD1 ILE 28 3HD1 ILE 28 12.030 3.656 7.895 228 HA PRO 29 HA PRO 29 8.835 5.638 2.749 229 1HB PRO 29 1HB PRO 29 9.843 8.086 3.344 230 2HB PRO 29 2HB PRO 29 8.115 7.722 3.398 231 1HG PRO 29 1HG PRO 29 10.094 7.849 5.640 232 2HG PRO 29 2HG PRO 29 8.439 8.481 5.571 233 1HD PRO 29 1HD PRO 29 9.059 6.155 6.809 234 2HD PRO 29 2HD PRO 29 7.500 6.421 6.004 235 H ALA 30 H ALA 30 10.865 7.153 1.897 236 HA ALA 30 HA ALA 30 13.111 5.378 2.076 237 1HB ALA 30 1HB ALA 30 13.432 8.003 0.756 238 2HB ALA 30 2HB ALA 30 12.197 6.930 0.098 239 3HB ALA 30 3HB ALA 30 13.873 6.390 0.199 240 H ILE 31 H ILE 31 15.318 6.953 1.946 241 HA ILE 31 HA ILE 31 15.387 8.821 4.141 242 HB ILE 31 HB ILE 31 15.509 6.684 5.348 243 1HG1 ILE 31 1HG1 ILE 31 17.688 7.115 6.525 244 2HG1 ILE 31 2HG1 ILE 31 18.067 8.296 5.276 245 1HG2 ILE 31 1HG2 ILE 31 16.473 5.311 3.587 246 2HG2 ILE 31 2HG2 ILE 31 17.437 5.205 5.060 247 3HG2 ILE 31 3HG2 ILE 31 17.993 6.196 3.712 248 1HD1 ILE 31 1HD1 ILE 31 15.593 8.468 6.963 249 2HD1 ILE 31 2HD1 ILE 31 16.322 9.719 5.957 250 3HD1 ILE 31 3HD1 ILE 31 17.129 9.195 7.434 251 H THR 32 H THR 32 17.179 10.142 4.096 252 HA THR 32 HA THR 32 18.975 9.743 1.800 253 HB THR 32 HB THR 32 19.389 12.316 2.393 254 HG1 THR 32 HG1 THR 32 16.693 11.902 3.157 255 1HG2 THR 32 1HG2 THR 32 18.486 12.626 0.405 256 2HG2 THR 32 2HG2 THR 32 16.876 12.281 1.036 257 3HG2 THR 32 3HG2 THR 32 17.894 10.965 0.451 258 H TRP 33 H TRP 33 20.552 8.495 2.773 259 HA TRP 33 HA TRP 33 22.047 9.796 4.954 260 1HB TRP 33 1HB TRP 33 21.312 6.954 4.471 261 2HB TRP 33 2HB TRP 33 22.899 7.267 5.165 262 HD1 TRP 33 HD1 TRP 33 20.016 9.551 6.137 263 HE1 TRP 33 HE1 TRP 33 19.415 9.134 8.604 264 HE3 TRP 33 HE3 TRP 33 22.912 5.426 6.991 265 HZ2 TRP 33 HZ2 TRP 33 20.081 7.299 10.644 266 HZ3 TRP 33 HZ3 TRP 33 22.873 4.400 9.228 267 HH2 TRP 33 HH2 TRP 33 21.486 5.319 11.015 268 H HIS 34 H HIS 34 24.026 10.461 4.465 269 HA HIS 34 HA HIS 34 25.841 8.987 2.865 270 1HB HIS 34 1HB HIS 34 24.070 10.397 1.322 271 2HB HIS 34 2HB HIS 34 25.398 11.543 1.478 272 HD1 HIS 34 HD1 HIS 34 25.302 7.783 0.847 273 HD2 HIS 34 HD2 HIS 34 26.979 11.262 -0.684 274 HE1 HIS 34 HE1 HIS 34 26.732 7.045 -1.086 275 HE2 HIS 34 HE2 HIS 34 27.668 9.177 -2.051 276 H ALA 35 H ALA 35 24.991 12.286 3.890 277 HA ALA 35 HA ALA 35 27.723 13.080 4.219 278 1HB ALA 35 1HB ALA 35 26.049 14.734 3.672 279 2HB ALA 35 2HB ALA 35 26.764 15.112 5.239 280 3HB ALA 35 3HB ALA 35 25.165 14.374 5.155 281 H ARG 36 H ARG 36 25.184 11.865 6.327 282 HA ARG 36 HA ARG 36 25.201 11.108 8.471 283 1HB ARG 36 1HB ARG 36 27.377 10.022 7.361 284 2HB ARG 36 2HB ARG 36 28.172 11.010 8.580 285 1HG ARG 36 1HG ARG 36 26.078 9.722 9.911 286 2HG ARG 36 2HG ARG 36 26.802 8.501 8.864 287 1HD ARG 36 1HD ARG 36 28.166 10.179 10.960 288 2HD ARG 36 2HD ARG 36 27.942 8.430 10.959 289 HE ARG 36 HE ARG 36 29.402 9.196 8.675 290 1HH1 ARG 36 1HH1 ARG 36 29.752 8.915 12.136 291 2HH1 ARG 36 2HH1 ARG 36 31.460 8.642 12.067 292 1HH2 ARG 36 1HH2 ARG 36 31.649 8.836 8.582 293 2HH2 ARG 36 2HH2 ARG 36 32.537 8.597 10.050 294 H PHE 37 H PHE 37 25.375 13.959 7.947 295 HA PHE 37 HA PHE 37 26.019 14.817 10.615 296 1HB PHE 37 1HB PHE 37 28.196 14.874 9.189 297 2HB PHE 37 2HB PHE 37 27.468 16.288 8.433 298 HD1 PHE 37 HD1 PHE 37 27.004 18.304 9.772 299 HD2 PHE 37 HD2 PHE 37 29.095 14.967 11.384 300 HE1 PHE 37 HE1 PHE 37 27.824 19.714 11.615 301 HE2 PHE 37 HE2 PHE 37 29.918 16.370 13.230 302 HZ PHE 37 HZ PHE 37 29.282 18.746 13.348 303 H ALA 38 H ALA 38 23.793 15.319 10.597 304 HA ALA 38 HA ALA 38 22.719 17.173 8.679 305 1HB ALA 38 1HB ALA 38 21.016 15.853 9.390 306 2HB ALA 38 2HB ALA 38 20.836 17.151 10.569 307 3HB ALA 38 3HB ALA 38 21.686 15.669 11.010 308 H TYR 39 H TYR 39 22.839 19.314 8.756 309 HA TYR 39 HA TYR 39 24.211 20.691 10.797 310 1HB TYR 39 1HB TYR 39 23.114 21.295 8.227 311 2HB TYR 39 2HB TYR 39 22.576 22.527 9.363 312 HD1 TYR 39 HD1 TYR 39 25.113 21.649 7.138 313 HD2 TYR 39 HD2 TYR 39 24.527 23.416 10.963 314 HE1 TYR 39 HE1 TYR 39 27.298 22.761 6.952 315 HE2 TYR 39 HE2 TYR 39 26.710 24.534 10.788 316 HH TYR 39 HH TYR 39 29.015 23.710 8.451 317 H ASP 40 H ASP 40 23.425 22.294 12.258 318 HA ASP 40 HA ASP 40 20.702 21.714 13.207 319 1HB ASP 40 1HB ASP 40 23.264 22.220 14.555 320 2HB ASP 40 2HB ASP 40 21.908 23.109 15.242 321 HD2 ASP 40 HD2 ASP 40 20.580 20.268 16.638 322 H LYS 41 H LYS 41 19.207 23.203 12.851 323 HA LYS 41 HA LYS 41 19.750 26.002 13.220 324 1HB LYS 41 1HB LYS 41 20.301 25.138 10.723 325 2HB LYS 41 2HB LYS 41 18.585 25.485 10.548 326 1HG LYS 41 1HG LYS 41 19.514 27.713 11.845 327 2HG LYS 41 2HG LYS 41 20.853 27.299 10.773 328 1HD LYS 41 1HD LYS 41 19.487 27.446 8.851 329 2HD LYS 41 2HD LYS 41 18.008 27.461 9.813 330 1HE LYS 41 1HE LYS 41 18.262 29.661 10.419 331 2HE LYS 41 2HE LYS 41 20.013 29.622 10.229 332 1HZ LYS 41 1HZ LYS 41 17.960 29.792 8.102 333 2HZ LYS 41 2HZ LYS 41 19.575 29.410 7.777 334 3HZ LYS 41 3HZ LYS 41 19.182 30.906 8.462 335 H GLU 42 H GLU 42 17.669 27.280 12.464 336 HA GLU 42 HA GLU 42 15.329 25.706 13.319 337 1HB GLU 42 1HB GLU 42 16.416 27.719 14.752 338 2HB GLU 42 2HB GLU 42 15.301 28.635 13.748 339 1HG GLU 42 1HG GLU 42 14.218 26.219 15.050 340 2HG GLU 42 2HG GLU 42 14.632 27.570 16.104 341 HE2 GLU 42 HE2 GLU 42 11.561 27.958 13.635 342 H LYS 43 H LYS 43 13.295 26.282 12.414 343 HA LYS 43 HA LYS 43 11.872 26.855 10.738 344 1HB LYS 43 1HB LYS 43 13.778 29.118 10.817 345 2HB LYS 43 2HB LYS 43 12.832 28.961 9.343 346 1HG LYS 43 1HG LYS 43 10.785 28.862 10.818 347 2HG LYS 43 2HG LYS 43 11.835 29.350 12.149 348 1HD LYS 43 1HD LYS 43 12.526 31.220 10.379 349 2HD LYS 43 2HD LYS 43 10.890 30.898 9.801 350 1HE LYS 43 1HE LYS 43 9.914 31.736 11.678 351 2HE LYS 43 2HE LYS 43 11.250 31.251 12.721 352 1HZ LYS 43 1HZ LYS 43 12.383 33.160 12.314 353 2HZ LYS 43 2HZ LYS 43 10.815 33.757 12.100 354 3HZ LYS 43 3HZ LYS 43 11.757 33.355 10.754 355 H THR 44 H THR 44 14.867 27.874 9.131 356 HA THR 44 HA THR 44 15.253 25.515 7.640 357 HB THR 44 HB THR 44 13.150 26.139 6.567 358 HG1 THR 44 HG1 THR 44 15.317 26.705 4.835 359 1HG2 THR 44 1HG2 THR 44 12.976 28.147 5.190 360 2HG2 THR 44 2HG2 THR 44 14.524 28.708 5.823 361 3HG2 THR 44 3HG2 THR 44 13.140 28.533 6.903 362 H ASP 45 H ASP 45 17.056 25.635 6.260 363 HA ASP 45 HA ASP 45 18.635 28.096 6.596 364 1HB ASP 45 1HB ASP 45 19.384 25.697 7.430 365 2HB ASP 45 2HB ASP 45 19.883 25.516 5.751 366 HD2 ASP 45 HD2 ASP 45 22.799 26.921 7.023 367 H ARG 46 H ARG 46 17.602 25.662 4.267 368 HA ARG 46 HA ARG 46 17.523 27.450 2.112 369 1HB ARG 46 1HB ARG 46 19.415 26.432 0.764 370 2HB ARG 46 2HB ARG 46 19.890 27.510 2.070 371 1HG ARG 46 1HG ARG 46 21.241 25.914 2.794 372 2HG ARG 46 2HG ARG 46 19.811 24.974 3.223 373 1HD ARG 46 1HD ARG 46 19.849 23.792 1.189 374 2HD ARG 46 2HD ARG 46 20.968 24.937 0.452 375 HE ARG 46 HE ARG 46 22.040 23.572 2.745 376 1HH1 ARG 46 1HH1 ARG 46 21.566 23.433 -0.710 377 2HH1 ARG 46 2HH1 ARG 46 22.889 22.346 -0.973 378 1HH2 ARG 46 1HH2 ARG 46 23.780 22.143 2.399 379 2HH2 ARG 46 2HH2 ARG 46 24.144 21.613 0.792 380 H TYR 47 H TYR 47 18.021 24.101 3.107 381 HA TYR 47 HA TYR 47 16.080 23.284 1.045 382 1HB TYR 47 1HB TYR 47 18.736 22.213 1.697 383 2HB TYR 47 2HB TYR 47 17.478 20.985 1.598 384 HD1 TYR 47 HD1 TYR 47 15.785 21.673 -0.541 385 HD2 TYR 47 HD2 TYR 47 19.979 22.320 -0.235 386 HE1 TYR 47 HE1 TYR 47 15.955 21.692 -2.994 387 HE2 TYR 47 HE2 TYR 47 20.160 22.343 -2.688 388 HH TYR 47 HH TYR 47 17.458 22.565 -4.728 389 H ASN 48 H ASN 48 14.883 21.282 1.598 390 HA ASN 48 HA ASN 48 14.333 21.183 4.491 391 1HB ASN 48 1HB ASN 48 12.497 20.744 2.130 392 2HB ASN 48 2HB ASN 48 12.050 20.367 3.792 393 1HD2 ASN 48 1HD2 ASN 48 12.641 22.304 5.318 394 2HD2 ASN 48 2HD2 ASN 48 12.045 23.834 4.782 395 H GLU 49 H GLU 49 14.586 19.306 5.528 396 HA GLU 49 HA GLU 49 15.571 17.020 4.066 397 1HB GLU 49 1HB GLU 49 15.325 17.779 6.941 398 2HB GLU 49 2HB GLU 49 15.467 16.072 6.544 399 1HG GLU 49 1HG GLU 49 17.404 18.058 5.432 400 2HG GLU 49 2HG GLU 49 17.594 17.428 7.068 401 HE2 GLU 49 HE2 GLU 49 19.237 14.753 5.713 402 H ARG 50 H ARG 50 14.721 14.810 4.614 403 HA ARG 50 HA ARG 50 11.866 14.791 4.150 404 1HB ARG 50 1HB ARG 50 13.968 12.632 4.194 405 2HB ARG 50 2HB ARG 50 12.258 12.276 3.999 406 1HG ARG 50 1HG ARG 50 13.767 14.134 2.181 407 2HG ARG 50 2HG ARG 50 13.592 12.404 1.880 408 1HD ARG 50 1HD ARG 50 11.356 12.572 1.419 409 2HD ARG 50 2HD ARG 50 11.141 13.988 2.446 410 HE ARG 50 HE ARG 50 11.504 15.287 0.612 411 1HH1 ARG 50 1HH1 ARG 50 12.912 12.150 0.016 412 2HH1 ARG 50 2HH1 ARG 50 13.355 12.521 -1.617 413 1HH2 ARG 50 1HH2 ARG 50 12.086 15.777 -1.534 414 2HH2 ARG 50 2HH2 ARG 50 12.887 14.580 -2.497 415 HA PRO 51 HA PRO 51 10.677 14.318 8.410 416 1HB PRO 51 1HB PRO 51 8.461 12.714 7.235 417 2HB PRO 51 2HB PRO 51 8.392 14.082 8.351 418 1HG PRO 51 1HG PRO 51 7.757 14.391 5.785 419 2HG PRO 51 2HG PRO 51 8.655 15.646 6.659 420 1HD PRO 51 1HD PRO 51 9.639 13.639 4.677 421 2HD PRO 51 2HD PRO 51 10.135 15.326 4.918 422 H TRP 52 H TRP 52 9.530 12.301 9.652 423 HA TRP 52 HA TRP 52 11.045 9.877 8.954 424 1HB TRP 52 1HB TRP 52 11.780 11.471 11.020 425 2HB TRP 52 2HB TRP 52 10.640 10.408 11.837 426 HD1 TRP 52 HD1 TRP 52 13.622 9.881 9.387 427 HE1 TRP 52 HE1 TRP 52 14.989 7.874 10.240 428 HE3 TRP 52 HE3 TRP 52 10.808 8.660 13.477 429 HZ2 TRP 52 HZ2 TRP 52 14.887 6.018 12.365 430 HZ3 TRP 52 HZ3 TRP 52 11.511 6.754 14.866 431 HH2 TRP 52 HH2 TRP 52 13.508 5.461 14.320 432 H GLY 53 H GLY 53 8.489 10.104 8.149 433 1HA GLY 53 1HA GLY 53 6.477 9.362 9.944 434 2HA GLY 53 2HA GLY 53 6.458 9.039 8.217 435 H GLY 54 H GLY 54 5.258 7.225 9.755 436 1HA GLY 54 1HA GLY 54 6.293 4.803 9.065 437 2HA GLY 54 2HA GLY 54 7.052 5.144 10.612 438 H GLY 55 H GLY 55 4.984 3.133 9.657 439 1HA GLY 55 1HA GLY 55 3.297 3.377 12.013 440 2HA GLY 55 2HA GLY 55 2.453 3.422 10.472 441 H PHE 56 H PHE 56 1.491 1.488 11.714 442 HA PHE 56 HA PHE 56 2.956 -0.923 10.868 443 1HB PHE 56 1HB PHE 56 2.002 -2.107 12.819 444 2HB PHE 56 2HB PHE 56 3.058 -0.783 13.295 445 HD1 PHE 56 HD1 PHE 56 -0.235 -2.186 13.512 446 HD2 PHE 56 HD2 PHE 56 2.023 1.383 14.043 447 HE1 PHE 56 HE1 PHE 56 -2.040 -1.254 14.901 448 HE2 PHE 56 HE2 PHE 56 0.223 2.320 15.434 449 HZ PHE 56 HZ PHE 56 -1.812 1.000 15.866 450 H GLY 57 H GLY 57 1.356 -2.874 10.860 451 1HA GLY 57 1HA GLY 57 -1.346 -2.129 10.071 452 2HA GLY 57 2HA GLY 57 -0.336 -2.811 8.804 453 H LEU 58 H LEU 58 -2.788 -3.894 9.869 454 HA LEU 58 HA LEU 58 -1.794 -6.347 11.159 455 1HB LEU 58 1HB LEU 58 -4.238 -4.744 11.473 456 2HB LEU 58 2HB LEU 58 -4.517 -6.474 11.382 457 HG LEU 58 HG LEU 58 -2.999 -6.832 13.272 458 1HD1 LEU 58 1HD1 LEU 58 -2.581 -3.894 12.968 459 2HD1 LEU 58 2HD1 LEU 58 -1.402 -5.176 13.245 460 3HD1 LEU 58 3HD1 LEU 58 -2.444 -4.637 14.561 461 1HD2 LEU 58 1HD2 LEU 58 -4.592 -6.393 14.812 462 2HD2 LEU 58 2HD2 LEU 58 -5.542 -5.980 13.386 463 3HD2 LEU 58 3HD2 LEU 58 -4.759 -4.707 14.321 464 H SER 59 H SER 59 -3.442 -8.244 10.632 465 HA SER 59 HA SER 59 -4.183 -8.232 7.808 466 1HB SER 59 1HB SER 59 -2.003 -9.104 7.573 467 2HB SER 59 2HB SER 59 -2.135 -10.061 9.047 468 HG SER 59 HG SER 59 -3.781 -10.516 6.794 469 H ARG 60 H ARG 60 -5.701 -9.835 7.236 470 HA ARG 60 HA ARG 60 -6.702 -11.617 9.294 471 1HB ARG 60 1HB ARG 60 -7.883 -9.488 9.723 472 2HB ARG 60 2HB ARG 60 -8.481 -9.502 8.070 473 1HG ARG 60 1HG ARG 60 -9.665 -11.610 8.542 474 2HG ARG 60 2HG ARG 60 -9.115 -11.514 10.217 475 1HD ARG 60 1HD ARG 60 -10.559 -9.843 10.738 476 2HD ARG 60 2HD ARG 60 -10.477 -9.124 9.130 477 HE ARG 60 HE ARG 60 -12.278 -10.395 8.503 478 1HH1 ARG 60 1HH1 ARG 60 -11.004 -11.632 11.508 479 2HH1 ARG 60 2HH1 ARG 60 -12.326 -12.721 11.764 480 1HH2 ARG 60 1HH2 ARG 60 -14.018 -11.826 8.840 481 2HH2 ARG 60 2HH2 ARG 60 -14.036 -12.831 10.250 482 H TRP 61 H TRP 61 -7.689 -13.406 8.475 483 HA TRP 61 HA TRP 61 -7.581 -13.720 5.581 484 1HB TRP 61 1HB TRP 61 -8.028 -16.135 6.116 485 2HB TRP 61 2HB TRP 61 -6.551 -15.491 6.824 486 HD1 TRP 61 HD1 TRP 61 -6.458 -15.260 9.479 487 HE1 TRP 61 HE1 TRP 61 -7.893 -16.286 11.355 488 HE3 TRP 61 HE3 TRP 61 -10.433 -16.853 6.685 489 HZ2 TRP 61 HZ2 TRP 61 -10.380 -17.596 11.615 490 HZ3 TRP 61 HZ3 TRP 61 -12.297 -17.984 7.824 491 HH2 TRP 61 HH2 TRP 61 -12.270 -18.347 10.238 492 H ASP 62 H ASP 62 -9.310 -13.823 4.286 493 HA ASP 62 HA ASP 62 -11.965 -13.745 5.550 494 1HB ASP 62 1HB ASP 62 -10.780 -12.370 3.216 495 2HB ASP 62 2HB ASP 62 -12.441 -12.915 3.016 496 HD2 ASP 62 HD2 ASP 62 -11.892 -10.317 5.972 497 H GLU 63 H GLU 63 -13.335 -15.363 5.220 498 HA GLU 63 HA GLU 63 -12.642 -17.757 4.013 499 1HB GLU 63 1HB GLU 63 -14.475 -17.433 5.668 500 2HB GLU 63 2HB GLU 63 -15.449 -16.708 4.397 501 1HG GLU 63 1HG GLU 63 -16.243 -18.769 4.107 502 2HG GLU 63 2HG GLU 63 -14.730 -19.065 3.250 503 HE2 GLU 63 HE2 GLU 63 -13.696 -20.365 6.621 504 H LYS 64 H LYS 64 -13.830 -14.864 2.556 505 HA LYS 64 HA LYS 64 -14.638 -16.227 0.113 506 1HB LYS 64 1HB LYS 64 -14.533 -13.250 0.568 507 2HB LYS 64 2HB LYS 64 -15.481 -14.130 -0.623 508 1HG LYS 64 1HG LYS 64 -16.905 -15.025 1.094 509 2HG LYS 64 2HG LYS 64 -15.894 -14.314 2.354 510 1HD LYS 64 1HD LYS 64 -17.280 -12.675 0.243 511 2HD LYS 64 2HD LYS 64 -18.021 -13.063 1.797 512 1HE LYS 64 1HE LYS 64 -16.701 -11.628 2.934 513 2HE LYS 64 2HE LYS 64 -15.291 -11.965 1.929 514 1HZ LYS 64 1HZ LYS 64 -17.446 -10.015 1.513 515 2HZ LYS 64 2HZ LYS 64 -16.662 -10.661 0.162 516 3HZ LYS 64 3HZ LYS 64 -15.774 -9.824 1.334 517 H GLY 65 H GLY 65 -11.800 -16.179 1.045 518 1HA GLY 65 1HA GLY 65 -9.735 -16.058 0.057 519 2HA GLY 65 2HA GLY 65 -10.575 -15.799 -1.466 520 H ASN 66 H ASN 66 -10.312 -13.885 1.530 521 HA ASN 66 HA ASN 66 -9.138 -11.713 -0.068 522 1HB ASN 66 1HB ASN 66 -11.662 -11.708 1.434 523 2HB ASN 66 2HB ASN 66 -10.601 -10.355 1.818 524 1HD2 ASN 66 1HD2 ASN 66 -11.569 -8.712 0.815 525 2HD2 ASN 66 2HD2 ASN 66 -11.910 -8.644 -0.877 526 H TRP 67 H TRP 67 -7.919 -10.150 1.174 527 HA TRP 67 HA TRP 67 -7.046 -11.132 3.806 528 1HB TRP 67 1HB TRP 67 -5.361 -10.429 1.423 529 2HB TRP 67 2HB TRP 67 -4.716 -10.243 3.052 530 HD1 TRP 67 HD1 TRP 67 -5.911 -12.947 0.602 531 HE1 TRP 67 HE1 TRP 67 -4.970 -15.215 1.370 532 HE3 TRP 67 HE3 TRP 67 -3.866 -11.509 5.061 533 HZ2 TRP 67 HZ2 TRP 67 -3.548 -16.257 3.575 534 HZ3 TRP 67 HZ3 TRP 67 -2.733 -13.202 6.439 535 HH2 TRP 67 HH2 TRP 67 -2.579 -15.528 5.710 536 H HIS 68 H HIS 68 -8.249 -9.543 4.853 537 HA HIS 68 HA HIS 68 -8.113 -6.785 4.170 538 1HB HIS 68 1HB HIS 68 -9.057 -8.231 6.646 539 2HB HIS 68 2HB HIS 68 -9.137 -6.480 6.475 540 HD1 HIS 68 HD1 HIS 68 -10.021 -9.097 3.872 541 HD2 HIS 68 HD2 HIS 68 -11.805 -6.086 6.112 542 HE1 HIS 68 HE1 HIS 68 -12.379 -8.927 3.013 543 HE2 HIS 68 HE2 HIS 68 -13.463 -7.156 4.439 544 H GLY 69 H GLY 69 -6.820 -5.178 4.913 545 1HA GLY 69 1HA GLY 69 -4.828 -5.868 6.973 546 2HA GLY 69 2HA GLY 69 -4.315 -5.149 5.454 547 H LEU 70 H LEU 70 -4.540 -4.366 8.490 548 HA LEU 70 HA LEU 70 -6.014 -1.873 8.262 549 1HB LEU 70 1HB LEU 70 -5.720 -3.535 10.332 550 2HB LEU 70 2HB LEU 70 -4.354 -2.482 10.648 551 HG LEU 70 HG LEU 70 -6.405 -1.831 11.876 552 1HD1 LEU 70 1HD1 LEU 70 -4.556 -0.235 10.718 553 2HD1 LEU 70 2HD1 LEU 70 -5.833 0.340 11.790 554 3HD1 LEU 70 3HD1 LEU 70 -6.042 0.434 10.041 555 1HD2 LEU 70 1HD2 LEU 70 -7.886 -2.518 9.882 556 2HD2 LEU 70 2HD2 LEU 70 -7.542 -0.901 9.265 557 3HD2 LEU 70 3HD2 LEU 70 -8.344 -1.098 10.823 558 H TYR 71 H TYR 71 -5.127 0.164 8.292 559 HA TYR 71 HA TYR 71 -2.193 0.320 8.081 560 1HB TYR 71 1HB TYR 71 -4.299 1.326 6.266 561 2HB TYR 71 2HB TYR 71 -2.988 2.452 6.603 562 HD1 TYR 71 HD1 TYR 71 -3.123 -1.245 6.040 563 HD2 TYR 71 HD2 TYR 71 -1.496 2.501 4.849 564 HE1 TYR 71 HE1 TYR 71 -1.721 -2.390 4.375 565 HE2 TYR 71 HE2 TYR 71 -0.091 1.367 3.180 566 HH TYR 71 HH TYR 71 0.883 -1.182 3.020 567 H ALA 72 H ALA 72 -1.352 1.475 9.672 568 HA ALA 72 HA ALA 72 -2.676 3.933 10.529 569 1HB ALA 72 1HB ALA 72 -1.948 3.075 12.953 570 2HB ALA 72 2HB ALA 72 -2.308 1.522 12.202 571 3HB ALA 72 3HB ALA 72 -3.546 2.775 12.272 572 H MET 73 H MET 73 -1.160 5.409 10.135 573 HA MET 73 HA MET 73 1.507 5.002 11.275 574 1HB MET 73 1HB MET 73 2.582 5.883 9.262 575 2HB MET 73 2HB MET 73 1.688 4.412 8.905 576 1HG MET 73 1HG MET 73 0.229 5.463 7.553 577 2HG MET 73 2HG MET 73 0.213 6.931 8.529 578 1HE MET 73 1HE MET 73 1.611 9.114 5.914 579 2HE MET 73 2HE MET 73 0.649 8.911 7.377 580 3HE MET 73 3HE MET 73 0.142 8.140 5.875 581 H ALA 74 H ALA 74 2.786 7.198 10.916 582 HA ALA 74 HA ALA 74 1.071 9.530 11.156 583 1HB ALA 74 1HB ALA 74 0.982 9.246 13.400 584 2HB ALA 74 2HB ALA 74 2.554 10.040 13.324 585 3HB ALA 74 3HB ALA 74 2.459 8.284 13.448 586 H PHE 75 H PHE 75 2.056 11.380 10.501 587 HA PHE 75 HA PHE 75 4.907 11.168 9.787 588 1HB PHE 75 1HB PHE 75 4.319 13.007 8.109 589 2HB PHE 75 2HB PHE 75 3.703 11.393 7.769 590 HD1 PHE 75 HD1 PHE 75 2.792 14.739 9.023 591 HD2 PHE 75 HD2 PHE 75 1.385 10.964 7.654 592 HE1 PHE 75 HE1 PHE 75 0.510 15.648 8.877 593 HE2 PHE 75 HE2 PHE 75 -0.900 11.866 7.504 594 HZ PHE 75 HZ PHE 75 -1.340 14.211 8.116 595 H LYS 76 H LYS 76 6.253 12.420 10.881 596 HA LYS 76 HA LYS 76 5.178 14.827 12.198 597 1HB LYS 76 1HB LYS 76 7.001 14.555 13.847 598 2HB LYS 76 2HB LYS 76 5.907 13.179 13.820 599 1HG LYS 76 1HG LYS 76 8.323 13.030 12.115 600 2HG LYS 76 2HG LYS 76 8.540 12.900 13.861 601 1HD LYS 76 1HD LYS 76 6.357 11.286 12.704 602 2HD LYS 76 2HD LYS 76 7.994 10.803 12.258 603 1HE LYS 76 1HE LYS 76 7.616 11.395 15.108 604 2HE LYS 76 2HE LYS 76 6.702 10.008 14.515 605 1HZ LYS 76 1HZ LYS 76 9.628 10.410 14.536 606 2HZ LYS 76 2HZ LYS 76 8.910 9.283 13.500 607 3HZ LYS 76 3HZ LYS 76 8.732 9.124 15.175 608 H ASP 77 H ASP 77 6.228 16.755 11.971 609 HA ASP 77 HA ASP 77 8.551 16.779 10.155 610 1HB ASP 77 1HB ASP 77 6.169 18.619 10.295 611 2HB ASP 77 2HB ASP 77 7.675 19.114 9.527 612 HD2 ASP 77 HD2 ASP 77 7.130 17.022 6.808 613 H SER 78 H SER 78 9.811 18.890 10.337 614 HA SER 78 HA SER 78 10.688 19.168 13.033 615 1HB SER 78 1HB SER 78 11.418 20.572 10.465 616 2HB SER 78 2HB SER 78 12.133 21.023 12.012 617 HG SER 78 HG SER 78 13.447 19.507 11.021 618 H TRP 79 H TRP 79 8.525 20.956 10.968 619 HA TRP 79 HA TRP 79 8.135 22.917 13.133 620 1HB TRP 79 1HB TRP 79 9.041 23.633 10.753 621 2HB TRP 79 2HB TRP 79 7.337 23.542 10.321 622 HD1 TRP 79 HD1 TRP 79 6.331 25.884 10.366 623 HE1 TRP 79 HE1 TRP 79 6.531 27.958 11.877 624 HE3 TRP 79 HE3 TRP 79 9.835 24.154 13.662 625 HZ2 TRP 79 HZ2 TRP 79 7.982 28.755 14.164 626 HZ3 TRP 79 HZ3 TRP 79 10.576 25.635 15.483 627 HH2 TRP 79 HH2 TRP 79 9.667 27.888 15.727 628 H ASN 80 H ASN 80 6.570 21.047 10.573 629 HA ASN 80 HA ASN 80 3.918 21.733 11.431 630 1HB ASN 80 1HB ASN 80 5.120 20.024 9.322 631 2HB ASN 80 2HB ASN 80 3.500 19.591 9.861 632 1HD2 ASN 80 1HD2 ASN 80 2.278 21.910 10.300 633 2HD2 ASN 80 2HD2 ASN 80 2.206 22.864 8.861 634 H LYS 81 H LYS 81 2.920 20.902 13.129 635 HA LYS 81 HA LYS 81 3.919 18.933 14.800 636 1HB LYS 81 1HB LYS 81 1.259 20.211 14.429 637 2HB LYS 81 2HB LYS 81 1.322 18.743 15.397 638 1HG LYS 81 1HG LYS 81 3.362 20.114 16.490 639 2HG LYS 81 2HG LYS 81 2.323 21.447 15.984 640 1HD LYS 81 1HD LYS 81 0.497 20.615 17.267 641 2HD LYS 81 2HD LYS 81 1.334 19.094 17.584 642 1HE LYS 81 1HE LYS 81 3.125 20.859 18.572 643 2HE LYS 81 2HE LYS 81 1.619 21.725 18.878 644 1HZ LYS 81 1HZ LYS 81 1.740 18.898 19.615 645 2HZ LYS 81 2HZ LYS 81 0.919 20.174 20.362 646 3HZ LYS 81 3HZ LYS 81 2.586 19.997 20.584 647 H TRP 82 H TRP 82 3.635 16.754 15.024 648 HA TRP 82 HA TRP 82 3.225 15.207 12.729 649 1HB TRP 82 1HB TRP 82 3.253 13.268 14.254 650 2HB TRP 82 2HB TRP 82 4.550 14.405 14.614 651 HD1 TRP 82 HD1 TRP 82 1.232 13.105 16.032 652 HE1 TRP 82 HE1 TRP 82 1.123 13.703 18.533 653 HE3 TRP 82 HE3 TRP 82 5.410 16.033 16.351 654 HZ2 TRP 82 HZ2 TRP 82 2.611 15.217 20.395 655 HZ3 TRP 82 HZ3 TRP 82 5.998 17.019 18.527 656 HH2 TRP 82 HH2 TRP 82 4.624 16.618 20.506 657 H GLU 83 H GLU 83 1.559 13.708 12.206 658 HA GLU 83 HA GLU 83 -1.000 14.020 13.561 659 1HB GLU 83 1HB GLU 83 -0.390 14.994 10.824 660 2HB GLU 83 2HB GLU 83 -1.926 14.170 11.047 661 1HG GLU 83 1HG GLU 83 -1.330 16.195 13.075 662 2HG GLU 83 2HG GLU 83 -1.505 16.821 11.437 663 HE2 GLU 83 HE2 GLU 83 -4.906 16.494 11.583 664 HA PRO 84 HA PRO 84 -0.840 9.673 12.503 665 1HB PRO 84 1HB PRO 84 -2.943 8.866 13.949 666 2HB PRO 84 2HB PRO 84 -1.438 9.376 14.722 667 1HG PRO 84 1HG PRO 84 -3.991 10.893 14.362 668 2HG PRO 84 2HG PRO 84 -2.928 10.809 15.779 669 1HD PRO 84 1HD PRO 84 -2.924 12.872 13.956 670 2HD PRO 84 2HD PRO 84 -1.537 12.436 14.974 671 H ILE 85 H ILE 85 -2.361 8.028 11.607 672 HA ILE 85 HA ILE 85 -4.776 8.990 10.348 673 HB ILE 85 HB ILE 85 -3.058 9.747 8.756 674 1HG1 ILE 85 1HG1 ILE 85 -4.616 7.392 7.672 675 2HG1 ILE 85 2HG1 ILE 85 -5.313 8.977 7.996 676 1HG2 ILE 85 1HG2 ILE 85 -1.629 8.228 7.590 677 2HG2 ILE 85 2HG2 ILE 85 -2.373 6.839 8.382 678 3HG2 ILE 85 3HG2 ILE 85 -1.402 7.973 9.320 679 1HD1 ILE 85 1HD1 ILE 85 -4.146 9.977 6.255 680 2HD1 ILE 85 2HD1 ILE 85 -4.622 8.410 5.599 681 3HD1 ILE 85 3HD1 ILE 85 -2.972 8.665 6.163 682 H ALA 86 H ALA 86 -6.205 7.392 10.450 683 HA ALA 86 HA ALA 86 -5.220 4.615 10.347 684 1HB ALA 86 1HB ALA 86 -6.052 5.536 12.615 685 2HB ALA 86 2HB ALA 86 -6.620 3.956 12.076 686 3HB ALA 86 3HB ALA 86 -7.659 5.372 11.908 687 H GLY 87 H GLY 87 -6.436 3.123 9.218 688 1HA GLY 87 1HA GLY 87 -9.035 3.683 8.187 689 2HA GLY 87 2HA GLY 87 -7.802 3.935 6.959 690 H TYR 88 H TYR 88 -9.518 2.116 6.262 691 HA TYR 88 HA TYR 88 -8.245 -0.469 6.886 692 1HB TYR 88 1HB TYR 88 -11.102 0.304 6.613 693 2HB TYR 88 2HB TYR 88 -10.634 -1.264 5.963 694 HD1 TYR 88 HD1 TYR 88 -10.033 -3.080 7.415 695 HD2 TYR 88 HD2 TYR 88 -10.888 0.765 9.021 696 HE1 TYR 88 HE1 TYR 88 -10.157 -4.056 9.669 697 HE2 TYR 88 HE2 TYR 88 -11.014 -0.200 11.279 698 HH TYR 88 HH TYR 88 -11.212 -3.517 11.854 699 H GLY 89 H GLY 89 -8.011 -1.970 5.172 700 1HA GLY 89 1HA GLY 89 -8.621 -1.095 2.466 701 2HA GLY 89 2HA GLY 89 -6.912 -1.199 2.860 702 H TRP 90 H TRP 90 -8.231 -2.712 0.851 703 HA TRP 90 HA TRP 90 -8.083 -5.427 1.990 704 1HB TRP 90 1HB TRP 90 -9.494 -4.588 -0.551 705 2HB TRP 90 2HB TRP 90 -9.541 -6.176 0.210 706 HD1 TRP 90 HD1 TRP 90 -11.318 -6.564 2.076 707 HE1 TRP 90 HE1 TRP 90 -13.181 -5.115 3.105 708 HE3 TRP 90 HE3 TRP 90 -10.022 -2.038 0.084 709 HZ2 TRP 90 HZ2 TRP 90 -13.993 -2.413 3.075 710 HZ3 TRP 90 HZ3 TRP 90 -11.395 -0.071 0.632 711 HH2 TRP 90 HH2 TRP 90 -13.339 -0.256 2.097 712 H GLU 91 H GLU 91 -6.904 -7.007 0.898 713 HA GLU 91 HA GLU 91 -5.388 -6.235 -1.466 714 1HB GLU 91 1HB GLU 91 -4.157 -6.904 1.197 715 2HB GLU 91 2HB GLU 91 -3.281 -7.154 -0.308 716 1HG GLU 91 1HG GLU 91 -3.227 -4.866 -0.789 717 2HG GLU 91 2HG GLU 91 -4.486 -4.500 0.390 718 HE2 GLU 91 HE2 GLU 91 -0.860 -4.163 1.565 719 H SER 92 H SER 92 -4.453 -8.013 -2.587 720 HA SER 92 HA SER 92 -5.385 -10.659 -1.698 721 1HB SER 92 1HB SER 92 -5.639 -11.073 -4.276 722 2HB SER 92 2HB SER 92 -6.925 -10.253 -3.391 723 HG SER 92 HG SER 92 -5.166 -9.269 -5.291 724 H THR 93 H THR 93 -3.663 -11.882 -1.337 725 HA THR 93 HA THR 93 -1.129 -11.322 -2.598 726 HB THR 93 HB THR 93 -0.228 -13.026 -1.152 727 HG1 THR 93 HG1 THR 93 -2.900 -13.670 -0.461 728 1HG2 THR 93 1HG2 THR 93 -0.322 -11.613 0.537 729 2HG2 THR 93 2HG2 THR 93 -1.900 -12.269 0.971 730 3HG2 THR 93 3HG2 THR 93 -1.789 -10.883 -0.114 731 H TRP 94 H TRP 94 -0.022 -12.607 -4.041 732 HA TRP 94 HA TRP 94 -1.456 -14.918 -5.151 733 1HB TRP 94 1HB TRP 94 -1.123 -12.436 -6.453 734 2HB TRP 94 2HB TRP 94 0.004 -13.548 -7.225 735 HD1 TRP 94 HD1 TRP 94 -1.051 -15.663 -8.516 736 HE1 TRP 94 HE1 TRP 94 -3.398 -16.060 -9.496 737 HE3 TRP 94 HE3 TRP 94 -3.583 -11.946 -6.086 738 HZ2 TRP 94 HZ2 TRP 94 -5.981 -14.944 -9.267 739 HZ3 TRP 94 HZ3 TRP 94 -5.989 -11.678 -6.523 740 HH2 TRP 94 HH2 TRP 94 -7.162 -13.147 -8.082 741 H ARG 95 H ARG 95 -0.112 -16.470 -6.225 742 HA ARG 95 HA ARG 95 2.600 -16.505 -5.128 743 1HB ARG 95 1HB ARG 95 0.961 -18.707 -6.395 744 2HB ARG 95 2HB ARG 95 2.569 -18.908 -5.714 745 1HG ARG 95 1HG ARG 95 1.808 -18.537 -3.525 746 2HG ARG 95 2HG ARG 95 0.267 -17.883 -4.086 747 1HD ARG 95 1HD ARG 95 0.080 -20.182 -3.194 748 2HD ARG 95 2HD ARG 95 -0.417 -20.051 -4.880 749 HE ARG 95 HE ARG 95 2.332 -20.817 -4.538 750 1HH1 ARG 95 1HH1 ARG 95 -0.957 -21.968 -4.738 751 2HH1 ARG 95 2HH1 ARG 95 -0.501 -23.559 -5.246 752 1HH2 ARG 95 1HH2 ARG 95 2.933 -22.910 -5.206 753 2HH2 ARG 95 2HH2 ARG 95 1.707 -24.095 -5.512 754 HA PRO 96 HA PRO 96 4.416 -15.693 -9.079 755 1HB PRO 96 1HB PRO 96 6.877 -16.751 -8.699 756 2HB PRO 96 2HB PRO 96 6.356 -15.252 -7.919 757 1HG PRO 96 1HG PRO 96 6.464 -18.028 -6.804 758 2HG PRO 96 2HG PRO 96 6.952 -16.500 -6.049 759 1HD PRO 96 1HD PRO 96 4.583 -17.714 -5.516 760 2HD PRO 96 2HD PRO 96 4.793 -15.951 -5.469 761 H LEU 97 H LEU 97 6.175 -17.100 -10.526 762 HA LEU 97 HA LEU 97 4.896 -19.721 -10.950 763 1HB LEU 97 1HB LEU 97 5.366 -17.485 -12.801 764 2HB LEU 97 2HB LEU 97 5.842 -19.054 -13.421 765 HG LEU 97 HG LEU 97 3.093 -18.370 -12.378 766 1HD1 LEU 97 1HD1 LEU 97 2.361 -18.251 -14.611 767 2HD1 LEU 97 2HD1 LEU 97 3.883 -18.892 -15.229 768 3HD1 LEU 97 3HD1 LEU 97 3.824 -17.269 -14.542 769 1HD2 LEU 97 1HD2 LEU 97 3.430 -20.674 -12.037 770 2HD2 LEU 97 2HD2 LEU 97 4.284 -20.859 -13.569 771 3HD2 LEU 97 3HD2 LEU 97 2.548 -20.551 -13.559 772 H ALA 98 H ALA 98 7.837 -17.795 -11.400 773 HA ALA 98 HA ALA 98 9.383 -20.297 -11.542 774 1HB ALA 98 1HB ALA 98 11.120 -19.051 -12.658 775 2HB ALA 98 2HB ALA 98 10.240 -17.542 -12.418 776 3HB ALA 98 3HB ALA 98 9.587 -18.784 -13.487 777 H ASP 99 H ASP 99 8.499 -19.456 -9.045 778 HA ASP 99 HA ASP 99 10.966 -19.299 -7.632 779 1HB ASP 99 1HB ASP 99 9.382 -16.830 -8.036 780 2HB ASP 99 2HB ASP 99 9.937 -17.129 -6.392 781 HD2 ASP 99 HD2 ASP 99 13.252 -16.575 -7.265 782 H GLU 100 H GLU 100 10.690 -19.516 -5.324 783 HA GLU 100 HA GLU 100 8.017 -20.523 -4.603 784 1HB GLU 100 1HB GLU 100 10.191 -22.062 -4.744 785 2HB GLU 100 2HB GLU 100 10.423 -21.443 -3.114 786 1HG GLU 100 1HG GLU 100 9.269 -23.497 -2.926 787 2HG GLU 100 2HG GLU 100 8.106 -22.217 -2.583 788 HE2 GLU 100 HE2 GLU 100 6.651 -24.592 -4.947 789 H ASN 101 H ASN 101 10.811 -18.673 -3.561 790 HA ASN 101 HA ASN 101 9.414 -17.924 -1.094 791 1HB ASN 101 1HB ASN 101 12.267 -18.001 -1.929 792 2HB ASN 101 2HB ASN 101 11.797 -16.746 -0.786 793 1HD2 ASN 101 1HD2 ASN 101 12.166 -17.304 1.220 794 2HD2 ASN 101 2HD2 ASN 101 12.011 -18.890 1.889 795 H PHE 102 H PHE 102 8.521 -16.901 -3.614 796 HA PHE 102 HA PHE 102 9.124 -14.042 -3.232 797 1HB PHE 102 1HB PHE 102 9.832 -15.384 -5.454 798 2HB PHE 102 2HB PHE 102 8.187 -14.941 -5.900 799 HD1 PHE 102 HD1 PHE 102 11.492 -13.956 -6.104 800 HD2 PHE 102 HD2 PHE 102 7.622 -12.379 -5.300 801 HE1 PHE 102 HE1 PHE 102 12.278 -11.713 -6.741 802 HE2 PHE 102 HE2 PHE 102 8.401 -10.134 -5.935 803 HZ PHE 102 HZ PHE 102 10.731 -9.798 -6.657 804 H HIS 103 H HIS 103 7.419 -12.637 -3.194 805 HA HIS 103 HA HIS 103 4.731 -13.810 -3.479 806 1HB HIS 103 1HB HIS 103 5.540 -11.693 -1.477 807 2HB HIS 103 2HB HIS 103 3.959 -12.457 -1.621 808 HD1 HIS 103 HD1 HIS 103 7.503 -13.238 -0.582 809 HD2 HIS 103 HD2 HIS 103 3.680 -14.833 -0.268 810 HE1 HIS 103 HE1 HIS 103 7.706 -15.157 1.030 811 HE2 HIS 103 HE2 HIS 103 5.364 -16.051 1.272 812 H LEU 104 H LEU 104 3.146 -12.542 -4.412 813 HA LEU 104 HA LEU 104 3.711 -9.803 -5.156 814 1HB LEU 104 1HB LEU 104 3.330 -10.212 -7.568 815 2HB LEU 104 2HB LEU 104 4.816 -10.921 -6.966 816 HG LEU 104 HG LEU 104 2.390 -12.647 -7.074 817 1HD1 LEU 104 1HD1 LEU 104 3.381 -13.189 -9.479 818 2HD1 LEU 104 2HD1 LEU 104 3.770 -11.470 -9.417 819 3HD1 LEU 104 3HD1 LEU 104 2.099 -12.003 -9.232 820 1HD2 LEU 104 1HD2 LEU 104 4.031 -14.365 -7.532 821 2HD2 LEU 104 2HD2 LEU 104 4.516 -13.439 -6.113 822 3HD2 LEU 104 3HD2 LEU 104 5.304 -13.152 -7.664 823 H GLY 105 H GLY 105 1.888 -8.643 -5.124 824 1HA GLY 105 1HA GLY 105 -0.640 -9.760 -5.945 825 2HA GLY 105 2HA GLY 105 -0.523 -9.496 -4.211 826 H LEU 106 H LEU 106 -2.476 -8.152 -5.241 827 HA LEU 106 HA LEU 106 -1.517 -5.392 -5.263 828 1HB LEU 106 1HB LEU 106 -3.271 -6.645 -7.361 829 2HB LEU 106 2HB LEU 106 -3.258 -4.915 -7.073 830 HG LEU 106 HG LEU 106 -0.627 -5.292 -7.398 831 1HD1 LEU 106 1HD1 LEU 106 -0.419 -7.527 -7.865 832 2HD1 LEU 106 2HD1 LEU 106 -0.584 -6.864 -9.491 833 3HD1 LEU 106 3HD1 LEU 106 -1.972 -7.610 -8.698 834 1HD2 LEU 106 1HD2 LEU 106 -1.051 -4.763 -9.850 835 2HD2 LEU 106 2HD2 LEU 106 -1.761 -3.669 -8.663 836 3HD2 LEU 106 3HD2 LEU 106 -2.768 -4.875 -9.463 837 H GLY 107 H GLY 107 -3.410 -3.835 -5.047 838 1HA GLY 107 1HA GLY 107 -5.946 -4.558 -4.204 839 2HA GLY 107 2HA GLY 107 -4.933 -4.596 -2.767 840 H PHE 108 H PHE 108 -6.682 -2.900 -2.281 841 HA PHE 108 HA PHE 108 -5.573 -0.268 -2.985 842 1HB PHE 108 1HB PHE 108 -8.522 -0.768 -2.592 843 2HB PHE 108 2HB PHE 108 -7.746 0.685 -3.212 844 HD1 PHE 108 HD1 PHE 108 -8.337 -2.897 -3.981 845 HD2 PHE 108 HD2 PHE 108 -7.438 0.976 -5.498 846 HE1 PHE 108 HE1 PHE 108 -8.614 -3.737 -6.277 847 HE2 PHE 108 HE2 PHE 108 -7.714 0.143 -7.797 848 HZ PHE 108 HZ PHE 108 -8.303 -2.215 -8.189 849 H THR 109 H THR 109 -5.333 1.149 -1.331 850 HA THR 109 HA THR 109 -6.182 0.221 1.333 851 HB THR 109 HB THR 109 -3.855 2.014 0.613 852 HG1 THR 109 HG1 THR 109 -2.618 0.196 1.231 853 1HG2 THR 109 1HG2 THR 109 -5.110 1.416 3.148 854 2HG2 THR 109 2HG2 THR 109 -3.876 2.610 2.746 855 3HG2 THR 109 3HG2 THR 109 -3.410 0.950 3.115 856 H ALA 110 H ALA 110 -7.509 1.466 2.495 857 HA ALA 110 HA ALA 110 -8.055 4.189 1.506 858 1HB ALA 110 1HB ALA 110 -9.981 2.571 3.143 859 2HB ALA 110 2HB ALA 110 -9.891 2.408 1.389 860 3HB ALA 110 3HB ALA 110 -10.304 3.964 2.110 861 H GLY 111 H GLY 111 -7.193 5.697 2.768 862 1HA GLY 111 1HA GLY 111 -6.915 5.142 5.647 863 2HA GLY 111 2HA GLY 111 -5.962 6.310 4.743 864 H VAL 112 H VAL 112 -7.682 6.518 7.199 865 HA VAL 112 HA VAL 112 -9.483 8.650 6.246 866 HB VAL 112 HB VAL 112 -9.754 7.128 8.837 867 1HG1 VAL 112 1HG1 VAL 112 -10.758 9.339 8.862 868 2HG1 VAL 112 2HG1 VAL 112 -12.010 8.097 8.850 869 3HG1 VAL 112 3HG1 VAL 112 -11.629 8.980 7.372 870 1HG2 VAL 112 1HG2 VAL 112 -11.668 5.988 7.720 871 2HG2 VAL 112 2HG2 VAL 112 -10.091 5.552 7.062 872 3HG2 VAL 112 3HG2 VAL 112 -11.128 6.683 6.192 873 H THR 113 H THR 113 -9.053 10.661 6.883 874 HA THR 113 HA THR 113 -7.023 11.050 8.970 875 HB THR 113 HB THR 113 -7.996 13.068 6.945 876 HG1 THR 113 HG1 THR 113 -5.835 11.247 6.818 877 1HG2 THR 113 1HG2 THR 113 -6.884 14.245 8.627 878 2HG2 THR 113 2HG2 THR 113 -5.675 14.004 7.367 879 3HG2 THR 113 3HG2 THR 113 -5.656 12.993 8.812 880 H ALA 114 H ALA 114 -7.798 11.506 10.915 881 HA ALA 114 HA ALA 114 -10.107 13.322 11.114 882 1HB ALA 114 1HB ALA 114 -11.257 11.964 12.503 883 2HB ALA 114 2HB ALA 114 -9.799 11.329 13.265 884 3HB ALA 114 3HB ALA 114 -10.319 10.705 11.699 885 H ARG 115 H ARG 115 -9.651 15.104 12.216 886 HA ARG 115 HA ARG 115 -7.171 15.454 13.561 887 1HB ARG 115 1HB ARG 115 -9.610 17.122 13.124 888 2HB ARG 115 2HB ARG 115 -8.460 17.620 14.356 889 1HG ARG 115 1HG ARG 115 -6.886 18.210 12.846 890 2HG ARG 115 2HG ARG 115 -7.341 16.938 11.710 891 1HD ARG 115 1HD ARG 115 -9.549 18.463 11.599 892 2HD ARG 115 2HD ARG 115 -8.354 19.700 11.981 893 HE ARG 115 HE ARG 115 -7.637 19.554 9.830 894 1HH1 ARG 115 1HH1 ARG 115 -9.172 16.532 10.659 895 2HH1 ARG 115 2HH1 ARG 115 -8.991 15.861 9.073 896 1HH2 ARG 115 1HH2 ARG 115 -7.397 18.673 7.743 897 2HH2 ARG 115 2HH2 ARG 115 -7.983 17.075 7.417 898 H ASP 116 H ASP 116 -6.805 15.888 15.780 899 HA ASP 116 HA ASP 116 -8.663 14.459 17.536 900 1HB ASP 116 1HB ASP 116 -5.736 15.090 17.675 901 2HB ASP 116 2HB ASP 116 -6.622 14.719 19.152 902 HD2 ASP 116 HD2 ASP 116 -6.158 11.405 18.484 903 H ASN 117 H ASN 117 -7.196 17.584 17.012 904 HA ASN 117 HA ASN 117 -8.599 18.631 19.378 905 1HB ASN 117 1HB ASN 117 -5.958 18.997 18.521 906 2HB ASN 117 2HB ASN 117 -6.772 20.512 18.144 907 1HD2 ASN 117 1HD2 ASN 117 -7.415 21.842 19.770 908 2HD2 ASN 117 2HD2 ASN 117 -7.043 21.565 21.435 909 H TRP 118 H TRP 118 -10.000 18.068 16.972 910 HA TRP 118 HA TRP 118 -11.090 20.706 16.465 911 1HB TRP 118 1HB TRP 118 -9.907 18.998 14.276 912 2HB TRP 118 2HB TRP 118 -11.053 20.297 13.964 913 HD1 TRP 118 HD1 TRP 118 -7.456 19.695 14.105 914 HE1 TRP 118 HE1 TRP 118 -6.147 21.904 14.274 915 HE3 TRP 118 HE3 TRP 118 -11.306 22.828 15.328 916 HZ2 TRP 118 HZ2 TRP 118 -6.676 24.615 14.851 917 HZ3 TRP 118 HZ3 TRP 118 -10.820 25.215 15.672 918 HH2 TRP 118 HH2 TRP 118 -8.552 26.089 15.439 919 H ASN 119 H ASN 119 -12.926 20.329 14.641 920 HA ASN 119 HA ASN 119 -14.457 17.976 15.541 921 1HB ASN 119 1HB ASN 119 -15.660 20.586 14.612 922 2HB ASN 119 2HB ASN 119 -16.468 19.256 15.439 923 1HD2 ASN 119 1HD2 ASN 119 -15.595 18.754 17.638 924 2HD2 ASN 119 2HD2 ASN 119 -15.174 20.095 18.643 925 H TYR 120 H TYR 120 -16.596 18.289 13.732 926 HA TYR 120 HA TYR 120 -17.267 17.829 11.606 927 1HB TYR 120 1HB TYR 120 -14.502 18.583 10.657 928 2HB TYR 120 2HB TYR 120 -15.999 18.584 9.729 929 HD1 TYR 120 HD1 TYR 120 -17.736 20.313 10.207 930 HD2 TYR 120 HD2 TYR 120 -13.864 20.462 11.962 931 HE1 TYR 120 HE1 TYR 120 -18.084 22.684 10.761 932 HE2 TYR 120 HE2 TYR 120 -14.201 22.832 12.521 933 HH TYR 120 HH TYR 120 -17.266 24.366 12.255 934 H ILE 121 H ILE 121 -17.041 16.191 9.951 935 HA ILE 121 HA ILE 121 -15.925 13.783 10.988 936 HB ILE 121 HB ILE 121 -16.701 12.748 8.889 937 1HG1 ILE 121 1HG1 ILE 121 -18.235 14.614 7.613 938 2HG1 ILE 121 2HG1 ILE 121 -16.833 15.576 8.071 939 1HG2 ILE 121 1HG2 ILE 121 -18.802 14.593 10.005 940 2HG2 ILE 121 2HG2 ILE 121 -18.203 13.167 10.853 941 3HG2 ILE 121 3HG2 ILE 121 -19.031 12.990 9.307 942 1HD1 ILE 121 1HD1 ILE 121 -15.551 14.625 6.521 943 2HD1 ILE 121 2HD1 ILE 121 -17.059 14.035 5.825 944 3HD1 ILE 121 3HD1 ILE 121 -16.126 13.004 6.909 945 HA PRO 122 HA PRO 122 -11.894 13.747 9.209 946 1HB PRO 122 1HB PRO 122 -11.634 11.116 8.515 947 2HB PRO 122 2HB PRO 122 -11.502 11.708 10.173 948 1HG PRO 122 1HG PRO 122 -13.835 10.440 8.794 949 2HG PRO 122 2HG PRO 122 -13.222 10.170 10.437 950 1HD PRO 122 1HD PRO 122 -15.371 11.720 9.954 951 2HD PRO 122 2HD PRO 122 -14.225 12.083 11.262 952 H LEU 123 H LEU 123 -10.733 12.569 7.201 953 HA LEU 123 HA LEU 123 -12.472 12.916 4.851 954 1HB LEU 123 1HB LEU 123 -10.960 14.879 5.288 955 2HB LEU 123 2HB LEU 123 -9.597 13.810 5.014 956 HG LEU 123 HG LEU 123 -11.650 13.933 2.875 957 1HD1 LEU 123 1HD1 LEU 123 -9.596 16.112 3.133 958 2HD1 LEU 123 2HD1 LEU 123 -11.263 16.304 3.678 959 3HD1 LEU 123 3HD1 LEU 123 -10.923 15.985 1.977 960 1HD2 LEU 123 1HD2 LEU 123 -8.635 13.943 2.820 961 2HD2 LEU 123 2HD2 LEU 123 -9.719 13.678 1.454 962 3HD2 LEU 123 3HD2 LEU 123 -9.640 12.495 2.759 963 HA PRO 124 HA PRO 124 -10.601 8.783 4.396 964 1HB PRO 124 1HB PRO 124 -12.493 7.834 2.702 965 2HB PRO 124 2HB PRO 124 -12.719 7.885 4.454 966 1HG PRO 124 1HG PRO 124 -13.714 9.780 2.360 967 2HG PRO 124 2HG PRO 124 -14.567 9.119 3.768 968 1HD PRO 124 1HD PRO 124 -13.500 11.608 3.745 969 2HD PRO 124 2HD PRO 124 -13.603 10.626 5.219 970 H VAL 125 H VAL 125 -9.512 7.775 2.677 971 HA VAL 125 HA VAL 125 -9.626 8.932 0.024 972 HB VAL 125 HB VAL 125 -7.123 9.287 -0.019 973 1HG1 VAL 125 1HG1 VAL 125 -9.023 11.046 0.295 974 2HG1 VAL 125 2HG1 VAL 125 -7.338 11.520 0.513 975 3HG1 VAL 125 3HG1 VAL 125 -8.353 11.197 1.919 976 1HG2 VAL 125 1HG2 VAL 125 -7.479 9.209 2.977 977 2HG2 VAL 125 2HG2 VAL 125 -6.028 9.747 2.132 978 3HG2 VAL 125 3HG2 VAL 125 -6.551 8.067 2.004 979 H LEU 126 H LEU 126 -9.301 7.401 -1.460 980 HA LEU 126 HA LEU 126 -8.038 4.885 -0.595 981 1HB LEU 126 1HB LEU 126 -10.157 5.377 -2.686 982 2HB LEU 126 2HB LEU 126 -9.368 3.832 -2.432 983 HG LEU 126 HG LEU 126 -10.246 4.201 0.049 984 1HD1 LEU 126 1HD1 LEU 126 -11.211 6.462 -0.830 985 2HD1 LEU 126 2HD1 LEU 126 -12.147 5.470 0.287 986 3HD1 LEU 126 3HD1 LEU 126 -12.514 5.442 -1.437 987 1HD2 LEU 126 1HD2 LEU 126 -12.035 3.278 -2.196 988 2HD2 LEU 126 2HD2 LEU 126 -12.142 2.811 -0.499 989 3HD2 LEU 126 3HD2 LEU 126 -10.751 2.314 -1.463 990 H LEU 127 H LEU 127 -6.250 4.229 -1.609 991 HA LEU 127 HA LEU 127 -5.643 5.297 -4.268 992 1HB LEU 127 1HB LEU 127 -4.031 5.611 -1.783 993 2HB LEU 127 2HB LEU 127 -3.178 5.363 -3.295 994 HG LEU 127 HG LEU 127 -5.263 7.481 -3.239 995 1HD1 LEU 127 1HD1 LEU 127 -4.355 8.324 -1.346 996 2HD1 LEU 127 2HD1 LEU 127 -3.160 8.946 -2.484 997 3HD1 LEU 127 3HD1 LEU 127 -2.825 7.476 -1.568 998 1HD2 LEU 127 1HD2 LEU 127 -4.136 8.293 -5.019 999 2HD2 LEU 127 2HD2 LEU 127 -3.531 6.640 -5.113 1000 3HD2 LEU 127 3HD2 LEU 127 -2.558 7.891 -4.342 1001 HA PRO 128 HA PRO 128 -4.885 0.936 -4.924 1002 1HB PRO 128 1HB PRO 128 -3.480 1.893 -7.348 1003 2HB PRO 128 2HB PRO 128 -4.824 0.756 -7.202 1004 1HG PRO 128 1HG PRO 128 -5.204 3.224 -8.148 1005 2HG PRO 128 2HG PRO 128 -6.412 2.436 -7.116 1006 1HD PRO 128 1HD PRO 128 -4.402 4.539 -6.415 1007 2HD PRO 128 2HD PRO 128 -6.091 4.371 -5.891 1008 H LEU 129 H LEU 129 -3.127 -0.499 -4.899 1009 HA LEU 129 HA LEU 129 -0.421 0.390 -5.080 1010 1HB LEU 129 1HB LEU 129 0.230 0.002 -2.768 1011 2HB LEU 129 2HB LEU 129 -0.953 1.292 -2.876 1012 HG LEU 129 HG LEU 129 -1.931 -1.464 -2.305 1013 1HD1 LEU 129 1HD1 LEU 129 -0.642 0.327 -0.251 1014 2HD1 LEU 129 2HD1 LEU 129 -0.026 -1.229 -0.805 1015 3HD1 LEU 129 3HD1 LEU 129 -1.545 -1.149 0.086 1016 1HD2 LEU 129 1HD2 LEU 129 -2.788 1.101 -1.025 1017 2HD2 LEU 129 2HD2 LEU 129 -3.716 -0.372 -1.308 1018 3HD2 LEU 129 3HD2 LEU 129 -3.317 0.691 -2.657 1019 H ALA 130 H ALA 130 1.121 -1.363 -4.697 1020 HA ALA 130 HA ALA 130 -0.121 -4.031 -4.794 1021 1HB ALA 130 1HB ALA 130 1.730 -4.635 -6.426 1022 2HB ALA 130 2HB ALA 130 1.990 -2.900 -6.611 1023 3HB ALA 130 3HB ALA 130 0.434 -3.609 -7.042 1024 H SER 131 H SER 131 1.416 -5.798 -4.293 1025 HA SER 131 HA SER 131 3.567 -4.924 -2.482 1026 1HB SER 131 1HB SER 131 2.821 -7.215 -1.287 1027 2HB SER 131 2HB SER 131 2.137 -5.648 -0.853 1028 HG SER 131 HG SER 131 1.032 -7.652 -2.514 1029 H VAL 132 H VAL 132 5.460 -5.648 -3.167 1030 HA VAL 132 HA VAL 132 5.664 -8.374 -4.213 1031 HB VAL 132 HB VAL 132 7.216 -7.561 -6.014 1032 1HG1 VAL 132 1HG1 VAL 132 5.224 -8.232 -6.910 1033 2HG1 VAL 132 2HG1 VAL 132 5.200 -6.528 -7.368 1034 3HG1 VAL 132 3HG1 VAL 132 4.283 -7.078 -5.965 1035 1HG2 VAL 132 1HG2 VAL 132 6.379 -4.971 -4.868 1036 2HG2 VAL 132 2HG2 VAL 132 6.454 -5.061 -6.627 1037 3HG2 VAL 132 3HG2 VAL 132 7.885 -5.428 -5.663 1038 H GLY 133 H GLY 133 7.264 -9.416 -3.231 1039 1HA GLY 133 1HA GLY 133 9.873 -8.555 -2.908 1040 2HA GLY 133 2HA GLY 133 9.034 -8.095 -1.434 1041 H TYR 134 H TYR 134 10.721 -9.596 -0.554 1042 HA TYR 134 HA TYR 134 9.528 -12.239 -0.254 1043 1HB TYR 134 1HB TYR 134 11.658 -13.393 -0.614 1044 2HB TYR 134 2HB TYR 134 11.172 -12.516 -2.060 1045 HD1 TYR 134 HD1 TYR 134 13.710 -12.926 0.468 1046 HD2 TYR 134 HD2 TYR 134 12.302 -10.336 -2.600 1047 HE1 TYR 134 HE1 TYR 134 15.890 -11.790 0.434 1048 HE2 TYR 134 HE2 TYR 134 14.478 -9.194 -2.643 1049 HH TYR 134 HH TYR 134 16.402 -8.837 -1.067 1050 H GLY 135 H GLY 135 10.009 -13.253 1.703 1051 1HA GLY 135 1HA GLY 135 10.493 -13.326 3.944 1052 2HA GLY 135 2HA GLY 135 11.990 -12.511 3.518 1053 HA PRO 136 HA PRO 136 9.840 -9.571 6.297 1054 1HB PRO 136 1HB PRO 136 12.117 -8.357 7.157 1055 2HB PRO 136 2HB PRO 136 11.493 -9.853 7.864 1056 1HG PRO 136 1HG PRO 136 13.663 -9.477 5.835 1057 2HG PRO 136 2HG PRO 136 13.623 -10.552 7.246 1058 1HD PRO 136 1HD PRO 136 13.139 -11.438 4.739 1059 2HD PRO 136 2HD PRO 136 12.337 -12.133 6.162 1060 H VAL 137 H VAL 137 11.990 -9.167 3.621 1061 HA VAL 137 HA VAL 137 11.557 -6.284 3.504 1062 HB VAL 137 HB VAL 137 13.099 -7.998 1.555 1063 1HG1 VAL 137 1HG1 VAL 137 12.597 -5.908 0.575 1064 2HG1 VAL 137 2HG1 VAL 137 14.259 -5.783 1.153 1065 3HG1 VAL 137 3HG1 VAL 137 12.949 -5.038 2.068 1066 1HG2 VAL 137 1HG2 VAL 137 13.811 -6.987 4.234 1067 2HG2 VAL 137 2HG2 VAL 137 15.015 -6.748 2.968 1068 3HG2 VAL 137 3HG2 VAL 137 14.436 -8.371 3.338 1069 H THR 138 H THR 138 9.747 -5.578 2.593 1070 HA THR 138 HA THR 138 8.825 -6.868 0.120 1071 HB THR 138 HB THR 138 6.735 -5.762 1.905 1072 HG1 THR 138 HG1 THR 138 6.688 -7.698 3.116 1073 1HG2 THR 138 1HG2 THR 138 6.284 -6.873 -0.295 1074 2HG2 THR 138 2HG2 THR 138 5.402 -7.528 1.085 1075 3HG2 THR 138 3HG2 THR 138 6.805 -8.385 0.447 1076 H PHE 139 H PHE 139 8.518 -5.482 -1.498 1077 HA PHE 139 HA PHE 139 8.689 -2.625 -0.938 1078 1HB PHE 139 1HB PHE 139 9.259 -4.368 -3.250 1079 2HB PHE 139 2HB PHE 139 8.580 -2.794 -3.651 1080 HD1 PHE 139 HD1 PHE 139 11.518 -4.596 -2.755 1081 HD2 PHE 139 HD2 PHE 139 9.737 -0.732 -2.700 1082 HE1 PHE 139 HE1 PHE 139 13.743 -3.578 -2.494 1083 HE2 PHE 139 HE2 PHE 139 11.959 0.293 -2.441 1084 HZ PHE 139 HZ PHE 139 13.965 -1.131 -2.339 1085 H GLN 140 H GLN 140 7.029 -1.250 -1.094 1086 HA GLN 140 HA GLN 140 4.488 -2.289 -2.167 1087 1HB GLN 140 1HB GLN 140 4.896 -1.502 0.368 1088 2HB GLN 140 2HB GLN 140 4.479 0.052 -0.341 1089 1HG GLN 140 1HG GLN 140 2.324 -0.468 -0.468 1090 2HG GLN 140 2HG GLN 140 2.661 -2.056 -1.156 1091 1HE2 GLN 140 1HE2 GLN 140 2.380 -3.793 0.080 1092 2HE2 GLN 140 2HE2 GLN 140 2.067 -3.771 1.779 1093 H MET 141 H MET 141 3.962 -1.442 -4.061 1094 HA MET 141 HA MET 141 4.955 1.228 -4.762 1095 1HB MET 141 1HB MET 141 4.139 -1.174 -6.339 1096 2HB MET 141 2HB MET 141 3.986 0.413 -7.082 1097 1HG MET 141 1HG MET 141 6.215 0.694 -7.274 1098 2HG MET 141 2HG MET 141 6.564 -0.172 -5.780 1099 1HE MET 141 1HE MET 141 8.336 -0.283 -8.105 1100 2HE MET 141 2HE MET 141 8.511 -1.900 -8.788 1101 3HE MET 141 3HE MET 141 8.746 -1.642 -7.059 1102 H THR 142 H THR 142 3.629 2.916 -4.836 1103 HA THR 142 HA THR 142 0.726 2.405 -4.879 1104 HB THR 142 HB THR 142 0.894 4.890 -3.810 1105 HG1 THR 142 HG1 THR 142 2.598 4.915 -2.352 1106 1HG2 THR 142 1HG2 THR 142 1.015 2.269 -2.349 1107 2HG2 THR 142 2HG2 THR 142 -0.414 3.220 -2.754 1108 3HG2 THR 142 3HG2 THR 142 0.737 3.821 -1.561 1109 H TYR 143 H TYR 143 -0.540 3.563 -6.265 1110 HA TYR 143 HA TYR 143 0.888 5.272 -8.189 1111 1HB TYR 143 1HB TYR 143 -0.422 3.051 -8.820 1112 2HB TYR 143 2HB TYR 143 -1.804 4.141 -8.801 1113 HD1 TYR 143 HD1 TYR 143 -2.403 4.450 -11.025 1114 HD2 TYR 143 HD2 TYR 143 1.700 4.724 -9.935 1115 HE1 TYR 143 HE1 TYR 143 -1.854 5.190 -13.305 1116 HE2 TYR 143 HE2 TYR 143 2.261 5.465 -12.212 1117 HH TYR 143 HH TYR 143 0.122 5.209 -14.809 1118 H ILE 144 H ILE 144 -0.309 7.087 -9.098 1119 HA ILE 144 HA ILE 144 -2.429 8.118 -7.346 1120 HB ILE 144 HB ILE 144 -0.351 9.173 -6.628 1121 1HG1 ILE 144 1HG1 ILE 144 -2.121 11.055 -8.206 1122 2HG1 ILE 144 2HG1 ILE 144 -2.422 10.493 -6.565 1123 1HG2 ILE 144 1HG2 ILE 144 1.201 10.106 -7.990 1124 2HG2 ILE 144 2HG2 ILE 144 0.008 10.625 -9.180 1125 3HG2 ILE 144 3HG2 ILE 144 0.530 8.942 -9.132 1126 1HD1 ILE 144 1HD1 ILE 144 -1.380 12.830 -6.968 1127 2HD1 ILE 144 2HD1 ILE 144 0.115 11.923 -7.196 1128 3HD1 ILE 144 3HD1 ILE 144 -0.763 11.809 -5.671 1129 HA PRO 145 HA PRO 145 -4.130 8.276 -11.585 1130 1HB PRO 145 1HB PRO 145 -6.382 9.339 -9.947 1131 2HB PRO 145 2HB PRO 145 -6.399 8.119 -11.224 1132 1HG PRO 145 1HG PRO 145 -6.596 7.404 -8.671 1133 2HG PRO 145 2HG PRO 145 -5.640 6.441 -9.813 1134 1HD PRO 145 1HD PRO 145 -4.722 8.334 -7.697 1135 2HD PRO 145 2HD PRO 145 -3.988 6.815 -8.250 1136 H GLY 146 H GLY 146 -4.202 9.948 -12.991 1137 1HA GLY 146 1HA GLY 146 -4.468 12.674 -11.920 1138 2HA GLY 146 2HA GLY 146 -3.077 12.276 -12.917 1139 H THR 147 H THR 147 -6.193 13.475 -12.921 1140 HA THR 147 HA THR 147 -6.744 12.724 -15.688 1141 HB THR 147 HB THR 147 -8.443 14.470 -13.908 1142 HG1 THR 147 HG1 THR 147 -9.526 12.558 -13.338 1143 1HG2 THR 147 1HG2 THR 147 -8.751 13.437 -16.565 1144 2HG2 THR 147 2HG2 THR 147 -9.778 14.553 -15.665 1145 3HG2 THR 147 3HG2 THR 147 -10.014 12.813 -15.504 1146 H TYR 148 H TYR 148 -6.531 14.066 -17.384 1147 HA TYR 148 HA TYR 148 -5.919 15.871 -18.622 1148 1HB TYR 148 1HB TYR 148 -7.108 17.275 -16.230 1149 2HB TYR 148 2HB TYR 148 -6.521 18.142 -17.645 1150 HD1 TYR 148 HD1 TYR 148 -7.561 17.535 -19.913 1151 HD2 TYR 148 HD2 TYR 148 -9.282 16.422 -16.185 1152 HE1 TYR 148 HE1 TYR 148 -9.730 17.202 -21.021 1153 HE2 TYR 148 HE2 TYR 148 -11.456 16.085 -17.282 1154 HH TYR 148 HH TYR 148 -11.806 16.012 -20.687 1155 H ASN 149 H ASN 149 -3.987 14.625 -16.846 1156 HA ASN 149 HA ASN 149 -2.022 16.777 -16.837 1157 1HB ASN 149 1HB ASN 149 -3.242 16.208 -14.485 1158 2HB ASN 149 2HB ASN 149 -1.909 15.058 -14.433 1159 1HD2 ASN 149 1HD2 ASN 149 -1.302 16.386 -12.567 1160 2HD2 ASN 149 2HD2 ASN 149 -0.347 17.799 -12.838 1161 H ASN 150 H ASN 150 0.102 15.507 -15.717 1162 HA ASN 150 HA ASN 150 0.426 12.823 -16.609 1163 1HB ASN 150 1HB ASN 150 2.198 13.401 -18.340 1164 2HB ASN 150 2HB ASN 150 0.528 13.691 -18.816 1165 1HD2 ASN 150 1HD2 ASN 150 3.466 14.918 -19.099 1166 2HD2 ASN 150 2HD2 ASN 150 3.114 16.609 -19.162 1167 H GLY 151 H GLY 151 2.638 12.031 -16.274 1168 1HA GLY 151 1HA GLY 151 4.874 12.435 -15.444 1169 2HA GLY 151 2HA GLY 151 4.234 13.787 -14.523 1170 H ASN 152 H ASN 152 2.590 10.710 -14.689 1171 HA ASN 152 HA ASN 152 2.414 10.459 -11.893 1172 1HB ASN 152 1HB ASN 152 2.033 8.378 -14.056 1173 2HB ASN 152 2HB ASN 152 1.572 8.167 -12.370 1174 1HD2 ASN 152 1HD2 ASN 152 -0.429 7.781 -13.897 1175 2HD2 ASN 152 2HD2 ASN 152 -1.492 9.137 -14.014 1176 H VAL 153 H VAL 153 4.002 10.010 -10.530 1177 HA VAL 153 HA VAL 153 6.220 8.304 -11.444 1178 HB VAL 153 HB VAL 153 7.452 9.256 -9.464 1179 1HG1 VAL 153 1HG1 VAL 153 6.732 11.600 -11.107 1180 2HG1 VAL 153 2HG1 VAL 153 7.266 10.165 -11.984 1181 3HG1 VAL 153 3HG1 VAL 153 8.311 10.893 -10.764 1182 1HG2 VAL 153 1HG2 VAL 153 5.444 9.978 -8.217 1183 2HG2 VAL 153 2HG2 VAL 153 5.173 11.231 -9.428 1184 3HG2 VAL 153 3HG2 VAL 153 6.623 11.273 -8.425 1185 H TYR 154 H TYR 154 6.542 6.371 -10.537 1186 HA TYR 154 HA TYR 154 4.647 5.274 -8.738 1187 1HB TYR 154 1HB TYR 154 7.198 4.323 -9.975 1188 2HB TYR 154 2HB TYR 154 6.518 3.414 -8.629 1189 HD1 TYR 154 HD1 TYR 154 5.282 4.998 -11.790 1190 HD2 TYR 154 HD2 TYR 154 5.206 1.616 -9.209 1191 HE1 TYR 154 HE1 TYR 154 3.756 3.854 -13.343 1192 HE2 TYR 154 HE2 TYR 154 3.681 0.463 -10.755 1193 HH TYR 154 HH TYR 154 2.105 0.971 -12.509 1194 H PHE 155 H PHE 155 4.712 4.935 -6.573 1195 HA PHE 155 HA PHE 155 6.940 6.188 -5.123 1196 1HB PHE 155 1HB PHE 155 4.286 6.709 -4.892 1197 2HB PHE 155 2HB PHE 155 4.483 5.488 -3.640 1198 HD1 PHE 155 HD1 PHE 155 4.745 8.917 -4.415 1199 HD2 PHE 155 HD2 PHE 155 6.442 5.869 -1.979 1200 HE1 PHE 155 HE1 PHE 155 5.629 10.634 -2.890 1201 HE2 PHE 155 HE2 PHE 155 7.328 7.579 -0.448 1202 HZ PHE 155 HZ PHE 155 6.922 9.966 -0.903 1203 H ALA 156 H ALA 156 8.353 4.883 -4.185 1204 HA ALA 156 HA ALA 156 7.648 2.087 -3.727 1205 1HB ALA 156 1HB ALA 156 9.812 2.979 -4.878 1206 2HB ALA 156 2HB ALA 156 9.900 1.596 -3.788 1207 3HB ALA 156 3HB ALA 156 10.374 3.197 -3.221 1208 H TRP 157 H TRP 157 7.389 1.197 -1.765 1209 HA TRP 157 HA TRP 157 8.110 2.796 0.597 1210 1HB TRP 157 1HB TRP 157 5.476 1.903 -0.249 1211 2HB TRP 157 2HB TRP 157 5.879 1.301 1.356 1212 HD1 TRP 157 HD1 TRP 157 7.278 4.688 0.391 1213 HE1 TRP 157 HE1 TRP 157 6.067 6.516 1.738 1214 HE3 TRP 157 HE3 TRP 157 3.558 1.849 2.451 1215 HZ2 TRP 157 HZ2 TRP 157 3.831 6.727 3.448 1216 HZ3 TRP 157 HZ3 TRP 157 1.923 2.941 3.930 1217 HH2 TRP 157 HH2 TRP 157 2.059 5.329 4.418 1218 H MET 158 H MET 158 8.835 1.670 2.382 1219 HA MET 158 HA MET 158 9.695 -1.064 1.839 1220 1HB MET 158 1HB MET 158 10.401 0.718 4.176 1221 2HB MET 158 2HB MET 158 11.188 -0.790 3.729 1222 1HG MET 158 1HG MET 158 11.115 1.362 1.698 1223 2HG MET 158 2HG MET 158 12.171 1.589 3.090 1224 1HE MET 158 1HE MET 158 13.532 -0.228 4.007 1225 2HE MET 158 2HE MET 158 14.784 -0.928 2.979 1226 3HE MET 158 3HE MET 158 13.340 -1.862 3.368 1227 H ARG 159 H ARG 159 9.277 -2.806 3.215 1228 HA ARG 159 HA ARG 159 7.271 -2.396 5.312 1229 1HB ARG 159 1HB ARG 159 6.486 -3.282 2.882 1230 2HB ARG 159 2HB ARG 159 6.908 -4.811 3.641 1231 1HG ARG 159 1HG ARG 159 5.429 -4.055 5.581 1232 2HG ARG 159 2HG ARG 159 4.824 -2.824 4.471 1233 1HD ARG 159 1HD ARG 159 4.579 -4.952 2.888 1234 2HD ARG 159 2HD ARG 159 4.446 -5.765 4.446 1235 HE ARG 159 HE ARG 159 2.753 -3.459 4.211 1236 1HH1 ARG 159 1HH1 ARG 159 3.025 -6.876 3.556 1237 2HH1 ARG 159 2HH1 ARG 159 1.313 -7.135 3.530 1238 1HH2 ARG 159 1HH2 ARG 159 0.501 -3.797 4.177 1239 2HH2 ARG 159 2HH2 ARG 159 -0.120 -5.387 3.882 1240 H PHE 160 H PHE 160 7.561 -3.626 7.089 1241 HA PHE 160 HA PHE 160 9.669 -5.684 6.971 1242 1HB PHE 160 1HB PHE 160 10.080 -3.489 8.295 1243 2HB PHE 160 2HB PHE 160 8.971 -4.177 9.477 1244 HD1 PHE 160 HD1 PHE 160 9.610 -6.039 10.845 1245 HD2 PHE 160 HD2 PHE 160 12.250 -4.513 7.877 1246 HE1 PHE 160 HE1 PHE 160 11.461 -7.320 11.840 1247 HE2 PHE 160 HE2 PHE 160 14.106 -5.791 8.865 1248 HZ PHE 160 HZ PHE 160 13.712 -7.197 10.848 1249 H GLN 161 H GLN 161 9.377 -7.583 8.147 1250 HA GLN 161 HA GLN 161 6.585 -8.138 8.857 1251 1HB GLN 161 1HB GLN 161 8.875 -9.899 8.015 1252 2HB GLN 161 2HB GLN 161 7.432 -10.565 8.764 1253 1HG GLN 161 1HG GLN 161 6.589 -8.838 6.692 1254 2HG GLN 161 2HG GLN 161 7.874 -9.859 6.048 1255 1HE2 GLN 161 1HE2 GLN 161 6.321 -10.861 4.703 1256 2HE2 GLN 161 2HE2 GLN 161 5.244 -12.058 5.327 1257 H PHE 162 H PHE 162 6.002 -8.914 10.841 1258 HA PHE 162 HA PHE 162 8.115 -9.362 12.824 1259 1HB PHE 162 1HB PHE 162 6.064 -7.233 12.844 1260 2HB PHE 162 2HB PHE 162 6.260 -8.107 14.360 1261 HD1 PHE 162 HD1 PHE 162 7.301 -5.329 12.591 1262 HD2 PHE 162 HD2 PHE 162 8.848 -8.478 14.999 1263 HE1 PHE 162 HE1 PHE 162 9.267 -3.950 13.124 1264 HE2 PHE 162 HE2 PHE 162 10.817 -7.105 15.537 1265 HZ PHE 162 HZ PHE 162 11.029 -4.837 14.599 1266 H LEU 163 H LEU 163 7.826 -11.291 13.703 1267 HA LEU 163 HA LEU 163 5.137 -12.458 13.729 1268 1HB LEU 163 1HB LEU 163 6.223 -14.599 14.007 1269 2HB LEU 163 2HB LEU 163 6.919 -13.750 12.639 1270 HG LEU 163 HG LEU 163 8.294 -13.457 15.256 1271 1HD1 LEU 163 1HD1 LEU 163 9.572 -15.584 14.683 1272 2HD1 LEU 163 2HD1 LEU 163 8.194 -16.000 13.664 1273 3HD1 LEU 163 3HD1 LEU 163 7.972 -15.774 15.399 1274 1HD2 LEU 163 1HD2 LEU 163 9.520 -12.350 13.716 1275 2HD2 LEU 163 2HD2 LEU 163 8.906 -13.316 12.374 1276 3HD2 LEU 163 3HD2 LEU 163 10.181 -13.956 13.411 1277 H GLU 164 H GLU 164 4.265 -13.398 15.597 1278 HA GLU 164 HA GLU 164 5.251 -12.207 18.074 1279 1HB GLU 164 1HB GLU 164 2.785 -12.178 17.207 1280 2HB GLU 164 2HB GLU 164 2.724 -13.805 17.870 1281 1HG GLU 164 1HG GLU 164 2.904 -13.083 20.034 1282 2HG GLU 164 2HG GLU 164 3.745 -11.600 19.584 1283 HE2 GLU 164 HE2 GLU 164 0.471 -10.344 18.526 1284 H HIS 165 H HIS 165 6.748 -13.390 19.082 1285 HA HIS 165 HA HIS 165 6.165 -16.234 19.546 1286 1HB HIS 165 1HB HIS 165 8.622 -16.683 19.382 1287 2HB HIS 165 2HB HIS 165 7.878 -16.212 17.858 1288 HD1 HIS 165 HD1 HIS 165 9.996 -15.262 16.817 1289 HD2 HIS 165 HD2 HIS 165 9.036 -13.524 20.467 1290 HE1 HIS 165 HE1 HIS 165 11.511 -13.266 17.032 1291 HE2 HIS 165 HE2 HIS 165 10.972 -12.281 19.286 1292 H HIS 166 H HIS 166 7.827 -17.057 21.305 1293 HA HIS 166 HA HIS 166 8.279 -15.023 23.353 1294 1HB HIS 166 1HB HIS 166 6.275 -17.189 23.490 1295 2HB HIS 166 2HB HIS 166 7.296 -17.020 24.915 1296 HD1 HIS 166 HD1 HIS 166 4.183 -16.343 24.716 1297 HD2 HIS 166 HD2 HIS 166 7.319 -13.618 24.664 1298 HE1 HIS 166 HE1 HIS 166 3.191 -14.164 25.483 1299 HE2 HIS 166 HE2 HIS 166 5.088 -12.510 25.361 1300 H HIS 167 H HIS 167 10.000 -15.437 24.672 1301 HA HIS 167 HA HIS 167 11.604 -17.790 23.974 1302 1HB HIS 167 1HB HIS 167 13.433 -16.487 25.191 1303 2HB HIS 167 2HB HIS 167 12.862 -15.814 23.668 1304 HD1 HIS 167 HD1 HIS 167 12.773 -15.219 27.371 1305 HD2 HIS 167 HD2 HIS 167 11.607 -13.340 23.853 1306 HE1 HIS 167 HE1 HIS 167 12.144 -12.877 28.037 1307 HE2 HIS 167 HE2 HIS 167 11.521 -11.735 25.879 1308 H HIS 168 H HIS 168 10.922 -19.432 25.255 1309 HA HIS 168 HA HIS 168 10.385 -19.007 28.067 1310 1HB HIS 168 1HB HIS 168 9.560 -20.879 26.151 1311 2HB HIS 168 2HB HIS 168 10.549 -21.792 27.286 1312 HD1 HIS 168 HD1 HIS 168 7.180 -20.843 26.771 1313 HD2 HIS 168 HD2 HIS 168 9.631 -21.115 30.115 1314 HE1 HIS 168 HE1 HIS 168 5.620 -20.976 28.739 1315 HE2 HIS 168 HE2 HIS 168 7.126 -21.053 30.756 1316 H HIS 169 H HIS 169 11.989 -18.884 29.482 1317 HA HIS 169 HA HIS 169 14.644 -19.628 28.985 1318 1HB HIS 169 1HB HIS 169 13.087 -18.799 31.380 1319 2HB HIS 169 2HB HIS 169 14.641 -19.577 31.659 1320 HD1 HIS 169 HD1 HIS 169 14.390 -17.464 28.635 1321 HD2 HIS 169 HD2 HIS 169 15.592 -17.055 32.591 1322 HE1 HIS 169 HE1 HIS 169 15.669 -15.301 28.728 1323 HE2 HIS 169 HE2 HIS 169 16.459 -15.116 31.114 1324 H HIS 170 H HIS 170 15.860 -21.401 29.516 1325 HA HIS 170 HA HIS 170 14.567 -23.640 30.876 1326 1HB HIS 170 1HB HIS 170 15.402 -23.588 28.026 1327 2HB HIS 170 2HB HIS 170 15.774 -25.047 28.938 1328 HD1 HIS 170 HD1 HIS 170 13.112 -23.445 27.077 1329 HD2 HIS 170 HD2 HIS 170 13.361 -26.230 30.151 1330 HE1 HIS 170 HE1 HIS 170 10.871 -24.581 27.137 1331 HE2 HIS 170 HE2 HIS 170 11.015 -26.202 29.061 Start of MODEL 16 1 1H MET 1 1H MET 1 -10.366 -44.396 1.971 2 2H MET 1 2H MET 1 -9.267 -45.462 1.196 3 H MET 1 H MET 1 -10.250 -44.968 1.464 4 3H MET 1 3H MET 1 -8.709 -43.975 1.848 5 HA MET 1 HA MET 1 -9.750 -46.301 3.317 6 1HB MET 1 1HB MET 1 -7.292 -45.936 2.272 7 2HB MET 1 2HB MET 1 -7.086 -45.088 3.798 8 1HG MET 1 1HG MET 1 -7.909 -47.144 4.954 9 2HG MET 1 2HG MET 1 -7.856 -47.964 3.396 10 1HE MET 1 1HE MET 1 -6.581 -49.709 4.556 11 2HE MET 1 2HE MET 1 -4.820 -49.715 4.656 12 3HE MET 1 3HE MET 1 -5.615 -49.612 3.084 13 H ASN 2 H ASN 2 -8.039 -43.205 3.806 14 HA ASN 2 HA ASN 2 -9.945 -42.086 5.528 15 1HB ASN 2 1HB ASN 2 -8.825 -42.334 7.702 16 2HB ASN 2 2HB ASN 2 -9.310 -43.898 7.054 17 1HD2 ASN 2 1HD2 ASN 2 -7.733 -45.317 6.288 18 2HD2 ASN 2 2HD2 ASN 2 -6.068 -45.143 6.717 19 H ALA 3 H ALA 3 -6.507 -42.378 4.782 20 HA ALA 3 HA ALA 3 -5.617 -39.903 5.679 21 1HB ALA 3 1HB ALA 3 -4.585 -41.184 3.168 22 2HB ALA 3 2HB ALA 3 -4.261 -41.858 4.765 23 3HB ALA 3 3HB ALA 3 -3.704 -40.234 4.363 24 H ASP 4 H ASP 4 -7.643 -40.650 2.993 25 HA ASP 4 HA ASP 4 -7.112 -38.251 1.512 26 1HB ASP 4 1HB ASP 4 -8.206 -40.605 0.809 27 2HB ASP 4 2HB ASP 4 -9.679 -39.692 1.124 28 HD2 ASP 4 HD2 ASP 4 -9.362 -37.954 -1.806 29 H GLU 5 H GLU 5 -9.931 -39.408 3.360 30 HA GLU 5 HA GLU 5 -11.270 -36.916 3.329 31 1HB GLU 5 1HB GLU 5 -12.440 -39.038 3.711 32 2HB GLU 5 2HB GLU 5 -11.577 -39.249 5.229 33 1HG GLU 5 1HG GLU 5 -12.931 -37.859 6.339 34 2HG GLU 5 2HG GLU 5 -13.019 -36.713 5.003 35 HE2 GLU 5 HE2 GLU 5 -16.154 -37.840 4.263 36 H TRP 6 H TRP 6 -8.775 -38.252 5.329 37 HA TRP 6 HA TRP 6 -9.152 -36.446 7.527 38 1HB TRP 6 1HB TRP 6 -7.879 -38.790 7.342 39 2HB TRP 6 2HB TRP 6 -6.506 -37.724 7.064 40 HD1 TRP 6 HD1 TRP 6 -6.065 -35.850 9.089 41 HE1 TRP 6 HE1 TRP 6 -6.345 -36.142 11.630 42 HE3 TRP 6 HE3 TRP 6 -9.140 -39.933 9.101 43 HZ2 TRP 6 HZ2 TRP 6 -7.694 -37.875 13.406 44 HZ3 TRP 6 HZ3 TRP 6 -9.880 -40.847 11.262 45 HH2 TRP 6 HH2 TRP 6 -9.170 -39.838 13.370 46 H MET 7 H MET 7 -7.219 -36.493 4.601 47 HA MET 7 HA MET 7 -5.476 -34.375 5.240 48 1HB MET 7 1HB MET 7 -5.360 -36.062 3.293 49 2HB MET 7 2HB MET 7 -6.434 -34.955 2.449 50 1HG MET 7 1HG MET 7 -4.747 -33.155 2.839 51 2HG MET 7 2HG MET 7 -3.660 -34.395 3.462 52 1HE MET 7 1HE MET 7 -2.586 -36.520 0.941 53 2HE MET 7 2HE MET 7 -4.279 -36.869 0.586 54 3HE MET 7 3HE MET 7 -3.755 -36.645 2.256 55 H THR 8 H THR 8 -8.690 -34.445 3.794 56 HA THR 8 HA THR 8 -8.846 -31.779 2.968 57 HB THR 8 HB THR 8 -11.414 -32.284 3.618 58 HG1 THR 8 HG1 THR 8 -11.724 -34.546 3.362 59 1HG2 THR 8 1HG2 THR 8 -9.803 -33.196 1.285 60 2HG2 THR 8 2HG2 THR 8 -11.049 -31.952 1.376 61 3HG2 THR 8 3HG2 THR 8 -11.500 -33.657 1.423 62 H THR 9 H THR 9 -9.619 -33.272 6.085 63 HA THR 9 HA THR 9 -10.474 -30.793 7.259 64 HB THR 9 HB THR 9 -11.409 -32.917 8.027 65 HG1 THR 9 HG1 THR 9 -11.585 -31.668 9.715 66 1HG2 THR 9 1HG2 THR 9 -9.768 -34.541 7.875 67 2HG2 THR 9 2HG2 THR 9 -9.915 -34.274 9.612 68 3HG2 THR 9 3HG2 THR 9 -8.574 -33.555 8.720 69 H PHE 10 H PHE 10 -7.508 -32.625 7.075 70 HA PHE 10 HA PHE 10 -6.150 -31.176 9.136 71 1HB PHE 10 1HB PHE 10 -5.592 -33.412 7.398 72 2HB PHE 10 2HB PHE 10 -4.230 -32.298 7.410 73 HD1 PHE 10 HD1 PHE 10 -6.612 -33.199 10.122 74 HD2 PHE 10 HD2 PHE 10 -2.603 -33.309 8.700 75 HE1 PHE 10 HE1 PHE 10 -5.877 -34.130 12.278 76 HE2 PHE 10 HE2 PHE 10 -1.860 -34.241 10.852 77 HZ PHE 10 HZ PHE 10 -3.498 -34.652 12.646 78 H ARG 11 H ARG 11 -6.574 -30.815 5.689 79 HA ARG 11 HA ARG 11 -4.468 -29.081 5.105 80 1HB ARG 11 1HB ARG 11 -6.350 -30.210 3.608 81 2HB ARG 11 2HB ARG 11 -7.110 -28.636 3.799 82 1HG ARG 11 1HG ARG 11 -5.492 -27.553 2.590 83 2HG ARG 11 2HG ARG 11 -4.259 -28.762 2.951 84 1HD ARG 11 1HD ARG 11 -5.221 -30.312 1.418 85 2HD ARG 11 2HD ARG 11 -6.653 -29.305 1.208 86 HE ARG 11 HE ARG 11 -4.571 -27.723 0.413 87 1HH1 ARG 11 1HH1 ARG 11 -5.773 -30.866 -0.511 88 2HH1 ARG 11 2HH1 ARG 11 -5.235 -30.729 -2.151 89 1HH2 ARG 11 1HH2 ARG 11 -3.863 -27.539 -1.744 90 2HH2 ARG 11 2HH2 ARG 11 -4.151 -28.839 -2.852 91 H GLU 12 H GLU 12 -7.606 -28.466 6.556 92 HA GLU 12 HA GLU 12 -7.332 -25.605 6.450 93 1HB GLU 12 1HB GLU 12 -9.513 -26.984 6.510 94 2HB GLU 12 2HB GLU 12 -9.234 -27.094 8.241 95 1HG GLU 12 1HG GLU 12 -9.402 -24.744 8.505 96 2HG GLU 12 2HG GLU 12 -9.371 -24.484 6.761 97 HE2 GLU 12 HE2 GLU 12 -12.783 -24.596 6.722 98 H ASN 13 H ASN 13 -6.630 -28.151 8.735 99 HA ASN 13 HA ASN 13 -6.258 -26.448 10.994 100 1HB ASN 13 1HB ASN 13 -5.578 -29.305 10.369 101 2HB ASN 13 2HB ASN 13 -4.945 -28.542 11.824 102 1HD2 ASN 13 1HD2 ASN 13 -7.174 -30.584 10.947 103 2HD2 ASN 13 2HD2 ASN 13 -8.471 -30.172 12.011 104 H ILE 14 H ILE 14 -4.027 -28.034 8.724 105 HA ILE 14 HA ILE 14 -1.654 -27.038 9.863 106 HB ILE 14 HB ILE 14 -2.083 -27.730 6.957 107 1HG1 ILE 14 1HG1 ILE 14 -0.905 -29.740 8.766 108 2HG1 ILE 14 2HG1 ILE 14 -2.615 -29.414 9.035 109 1HG2 ILE 14 1HG2 ILE 14 0.462 -28.319 8.312 110 2HG2 ILE 14 2HG2 ILE 14 0.097 -26.609 8.085 111 3HG2 ILE 14 3HG2 ILE 14 0.154 -27.691 6.693 112 1HD1 ILE 14 1HD1 ILE 14 -1.277 -30.477 6.577 113 2HD1 ILE 14 2HD1 ILE 14 -2.899 -29.786 6.531 114 3HD1 ILE 14 3HD1 ILE 14 -2.570 -31.196 7.537 115 H ALA 15 H ALA 15 -3.653 -25.833 7.186 116 HA ALA 15 HA ALA 15 -2.046 -23.650 6.482 117 1HB ALA 15 1HB ALA 15 -5.000 -23.410 6.254 118 2HB ALA 15 2HB ALA 15 -4.196 -24.708 5.374 119 3HB ALA 15 3HB ALA 15 -3.740 -23.030 5.081 120 H GLN 16 H GLN 16 -4.680 -23.928 8.831 121 HA GLN 16 HA GLN 16 -4.754 -21.186 9.532 122 1HB GLN 16 1HB GLN 16 -5.823 -23.714 10.681 123 2HB GLN 16 2HB GLN 16 -5.744 -22.312 11.738 124 1HG GLN 16 1HG GLN 16 -7.058 -22.229 9.042 125 2HG GLN 16 2HG GLN 16 -7.918 -22.695 10.508 126 1HE2 GLN 16 1HE2 GLN 16 -6.446 -20.107 8.744 127 2HE2 GLN 16 2HE2 GLN 16 -7.041 -18.818 9.728 128 H THR 17 H THR 17 -3.163 -23.991 11.024 129 HA THR 17 HA THR 17 -2.009 -22.582 13.175 130 HB THR 17 HB THR 17 -1.024 -25.109 11.835 131 HG1 THR 17 HG1 THR 17 -3.183 -25.255 12.579 132 1HG2 THR 17 1HG2 THR 17 0.665 -24.952 13.270 133 2HG2 THR 17 2HG2 THR 17 -0.525 -25.351 14.509 134 3HG2 THR 17 3HG2 THR 17 -0.114 -23.666 14.191 135 H TRP 18 H TRP 18 -1.014 -23.075 9.862 136 HA TRP 18 HA TRP 18 1.682 -22.230 10.196 137 1HB TRP 18 1HB TRP 18 -0.023 -23.091 8.027 138 2HB TRP 18 2HB TRP 18 0.927 -21.689 7.545 139 HD1 TRP 18 HD1 TRP 18 2.026 -24.680 9.760 140 HE1 TRP 18 HE1 TRP 18 4.116 -25.731 8.687 141 HE3 TRP 18 HE3 TRP 18 2.317 -21.794 5.550 142 HZ2 TRP 18 HZ2 TRP 18 5.680 -25.383 6.363 143 HZ3 TRP 18 HZ3 TRP 18 4.140 -22.217 3.953 144 HH2 TRP 18 HH2 TRP 18 5.787 -23.976 4.353 145 H GLN 19 H GLN 19 -1.270 -20.591 9.100 146 HA GLN 19 HA GLN 19 -0.023 -18.086 8.635 147 1HB GLN 19 1HB GLN 19 -2.482 -19.158 8.080 148 2HB GLN 19 2HB GLN 19 -2.871 -18.015 9.358 149 1HG GLN 19 1HG GLN 19 -3.096 -16.646 7.571 150 2HG GLN 19 2HG GLN 19 -1.376 -16.413 7.878 151 1HE2 GLN 19 1HE2 GLN 19 0.099 -17.833 6.652 152 2HE2 GLN 19 2HE2 GLN 19 -0.321 -18.232 5.024 153 H GLN 20 H GLN 20 -2.462 -18.823 11.129 154 HA GLN 20 HA GLN 20 -2.748 -18.052 13.250 155 1HB GLN 20 1HB GLN 20 -0.544 -19.251 13.495 156 2HB GLN 20 2HB GLN 20 0.251 -17.698 13.284 157 1HG GLN 20 1HG GLN 20 -0.283 -16.985 15.354 158 2HG GLN 20 2HG GLN 20 -1.838 -17.815 15.359 159 1HE2 GLN 20 1HE2 GLN 20 -1.467 -18.591 17.447 160 2HE2 GLN 20 2HE2 GLN 20 -0.367 -19.885 17.756 161 HA PRO 21 HA PRO 21 -2.710 -13.685 11.627 162 1HB PRO 21 1HB PRO 21 -5.122 -13.770 13.377 163 2HB PRO 21 2HB PRO 21 -4.919 -13.056 11.773 164 1HG PRO 21 1HG PRO 21 -6.226 -15.354 12.077 165 2HG PRO 21 2HG PRO 21 -5.152 -15.094 10.690 166 1HD PRO 21 1HD PRO 21 -4.706 -16.711 13.157 167 2HD PRO 21 2HD PRO 21 -4.173 -17.018 11.492 168 H GLU 22 H GLU 22 -0.848 -13.248 12.915 169 HA GLU 22 HA GLU 22 -1.301 -11.527 15.087 170 1HB GLU 22 1HB GLU 22 -1.714 -13.849 16.121 171 2HB GLU 22 2HB GLU 22 0.023 -14.078 15.977 172 1HG GLU 22 1HG GLU 22 0.088 -13.209 18.030 173 2HG GLU 22 2HG GLU 22 -0.081 -11.663 17.199 174 HE2 GLU 22 HE2 GLU 22 -3.495 -11.483 18.130 175 H HIS 23 H HIS 23 0.067 -10.351 13.643 176 HA HIS 23 HA HIS 23 2.877 -10.708 14.264 177 1HB HIS 23 1HB HIS 23 3.556 -10.575 11.873 178 2HB HIS 23 2HB HIS 23 2.703 -12.064 12.268 179 HD1 HIS 23 HD1 HIS 23 2.173 -8.767 10.505 180 HD2 HIS 23 HD2 HIS 23 0.406 -12.514 10.826 181 HE1 HIS 23 HE1 HIS 23 0.371 -8.814 8.751 182 HE2 HIS 23 HE2 HIS 23 -0.628 -11.121 8.908 183 H TYR 24 H TYR 24 4.146 -8.835 13.844 184 HA TYR 24 HA TYR 24 2.598 -6.392 13.968 185 1HB TYR 24 1HB TYR 24 5.581 -6.874 14.130 186 2HB TYR 24 2HB TYR 24 4.801 -5.316 14.377 187 HD1 TYR 24 HD1 TYR 24 4.019 -4.708 16.497 188 HD2 TYR 24 HD2 TYR 24 4.934 -8.786 15.705 189 HE1 TYR 24 HE1 TYR 24 3.721 -5.232 18.881 190 HE2 TYR 24 HE2 TYR 24 4.638 -9.322 18.087 191 HH TYR 24 HH TYR 24 3.146 -8.034 20.092 192 H ASP 25 H ASP 25 2.636 -4.717 12.503 193 HA ASP 25 HA ASP 25 3.942 -5.279 9.922 194 1HB ASP 25 1HB ASP 25 1.149 -4.474 10.548 195 2HB ASP 25 2HB ASP 25 1.893 -3.748 9.127 196 HD2 ASP 25 HD2 ASP 25 2.202 -7.006 7.669 197 H LEU 26 H LEU 26 5.307 -3.767 9.238 198 HA LEU 26 HA LEU 26 5.094 -1.067 10.401 199 1HB LEU 26 1HB LEU 26 7.229 -2.899 10.552 200 2HB LEU 26 2HB LEU 26 7.742 -1.651 9.434 201 HG LEU 26 HG LEU 26 8.463 -1.145 11.707 202 1HD1 LEU 26 1HD1 LEU 26 8.128 0.771 10.390 203 2HD1 LEU 26 2HD1 LEU 26 7.319 1.112 11.920 204 3HD1 LEU 26 3HD1 LEU 26 6.372 0.646 10.506 205 1HD2 LEU 26 1HD2 LEU 26 5.728 -0.584 12.658 206 2HD2 LEU 26 2HD2 LEU 26 7.137 -1.179 13.535 207 3HD2 LEU 26 3HD2 LEU 26 6.180 -2.285 12.549 208 H TYR 27 H TYR 27 5.025 0.615 9.032 209 HA TYR 27 HA TYR 27 5.596 0.101 6.187 210 1HB TYR 27 1HB TYR 27 3.400 1.868 7.287 211 2HB TYR 27 2HB TYR 27 3.745 1.577 5.586 212 HD1 TYR 27 HD1 TYR 27 2.480 0.037 8.692 213 HD2 TYR 27 HD2 TYR 27 2.958 -0.389 4.486 214 HE1 TYR 27 HE1 TYR 27 0.950 -1.887 8.720 215 HE2 TYR 27 HE2 TYR 27 1.429 -2.313 4.501 216 HH TYR 27 HH TYR 27 -0.499 -3.109 7.206 217 H ILE 28 H ILE 28 7.330 1.224 5.611 218 HA ILE 28 HA ILE 28 7.591 3.993 6.575 219 HB ILE 28 HB ILE 28 9.908 2.102 6.167 220 1HG1 ILE 28 1HG1 ILE 28 9.164 3.166 8.851 221 2HG1 ILE 28 2HG1 ILE 28 8.220 1.827 8.206 222 1HG2 ILE 28 1HG2 ILE 28 10.361 4.503 5.770 223 2HG2 ILE 28 2HG2 ILE 28 11.259 3.842 7.136 224 3HG2 ILE 28 3HG2 ILE 28 9.834 4.842 7.418 225 1HD1 ILE 28 1HD1 ILE 28 10.628 1.684 9.580 226 2HD1 ILE 28 2HD1 ILE 28 11.035 1.330 7.901 227 3HD1 ILE 28 3HD1 ILE 28 9.805 0.377 8.730 228 HA PRO 29 HA PRO 29 7.867 4.859 2.221 229 1HB PRO 29 1HB PRO 29 8.784 7.405 2.365 230 2HB PRO 29 2HB PRO 29 7.112 6.970 2.738 231 1HG PRO 29 1HG PRO 29 9.401 7.464 4.604 232 2HG PRO 29 2HG PRO 29 7.718 8.009 4.728 233 1HD PRO 29 1HD PRO 29 8.668 5.882 6.110 234 2HD PRO 29 2HD PRO 29 6.989 5.981 5.543 235 H ALA 30 H ALA 30 9.493 3.560 1.435 236 HA ALA 30 HA ALA 30 11.533 3.002 0.596 237 1HB ALA 30 1HB ALA 30 13.073 4.848 0.030 238 2HB ALA 30 2HB ALA 30 12.038 5.956 0.933 239 3HB ALA 30 3HB ALA 30 11.420 5.148 -0.508 240 H ILE 31 H ILE 31 14.047 3.364 1.093 241 HA ILE 31 HA ILE 31 14.414 3.428 4.010 242 HB ILE 31 HB ILE 31 16.039 1.527 3.764 243 1HG1 ILE 31 1HG1 ILE 31 15.428 0.032 1.724 244 2HG1 ILE 31 2HG1 ILE 31 14.839 1.529 1.009 245 1HG2 ILE 31 1HG2 ILE 31 13.995 -0.140 3.272 246 2HG2 ILE 31 2HG2 ILE 31 13.101 1.355 3.547 247 3HG2 ILE 31 3HG2 ILE 31 14.189 0.736 4.790 248 1HD1 ILE 31 1HD1 ILE 31 17.433 0.548 0.958 249 2HD1 ILE 31 2HD1 ILE 31 17.474 1.881 2.113 250 3HD1 ILE 31 3HD1 ILE 31 16.892 2.154 0.471 251 H THR 32 H THR 32 16.640 3.774 4.685 252 HA THR 32 HA THR 32 18.501 4.742 2.676 253 HB THR 32 HB THR 32 18.786 6.869 4.175 254 HG1 THR 32 HG1 THR 32 17.358 6.909 5.704 255 1HG2 THR 32 1HG2 THR 32 16.489 6.554 2.262 256 2HG2 THR 32 2HG2 THR 32 18.125 7.099 1.892 257 3HG2 THR 32 3HG2 THR 32 17.067 8.098 2.889 258 H TRP 33 H TRP 33 20.600 5.433 3.728 259 HA TRP 33 HA TRP 33 21.140 3.655 6.009 260 1HB TRP 33 1HB TRP 33 22.317 3.514 3.617 261 2HB TRP 33 2HB TRP 33 23.364 4.729 4.344 262 HD1 TRP 33 HD1 TRP 33 22.101 1.145 5.127 263 HE1 TRP 33 HE1 TRP 33 23.968 -0.092 6.394 264 HE3 TRP 33 HE3 TRP 33 25.469 4.968 5.545 265 HZ2 TRP 33 HZ2 TRP 33 26.531 0.478 7.433 266 HZ3 TRP 33 HZ3 TRP 33 27.604 4.540 6.690 267 HH2 TRP 33 HH2 TRP 33 28.122 2.340 7.614 268 H HIS 34 H HIS 34 21.021 4.840 7.821 269 HA HIS 34 HA HIS 34 21.846 7.593 7.913 270 1HB HIS 34 1HB HIS 34 19.996 6.335 9.301 271 2HB HIS 34 2HB HIS 34 21.339 5.974 10.379 272 HD1 HIS 34 HD1 HIS 34 22.204 9.134 9.145 273 HD2 HIS 34 HD2 HIS 34 19.325 7.814 11.835 274 HE1 HIS 34 HE1 HIS 34 21.594 11.150 10.519 275 HE2 HIS 34 HE2 HIS 34 19.788 10.347 12.082 276 H ALA 35 H ALA 35 23.849 8.288 8.217 277 HA ALA 35 HA ALA 35 25.990 6.494 8.814 278 1HB ALA 35 1HB ALA 35 27.336 8.661 8.849 279 2HB ALA 35 2HB ALA 35 25.833 9.464 8.396 280 3HB ALA 35 3HB ALA 35 26.531 8.235 7.339 281 H ARG 36 H ARG 36 27.420 6.579 10.603 282 HA ARG 36 HA ARG 36 26.108 6.909 13.110 283 1HB ARG 36 1HB ARG 36 28.801 6.033 12.198 284 2HB ARG 36 2HB ARG 36 28.645 6.568 13.866 285 1HG ARG 36 1HG ARG 36 26.602 4.661 12.945 286 2HG ARG 36 2HG ARG 36 28.249 4.037 13.052 287 1HD ARG 36 1HD ARG 36 27.920 5.490 15.390 288 2HD ARG 36 2HD ARG 36 26.366 4.688 15.161 289 HE ARG 36 HE ARG 36 27.372 2.755 15.797 290 1HH1 ARG 36 1HH1 ARG 36 29.828 4.862 14.488 291 2HH1 ARG 36 2HH1 ARG 36 31.124 3.762 14.817 292 1HH2 ARG 36 1HH2 ARG 36 29.077 1.307 16.231 293 2HH2 ARG 36 2HH2 ARG 36 30.699 1.744 15.806 294 H PHE 37 H PHE 37 29.232 8.317 12.151 295 HA PHE 37 HA PHE 37 28.351 10.875 13.306 296 1HB PHE 37 1HB PHE 37 30.332 9.156 14.369 297 2HB PHE 37 2HB PHE 37 31.180 10.532 13.674 298 HD1 PHE 37 HD1 PHE 37 31.832 11.899 15.405 299 HD2 PHE 37 HD2 PHE 37 27.894 10.286 15.411 300 HE1 PHE 37 HE1 PHE 37 31.289 13.239 17.397 301 HE2 PHE 37 HE2 PHE 37 27.344 11.623 17.402 302 HZ PHE 37 HZ PHE 37 29.043 13.102 18.398 303 H ALA 38 H ALA 38 27.976 11.652 11.199 304 HA ALA 38 HA ALA 38 29.841 11.557 9.096 305 1HB ALA 38 1HB ALA 38 27.518 13.369 9.676 306 2HB ALA 38 2HB ALA 38 27.624 12.054 8.506 307 3HB ALA 38 3HB ALA 38 28.512 13.553 8.231 308 H TYR 39 H TYR 39 31.290 13.103 8.305 309 HA TYR 39 HA TYR 39 32.266 14.985 10.343 310 1HB TYR 39 1HB TYR 39 33.622 13.377 8.219 311 2HB TYR 39 2HB TYR 39 34.348 14.901 8.720 312 HD1 TYR 39 HD1 TYR 39 35.049 15.204 11.098 313 HD2 TYR 39 HD2 TYR 39 33.754 11.442 9.590 314 HE1 TYR 39 HE1 TYR 39 36.080 14.082 13.027 315 HE2 TYR 39 HE2 TYR 39 34.782 10.310 11.517 316 HH TYR 39 HH TYR 39 36.966 11.235 13.244 317 H ASP 40 H ASP 40 31.672 17.016 10.005 318 HA ASP 40 HA ASP 40 30.930 17.936 7.364 319 1HB ASP 40 1HB ASP 40 29.970 18.543 9.809 320 2HB ASP 40 2HB ASP 40 31.114 19.867 9.607 321 HD2 ASP 40 HD2 ASP 40 27.721 20.113 7.783 322 H LYS 41 H LYS 41 32.528 18.431 6.004 323 HA LYS 41 HA LYS 41 34.452 20.455 6.792 324 1HB LYS 41 1HB LYS 41 36.398 19.187 6.055 325 2HB LYS 41 2HB LYS 41 35.584 18.349 7.369 326 1HG LYS 41 1HG LYS 41 35.006 16.592 6.076 327 2HG LYS 41 2HG LYS 41 34.771 17.588 4.638 328 1HD LYS 41 1HD LYS 41 37.212 17.787 4.400 329 2HD LYS 41 2HD LYS 41 37.421 16.748 5.811 330 1HE LYS 41 1HE LYS 41 36.453 14.889 4.689 331 2HE LYS 41 2HE LYS 41 35.908 15.901 3.352 332 1HZ LYS 41 1HZ LYS 41 38.624 14.956 3.971 333 2HZ LYS 41 2HZ LYS 41 38.418 16.381 3.085 334 3HZ LYS 41 3HZ LYS 41 37.790 14.924 2.500 335 H GLU 42 H GLU 42 32.194 20.296 4.970 336 HA GLU 42 HA GLU 42 33.606 21.019 2.500 337 1HB GLU 42 1HB GLU 42 31.027 19.445 2.589 338 2HB GLU 42 2HB GLU 42 31.889 19.954 1.144 339 1HG GLU 42 1HG GLU 42 33.286 18.247 3.144 340 2HG GLU 42 2HG GLU 42 32.116 17.517 2.045 341 HE2 GLU 42 HE2 GLU 42 35.662 18.169 0.697 342 H LYS 43 H LYS 43 31.910 22.122 0.955 343 HA LYS 43 HA LYS 43 30.532 24.148 2.581 344 1HB LYS 43 1HB LYS 43 31.716 24.252 -0.190 345 2HB LYS 43 2HB LYS 43 30.647 25.505 0.427 346 1HG LYS 43 1HG LYS 43 33.179 24.685 1.823 347 2HG LYS 43 2HG LYS 43 33.114 25.963 0.607 348 1HD LYS 43 1HD LYS 43 31.076 26.699 2.238 349 2HD LYS 43 2HD LYS 43 32.174 25.948 3.396 350 1HE LYS 43 1HE LYS 43 33.121 27.989 3.444 351 2HE LYS 43 2HE LYS 43 33.912 27.442 1.967 352 1HZ LYS 43 1HZ LYS 43 31.286 28.739 1.774 353 2HZ LYS 43 2HZ LYS 43 32.557 28.716 0.659 354 3HZ LYS 43 3HZ LYS 43 32.653 29.702 2.031 355 H THR 44 H THR 44 29.382 21.567 1.927 356 HA THR 44 HA THR 44 27.260 22.312 0.037 357 HB THR 44 HB THR 44 28.414 20.214 -0.459 358 HG1 THR 44 HG1 THR 44 26.124 20.401 -0.833 359 1HG2 THR 44 1HG2 THR 44 27.422 19.261 2.215 360 2HG2 THR 44 2HG2 THR 44 29.104 19.544 1.771 361 3HG2 THR 44 3HG2 THR 44 28.186 18.264 0.977 362 H ASP 45 H ASP 45 25.075 22.077 0.588 363 HA ASP 45 HA ASP 45 24.368 21.398 3.319 364 1HB ASP 45 1HB ASP 45 24.982 23.834 3.351 365 2HB ASP 45 2HB ASP 45 23.664 24.125 2.220 366 HD2 ASP 45 HD2 ASP 45 21.722 24.594 5.010 367 H ARG 46 H ARG 46 23.272 19.697 2.209 368 HA ARG 46 HA ARG 46 20.680 20.557 1.136 369 1HB ARG 46 1HB ARG 46 22.481 18.456 -0.077 370 2HB ARG 46 2HB ARG 46 20.803 18.707 -0.538 371 1HG ARG 46 1HG ARG 46 22.351 21.159 -0.640 372 2HG ARG 46 2HG ARG 46 23.015 19.895 -1.677 373 1HD ARG 46 1HD ARG 46 21.301 21.413 -2.742 374 2HD ARG 46 2HD ARG 46 20.988 19.684 -2.876 375 HE ARG 46 HE ARG 46 19.688 20.664 -0.593 376 1HH1 ARG 46 1HH1 ARG 46 19.499 20.881 -4.071 377 2HH1 ARG 46 2HH1 ARG 46 17.791 21.171 -4.085 378 1HH2 ARG 46 1HH2 ARG 46 17.442 21.043 -0.610 379 2HH2 ARG 46 2HH2 ARG 46 16.624 21.263 -2.120 380 H TYR 47 H TYR 47 21.475 19.597 3.756 381 HA TYR 47 HA TYR 47 20.678 16.857 4.001 382 1HB TYR 47 1HB TYR 47 21.399 19.054 5.887 383 2HB TYR 47 2HB TYR 47 20.494 17.683 6.520 384 HD1 TYR 47 HD1 TYR 47 23.703 18.845 5.272 385 HD2 TYR 47 HD2 TYR 47 21.485 15.419 6.474 386 HE1 TYR 47 HE1 TYR 47 25.795 17.567 5.469 387 HE2 TYR 47 HE2 TYR 47 23.570 14.132 6.674 388 HH TYR 47 HH TYR 47 25.843 14.166 5.854 389 H ASN 48 H ASN 48 18.670 16.120 3.925 390 HA ASN 48 HA ASN 48 16.457 17.975 4.461 391 1HB ASN 48 1HB ASN 48 15.069 16.254 3.258 392 2HB ASN 48 2HB ASN 48 16.307 17.022 2.268 393 1HD2 ASN 48 1HD2 ASN 48 14.991 14.123 3.287 394 2HD2 ASN 48 2HD2 ASN 48 16.231 13.060 2.721 395 H GLU 49 H GLU 49 14.725 17.360 5.794 396 HA GLU 49 HA GLU 49 15.458 15.372 7.815 397 1HB GLU 49 1HB GLU 49 13.793 17.832 7.797 398 2HB GLU 49 2HB GLU 49 13.300 16.542 8.886 399 1HG GLU 49 1HG GLU 49 16.122 17.537 8.850 400 2HG GLU 49 2HG GLU 49 14.868 18.374 9.764 401 HE2 GLU 49 HE2 GLU 49 15.560 16.207 12.328 402 H ARG 50 H ARG 50 13.933 13.832 8.575 403 HA ARG 50 HA ARG 50 11.639 13.339 6.812 404 1HB ARG 50 1HB ARG 50 13.848 11.914 6.432 405 2HB ARG 50 2HB ARG 50 13.202 10.995 7.784 406 1HG ARG 50 1HG ARG 50 11.215 10.474 6.582 407 2HG ARG 50 2HG ARG 50 11.641 11.592 5.284 408 1HD ARG 50 1HD ARG 50 13.596 9.461 5.914 409 2HD ARG 50 2HD ARG 50 12.089 8.956 5.150 410 HE ARG 50 HE ARG 50 14.247 10.384 3.931 411 1HH1 ARG 50 1HH1 ARG 50 10.797 9.863 3.836 412 2HH1 ARG 50 2HH1 ARG 50 10.653 10.290 2.164 413 1HH2 ARG 50 1HH2 ARG 50 14.058 10.947 1.731 414 2HH2 ARG 50 2HH2 ARG 50 12.503 10.905 0.969 415 HA PRO 51 HA PRO 51 9.541 12.838 10.686 416 1HB PRO 51 1HB PRO 51 7.322 11.536 9.820 417 2HB PRO 51 2HB PRO 51 7.593 13.260 9.538 418 1HG PRO 51 1HG PRO 51 8.033 10.948 7.689 419 2HG PRO 51 2HG PRO 51 7.306 12.529 7.349 420 1HD PRO 51 1HD PRO 51 9.865 11.935 6.700 421 2HD PRO 51 2HD PRO 51 9.354 13.571 7.162 422 H TRP 52 H TRP 52 9.625 11.383 12.294 423 HA TRP 52 HA TRP 52 10.376 8.636 11.616 424 1HB TRP 52 1HB TRP 52 10.728 10.369 14.031 425 2HB TRP 52 2HB TRP 52 10.751 8.618 14.222 426 HD1 TRP 52 HD1 TRP 52 13.154 11.170 14.081 427 HE1 TRP 52 HE1 TRP 52 15.361 10.441 12.975 428 HE3 TRP 52 HE3 TRP 52 11.514 6.958 11.690 429 HZ2 TRP 52 HZ2 TRP 52 16.285 8.358 11.309 430 HZ3 TRP 52 HZ3 TRP 52 13.122 5.655 10.361 431 HH2 TRP 52 HH2 TRP 52 15.458 6.341 10.175 432 H GLY 53 H GLY 53 7.663 9.418 11.248 433 1HA GLY 53 1HA GLY 53 6.271 8.124 13.491 434 2HA GLY 53 2HA GLY 53 5.515 9.114 12.252 435 H GLY 54 H GLY 54 5.291 8.213 10.104 436 1HA GLY 54 1HA GLY 54 4.913 6.510 8.591 437 2HA GLY 54 2HA GLY 54 5.830 5.438 9.639 438 H GLY 55 H GLY 55 4.229 3.819 9.116 439 1HA GLY 55 1HA GLY 55 1.860 4.082 10.849 440 2HA GLY 55 2HA GLY 55 1.688 3.493 9.202 441 H PHE 56 H PHE 56 1.101 2.198 11.795 442 HA PHE 56 HA PHE 56 2.421 -0.321 11.211 443 1HB PHE 56 1HB PHE 56 2.957 -0.633 13.678 444 2HB PHE 56 2HB PHE 56 3.988 0.490 12.798 445 HD1 PHE 56 HD1 PHE 56 2.001 0.019 15.671 446 HD2 PHE 56 HD2 PHE 56 3.304 2.993 12.921 447 HE1 PHE 56 HE1 PHE 56 1.501 1.766 17.330 448 HE2 PHE 56 HE2 PHE 56 2.808 4.746 14.575 449 HZ PHE 56 HZ PHE 56 1.906 4.134 16.783 450 H GLY 57 H GLY 57 1.267 -2.125 11.901 451 1HA GLY 57 1HA GLY 57 -0.896 -2.049 13.715 452 2HA GLY 57 2HA GLY 57 -1.509 -1.875 12.077 453 H LEU 58 H LEU 58 -2.563 -3.827 11.978 454 HA LEU 58 HA LEU 58 -0.812 -6.173 11.795 455 1HB LEU 58 1HB LEU 58 -3.256 -5.852 13.482 456 2HB LEU 58 2HB LEU 58 -2.909 -7.421 12.779 457 HG LEU 58 HG LEU 58 -0.520 -6.950 13.875 458 1HD1 LEU 58 1HD1 LEU 58 -0.807 -4.876 14.864 459 2HD1 LEU 58 2HD1 LEU 58 -1.103 -5.988 16.201 460 3HD1 LEU 58 3HD1 LEU 58 -2.460 -5.231 15.367 461 1HD2 LEU 58 1HD2 LEU 58 -1.224 -8.315 15.753 462 2HD2 LEU 58 2HD2 LEU 58 -1.975 -8.892 14.265 463 3HD2 LEU 58 3HD2 LEU 58 -2.915 -7.943 15.416 464 H SER 59 H SER 59 -2.008 -8.045 10.734 465 HA SER 59 HA SER 59 -3.886 -7.044 8.700 466 1HB SER 59 1HB SER 59 -1.322 -7.638 8.095 467 2HB SER 59 2HB SER 59 -2.052 -9.232 7.901 468 HG SER 59 HG SER 59 -2.386 -6.928 6.405 469 H ARG 60 H ARG 60 -5.558 -8.381 8.145 470 HA ARG 60 HA ARG 60 -5.807 -10.844 9.737 471 1HB ARG 60 1HB ARG 60 -7.512 -8.668 9.578 472 2HB ARG 60 2HB ARG 60 -8.267 -9.851 8.518 473 1HG ARG 60 1HG ARG 60 -7.987 -11.494 10.459 474 2HG ARG 60 2HG ARG 60 -7.679 -10.065 11.448 475 1HD ARG 60 1HD ARG 60 -9.827 -9.255 11.178 476 2HD ARG 60 2HD ARG 60 -10.090 -10.157 9.687 477 HE ARG 60 HE ARG 60 -10.907 -11.871 10.944 478 1HH1 ARG 60 1HH1 ARG 60 -8.921 -9.867 12.998 479 2HH1 ARG 60 2HH1 ARG 60 -9.300 -10.750 14.438 480 1HH2 ARG 60 1HH2 ARG 60 -11.408 -13.032 12.837 481 2HH2 ARG 60 2HH2 ARG 60 -10.712 -12.547 14.347 482 H TRP 61 H TRP 61 -6.587 -12.733 8.780 483 HA TRP 61 HA TRP 61 -6.437 -12.761 5.838 484 1HB TRP 61 1HB TRP 61 -5.948 -15.125 7.648 485 2HB TRP 61 2HB TRP 61 -5.559 -14.975 5.937 486 HD1 TRP 61 HD1 TRP 61 -4.473 -13.379 9.305 487 HE1 TRP 61 HE1 TRP 61 -1.976 -12.778 9.123 488 HE3 TRP 61 HE3 TRP 61 -3.668 -14.700 4.430 489 HZ2 TRP 61 HZ2 TRP 61 0.063 -12.853 7.174 490 HZ3 TRP 61 HZ3 TRP 61 -1.417 -14.404 3.485 491 HH2 TRP 61 HH2 TRP 61 0.409 -13.499 4.829 492 H ASP 62 H ASP 62 -7.967 -13.897 4.668 493 HA ASP 62 HA ASP 62 -10.267 -14.919 6.198 494 1HB ASP 62 1HB ASP 62 -10.182 -12.738 4.334 495 2HB ASP 62 2HB ASP 62 -11.187 -14.024 3.669 496 HD2 ASP 62 HD2 ASP 62 -12.526 -13.029 7.227 497 H GLU 63 H GLU 63 -10.941 -16.898 5.679 498 HA GLU 63 HA GLU 63 -9.470 -18.612 4.061 499 1HB GLU 63 1HB GLU 63 -12.335 -18.841 4.991 500 2HB GLU 63 2HB GLU 63 -11.424 -20.154 4.259 501 1HG GLU 63 1HG GLU 63 -9.824 -20.083 6.091 502 2HG GLU 63 2HG GLU 63 -10.706 -18.741 6.819 503 HE2 GLU 63 HE2 GLU 63 -11.769 -22.103 8.073 504 H LYS 64 H LYS 64 -11.896 -16.339 3.174 505 HA LYS 64 HA LYS 64 -12.448 -17.644 0.633 506 1HB LYS 64 1HB LYS 64 -14.108 -16.289 2.159 507 2HB LYS 64 2HB LYS 64 -13.432 -14.904 1.312 508 1HG LYS 64 1HG LYS 64 -14.427 -15.440 -0.649 509 2HG LYS 64 2HG LYS 64 -14.333 -17.176 -0.350 510 1HD LYS 64 1HD LYS 64 -16.094 -15.674 1.470 511 2HD LYS 64 2HD LYS 64 -16.617 -15.728 -0.215 512 1HE LYS 64 1HE LYS 64 -16.603 -18.119 -0.213 513 2HE LYS 64 2HE LYS 64 -15.840 -18.165 1.376 514 1HZ LYS 64 1HZ LYS 64 -18.366 -16.736 1.214 515 2HZ LYS 64 2HZ LYS 64 -17.782 -17.773 2.417 516 3HZ LYS 64 3HZ LYS 64 -18.455 -18.413 1.003 517 H GLY 65 H GLY 65 -9.744 -16.564 1.306 518 1HA GLY 65 1HA GLY 65 -8.045 -15.543 0.152 519 2HA GLY 65 2HA GLY 65 -9.138 -15.455 -1.220 520 H ASN 66 H ASN 66 -9.058 -13.945 2.012 521 HA ASN 66 HA ASN 66 -9.104 -11.324 0.682 522 1HB ASN 66 1HB ASN 66 -11.148 -12.487 2.395 523 2HB ASN 66 2HB ASN 66 -10.557 -10.954 3.029 524 1HD2 ASN 66 1HD2 ASN 66 -11.406 -9.165 2.235 525 2HD2 ASN 66 2HD2 ASN 66 -12.326 -9.042 0.778 526 H TRP 67 H TRP 67 -7.325 -10.274 1.246 527 HA TRP 67 HA TRP 67 -6.174 -10.754 3.906 528 1HB TRP 67 1HB TRP 67 -4.870 -11.035 1.641 529 2HB TRP 67 2HB TRP 67 -4.721 -9.283 1.738 530 HD1 TRP 67 HD1 TRP 67 -4.573 -11.352 4.941 531 HE1 TRP 67 HE1 TRP 67 -2.187 -11.224 5.900 532 HE3 TRP 67 HE3 TRP 67 -2.260 -8.967 1.054 533 HZ2 TRP 67 HZ2 TRP 67 0.340 -10.243 5.113 534 HZ3 TRP 67 HZ3 TRP 67 0.143 -8.470 1.237 535 HH2 TRP 67 HH2 TRP 67 1.414 -9.095 3.226 536 H HIS 68 H HIS 68 -7.229 -9.339 5.222 537 HA HIS 68 HA HIS 68 -7.756 -6.626 4.450 538 1HB HIS 68 1HB HIS 68 -8.420 -8.382 6.679 539 2HB HIS 68 2HB HIS 68 -8.027 -6.751 7.214 540 HD1 HIS 68 HD1 HIS 68 -9.767 -4.971 6.853 541 HD2 HIS 68 HD2 HIS 68 -10.651 -8.505 4.856 542 HE1 HIS 68 HE1 HIS 68 -12.106 -4.681 5.977 543 HE2 HIS 68 HE2 HIS 68 -12.651 -6.865 4.847 544 H GLY 69 H GLY 69 -6.820 -4.742 5.304 545 1HA GLY 69 1HA GLY 69 -4.260 -5.115 6.717 546 2HA GLY 69 2HA GLY 69 -4.334 -4.121 5.271 547 H LEU 70 H LEU 70 -4.196 -3.955 8.510 548 HA LEU 70 HA LEU 70 -5.519 -1.329 8.539 549 1HB LEU 70 1HB LEU 70 -5.778 -3.567 10.518 550 2HB LEU 70 2HB LEU 70 -5.981 -1.902 11.031 551 HG LEU 70 HG LEU 70 -7.707 -1.806 9.058 552 1HD1 LEU 70 1HD1 LEU 70 -8.551 -3.742 8.248 553 2HD1 LEU 70 2HD1 LEU 70 -8.239 -4.632 9.738 554 3HD1 LEU 70 3HD1 LEU 70 -6.924 -4.320 8.606 555 1HD2 LEU 70 1HD2 LEU 70 -7.985 -2.857 11.825 556 2HD2 LEU 70 2HD2 LEU 70 -9.386 -2.931 10.756 557 3HD2 LEU 70 3HD2 LEU 70 -8.625 -1.378 11.105 558 H TYR 71 H TYR 71 -4.170 0.242 9.088 559 HA TYR 71 HA TYR 71 -2.145 -0.173 11.117 560 1HB TYR 71 1HB TYR 71 -0.371 0.812 9.552 561 2HB TYR 71 2HB TYR 71 -0.810 -0.875 9.306 562 HD1 TYR 71 HD1 TYR 71 -0.584 2.379 7.814 563 HD2 TYR 71 HD2 TYR 71 -2.443 -1.430 7.442 564 HE1 TYR 71 HE1 TYR 71 -1.095 2.864 5.458 565 HE2 TYR 71 HE2 TYR 71 -2.960 -0.955 5.085 566 HH TYR 71 HH TYR 71 -1.611 0.976 3.259 567 H ALA 72 H ALA 72 -1.818 1.630 12.278 568 HA ALA 72 HA ALA 72 -3.292 4.016 11.530 569 1HB ALA 72 1HB ALA 72 -3.654 3.708 13.749 570 2HB ALA 72 2HB ALA 72 -2.209 4.712 13.862 571 3HB ALA 72 3HB ALA 72 -2.079 2.960 14.017 572 H MET 73 H MET 73 -2.395 5.596 10.399 573 HA MET 73 HA MET 73 0.504 5.795 10.222 574 1HB MET 73 1HB MET 73 -1.374 6.018 8.314 575 2HB MET 73 2HB MET 73 -1.241 7.709 8.773 576 1HG MET 73 1HG MET 73 1.319 7.281 8.502 577 2HG MET 73 2HG MET 73 0.783 5.921 7.519 578 1HE MET 73 1HE MET 73 2.578 7.933 5.948 579 2HE MET 73 2HE MET 73 2.255 9.053 7.271 580 3HE MET 73 3HE MET 73 1.876 9.515 5.611 581 H ALA 74 H ALA 74 1.699 7.571 10.827 582 HA ALA 74 HA ALA 74 0.326 9.812 12.106 583 1HB ALA 74 1HB ALA 74 0.662 8.763 14.089 584 2HB ALA 74 2HB ALA 74 2.250 9.512 13.929 585 3HB ALA 74 3HB ALA 74 2.024 7.820 13.489 586 H PHE 75 H PHE 75 1.376 11.735 11.905 587 HA PHE 75 HA PHE 75 3.896 11.685 10.392 588 1HB PHE 75 1HB PHE 75 1.794 12.835 9.463 589 2HB PHE 75 2HB PHE 75 2.078 14.071 10.684 590 HD1 PHE 75 HD1 PHE 75 3.806 12.287 7.909 591 HD2 PHE 75 HD2 PHE 75 3.437 15.865 10.184 592 HE1 PHE 75 HE1 PHE 75 5.392 13.407 6.398 593 HE2 PHE 75 HE2 PHE 75 5.022 16.992 8.676 594 HZ PHE 75 HZ PHE 75 6.002 15.763 6.781 595 H LYS 76 H LYS 76 5.600 11.889 11.690 596 HA LYS 76 HA LYS 76 5.439 13.356 14.175 597 1HB LYS 76 1HB LYS 76 7.494 11.648 12.835 598 2HB LYS 76 2HB LYS 76 8.007 12.751 14.104 599 1HG LYS 76 1HG LYS 76 5.672 11.061 14.724 600 2HG LYS 76 2HG LYS 76 7.220 10.230 14.554 601 1HD LYS 76 1HD LYS 76 8.211 11.745 16.204 602 2HD LYS 76 2HD LYS 76 6.661 12.573 16.373 603 1HE LYS 76 1HE LYS 76 7.057 9.636 16.911 604 2HE LYS 76 2HE LYS 76 7.170 10.880 18.155 605 1HZ LYS 76 1HZ LYS 76 4.952 11.188 18.177 606 2HZ LYS 76 2HZ LYS 76 4.921 9.605 17.581 607 3HZ LYS 76 3HZ LYS 76 4.767 10.911 16.517 608 H ASP 77 H ASP 77 6.251 15.338 14.602 609 HA ASP 77 HA ASP 77 7.151 16.916 12.320 610 1HB ASP 77 1HB ASP 77 5.374 17.531 14.237 611 2HB ASP 77 2HB ASP 77 6.832 18.161 14.999 612 HD2 ASP 77 HD2 ASP 77 5.972 19.843 11.506 613 H SER 78 H SER 78 8.755 18.781 13.170 614 HA SER 78 HA SER 78 11.212 17.404 13.711 615 1HB SER 78 1HB SER 78 12.295 19.443 13.226 616 2HB SER 78 2HB SER 78 10.871 19.448 12.185 617 HG SER 78 HG SER 78 11.560 21.267 13.942 618 H TRP 79 H TRP 79 8.963 19.359 15.533 619 HA TRP 79 HA TRP 79 10.721 19.147 17.887 620 1HB TRP 79 1HB TRP 79 8.778 21.237 17.001 621 2HB TRP 79 2HB TRP 79 9.020 20.992 18.728 622 HD1 TRP 79 HD1 TRP 79 10.384 22.896 15.900 623 HE1 TRP 79 HE1 TRP 79 12.661 23.931 16.502 624 HE3 TRP 79 HE3 TRP 79 11.367 20.267 20.175 625 HZ2 TRP 79 HZ2 TRP 79 14.616 23.669 18.522 626 HZ3 TRP 79 HZ3 TRP 79 13.463 20.720 21.381 627 HH2 TRP 79 HH2 TRP 79 15.053 22.386 20.570 628 H ASN 80 H ASN 80 7.220 19.599 17.401 629 HA ASN 80 HA ASN 80 6.520 17.063 18.473 630 1HB ASN 80 1HB ASN 80 7.285 18.739 20.450 631 2HB ASN 80 2HB ASN 80 5.580 19.166 20.336 632 1HD2 ASN 80 1HD2 ASN 80 7.019 17.832 22.481 633 2HD2 ASN 80 2HD2 ASN 80 6.233 16.312 22.717 634 H LYS 81 H LYS 81 5.137 16.954 16.729 635 HA LYS 81 HA LYS 81 2.590 18.241 17.074 636 1HB LYS 81 1HB LYS 81 4.520 19.221 15.088 637 2HB LYS 81 2HB LYS 81 2.937 18.855 14.420 638 1HG LYS 81 1HG LYS 81 2.424 20.937 15.036 639 2HG LYS 81 2HG LYS 81 2.267 20.251 16.654 640 1HD LYS 81 1HD LYS 81 4.904 20.712 16.635 641 2HD LYS 81 2HD LYS 81 4.388 21.973 15.513 642 1HE LYS 81 1HE LYS 81 3.134 23.068 17.114 643 2HE LYS 81 2HE LYS 81 2.949 21.622 18.107 644 1HZ LYS 81 1HZ LYS 81 4.466 23.271 19.080 645 2HZ LYS 81 2HZ LYS 81 5.495 23.108 17.747 646 3HZ LYS 81 3HZ LYS 81 5.235 21.793 18.779 647 H TRP 82 H TRP 82 3.021 15.639 17.306 648 HA TRP 82 HA TRP 82 2.942 14.085 14.969 649 1HB TRP 82 1HB TRP 82 2.009 12.305 16.449 650 2HB TRP 82 2HB TRP 82 3.462 13.063 17.093 651 HD1 TRP 82 HD1 TRP 82 3.211 14.529 19.304 652 HE1 TRP 82 HE1 TRP 82 1.349 14.678 21.076 653 HE3 TRP 82 HE3 TRP 82 -0.545 12.192 16.739 654 HZ2 TRP 82 HZ2 TRP 82 -1.352 13.908 21.351 655 HZ3 TRP 82 HZ3 TRP 82 -2.736 11.938 17.828 656 HH2 TRP 82 HH2 TRP 82 -3.130 12.778 20.086 657 H GLU 83 H GLU 83 1.401 13.771 13.506 658 HA GLU 83 HA GLU 83 -1.284 14.797 14.067 659 1HB GLU 83 1HB GLU 83 0.245 15.344 11.965 660 2HB GLU 83 2HB GLU 83 -0.486 13.867 11.351 661 1HG GLU 83 1HG GLU 83 -2.651 14.778 11.439 662 2HG GLU 83 2HG GLU 83 -2.124 16.134 12.436 663 HE2 GLU 83 HE2 GLU 83 -1.745 16.381 8.526 664 HA PRO 84 HA PRO 84 -2.620 10.538 14.408 665 1HB PRO 84 1HB PRO 84 -5.233 11.015 14.855 666 2HB PRO 84 2HB PRO 84 -4.001 11.311 16.088 667 1HG PRO 84 1HG PRO 84 -5.343 13.253 14.248 668 2HG PRO 84 2HG PRO 84 -4.981 13.419 15.976 669 1HD PRO 84 1HD PRO 84 -3.451 14.531 14.012 670 2HD PRO 84 2HD PRO 84 -2.802 14.029 15.587 671 H ILE 85 H ILE 85 -2.963 9.194 12.760 672 HA ILE 85 HA ILE 85 -5.051 9.757 10.816 673 HB ILE 85 HB ILE 85 -2.258 9.144 9.857 674 1HG1 ILE 85 1HG1 ILE 85 -3.736 11.786 9.873 675 2HG1 ILE 85 2HG1 ILE 85 -2.310 11.393 10.829 676 1HG2 ILE 85 1HG2 ILE 85 -4.866 9.742 8.496 677 2HG2 ILE 85 2HG2 ILE 85 -3.806 8.348 8.287 678 3HG2 ILE 85 3HG2 ILE 85 -3.316 9.928 7.673 679 1HD1 ILE 85 1HD1 ILE 85 -0.920 11.788 9.126 680 2HD1 ILE 85 2HD1 ILE 85 -2.285 12.665 8.434 681 3HD1 ILE 85 3HD1 ILE 85 -1.972 10.998 7.952 682 H ALA 86 H ALA 86 -5.676 7.909 9.579 683 HA ALA 86 HA ALA 86 -4.549 5.347 10.464 684 1HB ALA 86 1HB ALA 86 -6.823 4.423 10.723 685 2HB ALA 86 2HB ALA 86 -7.485 6.038 10.465 686 3HB ALA 86 3HB ALA 86 -6.477 5.712 11.876 687 H GLY 87 H GLY 87 -4.890 3.592 9.021 688 1HA GLY 87 1HA GLY 87 -6.096 4.204 6.430 689 2HA GLY 87 2HA GLY 87 -4.382 3.818 6.440 690 H TYR 88 H TYR 88 -7.001 2.483 5.467 691 HA TYR 88 HA TYR 88 -6.109 -0.203 6.025 692 1HB TYR 88 1HB TYR 88 -8.362 -0.951 6.826 693 2HB TYR 88 2HB TYR 88 -7.504 0.085 7.962 694 HD1 TYR 88 HD1 TYR 88 -8.579 1.944 8.856 695 HD2 TYR 88 HD2 TYR 88 -10.077 0.221 5.267 696 HE1 TYR 88 HE1 TYR 88 -10.519 3.452 8.949 697 HE2 TYR 88 HE2 TYR 88 -12.021 1.725 5.348 698 HH TYR 88 HH TYR 88 -12.982 3.344 7.999 699 H GLY 89 H GLY 89 -6.813 -1.692 4.503 700 1HA GLY 89 1HA GLY 89 -8.911 -1.067 2.639 701 2HA GLY 89 2HA GLY 89 -7.307 -0.892 1.941 702 H TRP 90 H TRP 90 -8.421 -2.614 0.547 703 HA TRP 90 HA TRP 90 -8.174 -5.280 1.744 704 1HB TRP 90 1HB TRP 90 -9.517 -4.291 -0.770 705 2HB TRP 90 2HB TRP 90 -9.276 -6.003 -0.441 706 HD1 TRP 90 HD1 TRP 90 -10.201 -3.715 2.456 707 HE1 TRP 90 HE1 TRP 90 -12.592 -4.271 3.229 708 HE3 TRP 90 HE3 TRP 90 -11.550 -6.904 -1.306 709 HZ2 TRP 90 HZ2 TRP 90 -14.762 -5.851 2.360 710 HZ3 TRP 90 HZ3 TRP 90 -13.802 -7.896 -1.261 711 HH2 TRP 90 HH2 TRP 90 -15.374 -7.379 0.536 712 H GLU 91 H GLU 91 -6.939 -6.913 0.745 713 HA GLU 91 HA GLU 91 -5.076 -6.061 -1.349 714 1HB GLU 91 1HB GLU 91 -4.268 -6.071 1.239 715 2HB GLU 91 2HB GLU 91 -3.894 -7.728 0.785 716 1HG GLU 91 1HG GLU 91 -1.938 -6.782 0.188 717 2HG GLU 91 2HG GLU 91 -2.821 -6.484 -1.309 718 HE2 GLU 91 HE2 GLU 91 -2.626 -3.301 1.050 719 H SER 92 H SER 92 -4.759 -7.560 -2.876 720 HA SER 92 HA SER 92 -5.612 -10.321 -2.299 721 1HB SER 92 1HB SER 92 -5.777 -9.339 -5.097 722 2HB SER 92 2HB SER 92 -6.840 -10.444 -4.223 723 HG SER 92 HG SER 92 -7.993 -8.801 -3.512 724 H THR 93 H THR 93 -3.862 -11.564 -2.234 725 HA THR 93 HA THR 93 -1.563 -10.924 -3.921 726 HB THR 93 HB THR 93 -1.630 -13.171 -1.934 727 HG1 THR 93 HG1 THR 93 -1.012 -11.644 -0.345 728 1HG2 THR 93 1HG2 THR 93 0.401 -13.050 -3.147 729 2HG2 THR 93 2HG2 THR 93 0.710 -12.398 -1.538 730 3HG2 THR 93 3HG2 THR 93 0.512 -11.306 -2.909 731 H TRP 94 H TRP 94 -0.731 -12.297 -5.455 732 HA TRP 94 HA TRP 94 -2.343 -14.681 -6.088 733 1HB TRP 94 1HB TRP 94 -1.457 -12.432 -7.814 734 2HB TRP 94 2HB TRP 94 -1.395 -14.045 -8.517 735 HD1 TRP 94 HD1 TRP 94 -3.633 -11.242 -8.387 736 HE1 TRP 94 HE1 TRP 94 -6.083 -11.936 -8.765 737 HE3 TRP 94 HE3 TRP 94 -3.178 -16.278 -7.632 738 HZ2 TRP 94 HZ2 TRP 94 -7.619 -14.304 -8.746 739 HZ3 TRP 94 HZ3 TRP 94 -5.185 -17.687 -7.830 740 HH2 TRP 94 HH2 TRP 94 -7.359 -16.719 -8.374 741 H ARG 95 H ARG 95 -1.247 -16.528 -6.182 742 HA ARG 95 HA ARG 95 1.669 -16.408 -6.587 743 1HB ARG 95 1HB ARG 95 1.730 -18.477 -5.095 744 2HB ARG 95 2HB ARG 95 1.430 -16.935 -4.306 745 1HG ARG 95 1HG ARG 95 -0.794 -17.427 -3.898 746 2HG ARG 95 2HG ARG 95 -0.856 -18.662 -5.156 747 1HD ARG 95 1HD ARG 95 1.058 -19.661 -3.493 748 2HD ARG 95 2HD ARG 95 -0.021 -18.860 -2.352 749 HE ARG 95 HE ARG 95 -1.588 -20.477 -2.754 750 1HH1 ARG 95 1HH1 ARG 95 0.820 -20.595 -5.277 751 2HH1 ARG 95 2HH1 ARG 95 0.199 -22.053 -5.973 752 1HH2 ARG 95 1HH2 ARG 95 -2.406 -22.396 -3.668 753 2HH2 ARG 95 2HH2 ARG 95 -1.634 -23.076 -5.062 754 HA PRO 96 HA PRO 96 0.232 -18.886 -10.136 755 1HB PRO 96 1HB PRO 96 3.180 -18.879 -10.558 756 2HB PRO 96 2HB PRO 96 1.878 -18.533 -11.702 757 1HG PRO 96 1HG PRO 96 3.349 -16.561 -10.685 758 2HG PRO 96 2HG PRO 96 1.605 -16.360 -10.937 759 1HD PRO 96 1HD PRO 96 3.114 -16.842 -8.404 760 2HD PRO 96 2HD PRO 96 1.677 -15.837 -8.691 761 H LEU 97 H LEU 97 3.240 -19.629 -8.362 762 HA LEU 97 HA LEU 97 2.361 -22.434 -8.224 763 1HB LEU 97 1HB LEU 97 5.133 -21.395 -8.798 764 2HB LEU 97 2HB LEU 97 4.789 -23.061 -8.373 765 HG LEU 97 HG LEU 97 3.140 -22.906 -10.431 766 1HD1 LEU 97 1HD1 LEU 97 3.248 -20.816 -11.289 767 2HD1 LEU 97 2HD1 LEU 97 4.633 -21.496 -12.143 768 3HD1 LEU 97 3HD1 LEU 97 4.881 -20.532 -10.686 769 1HD2 LEU 97 1HD2 LEU 97 6.050 -23.074 -11.094 770 2HD2 LEU 97 2HD2 LEU 97 4.710 -24.067 -11.668 771 3HD2 LEU 97 3HD2 LEU 97 5.314 -24.266 -10.023 772 H ALA 98 H ALA 98 4.627 -20.052 -6.858 773 HA ALA 98 HA ALA 98 5.318 -19.653 -4.727 774 1HB ALA 98 1HB ALA 98 3.641 -20.562 -2.919 775 2HB ALA 98 2HB ALA 98 2.605 -20.813 -4.323 776 3HB ALA 98 3HB ALA 98 3.210 -19.199 -3.953 777 H ASP 99 H ASP 99 7.176 -20.826 -4.590 778 HA ASP 99 HA ASP 99 6.941 -23.581 -3.571 779 1HB ASP 99 1HB ASP 99 8.785 -22.326 -5.536 780 2HB ASP 99 2HB ASP 99 9.474 -23.534 -4.454 781 HD2 ASP 99 HD2 ASP 99 6.765 -24.743 -7.094 782 H GLU 100 H GLU 100 9.181 -20.802 -3.518 783 HA GLU 100 HA GLU 100 10.215 -21.647 -0.942 784 1HB GLU 100 1HB GLU 100 10.905 -19.332 -2.754 785 2HB GLU 100 2HB GLU 100 11.683 -19.619 -1.203 786 1HG GLU 100 1HG GLU 100 11.943 -22.042 -2.433 787 2HG GLU 100 2HG GLU 100 12.094 -20.918 -3.781 788 HE2 GLU 100 HE2 GLU 100 14.900 -20.832 -0.968 789 H ASN 101 H ASN 101 9.277 -18.400 -2.046 790 HA ASN 101 HA ASN 101 7.165 -18.032 -0.233 791 1HB ASN 101 1HB ASN 101 8.375 -16.407 1.312 792 2HB ASN 101 2HB ASN 101 8.709 -18.117 1.567 793 1HD2 ASN 101 1HD2 ASN 101 9.993 -15.062 0.740 794 2HD2 ASN 101 2HD2 ASN 101 11.640 -15.550 0.555 795 H PHE 102 H PHE 102 7.769 -17.438 -2.938 796 HA PHE 102 HA PHE 102 7.955 -14.509 -2.968 797 1HB PHE 102 1HB PHE 102 8.176 -14.859 -5.477 798 2HB PHE 102 2HB PHE 102 9.506 -15.459 -4.493 799 HD1 PHE 102 HD1 PHE 102 9.935 -17.816 -4.282 800 HD2 PHE 102 HD2 PHE 102 6.647 -16.392 -6.579 801 HE1 PHE 102 HE1 PHE 102 9.685 -20.043 -5.298 802 HE2 PHE 102 HE2 PHE 102 6.391 -18.616 -7.598 803 HZ PHE 102 HZ PHE 102 7.911 -20.446 -6.957 804 H HIS 103 H HIS 103 6.190 -13.320 -3.247 805 HA HIS 103 HA HIS 103 3.864 -14.518 -4.585 806 1HB HIS 103 1HB HIS 103 3.912 -13.074 -1.940 807 2HB HIS 103 2HB HIS 103 2.442 -13.220 -2.897 808 HD1 HIS 103 HD1 HIS 103 4.956 -15.353 -1.055 809 HD2 HIS 103 HD2 HIS 103 1.139 -15.628 -2.672 810 HE1 HIS 103 HE1 HIS 103 4.058 -17.571 -0.282 811 HE2 HIS 103 HE2 HIS 103 1.716 -17.679 -1.206 812 H LEU 104 H LEU 104 2.514 -13.070 -5.692 813 HA LEU 104 HA LEU 104 3.365 -10.275 -5.833 814 1HB LEU 104 1HB LEU 104 3.655 -12.285 -7.955 815 2HB LEU 104 2HB LEU 104 2.867 -10.806 -8.470 816 HG LEU 104 HG LEU 104 4.955 -9.714 -7.217 817 1HD1 LEU 104 1HD1 LEU 104 6.973 -11.077 -7.769 818 2HD1 LEU 104 2HD1 LEU 104 5.898 -12.441 -8.078 819 3HD1 LEU 104 3HD1 LEU 104 5.981 -11.732 -6.466 820 1HD2 LEU 104 1HD2 LEU 104 5.881 -9.309 -9.327 821 2HD2 LEU 104 2HD2 LEU 104 4.168 -9.581 -9.647 822 3HD2 LEU 104 3HD2 LEU 104 5.338 -10.862 -9.962 823 H GLY 105 H GLY 105 1.656 -8.982 -5.708 824 1HA GLY 105 1HA GLY 105 -0.813 -9.636 -7.076 825 2HA GLY 105 2HA GLY 105 -0.925 -9.647 -5.322 826 H LEU 106 H LEU 106 -2.491 -7.931 -5.590 827 HA LEU 106 HA LEU 106 -1.247 -5.345 -5.380 828 1HB LEU 106 1HB LEU 106 -2.457 -4.262 -7.157 829 2HB LEU 106 2HB LEU 106 -1.515 -5.584 -7.820 830 HG LEU 106 HG LEU 106 -4.354 -6.132 -7.121 831 1HD1 LEU 106 1HD1 LEU 106 -4.975 -4.295 -8.288 832 2HD1 LEU 106 2HD1 LEU 106 -4.684 -5.368 -9.656 833 3HD1 LEU 106 3HD1 LEU 106 -3.451 -4.204 -9.173 834 1HD2 LEU 106 1HD2 LEU 106 -2.402 -7.031 -9.224 835 2HD2 LEU 106 2HD2 LEU 106 -4.118 -7.437 -9.279 836 3HD2 LEU 106 3HD2 LEU 106 -3.126 -7.979 -7.924 837 H GLY 107 H GLY 107 -2.786 -3.665 -4.717 838 1HA GLY 107 1HA GLY 107 -5.457 -4.457 -3.974 839 2HA GLY 107 2HA GLY 107 -4.364 -4.314 -2.606 840 H PHE 108 H PHE 108 -6.105 -2.673 -2.078 841 HA PHE 108 HA PHE 108 -5.146 -0.053 -2.951 842 1HB PHE 108 1HB PHE 108 -7.591 0.706 -3.034 843 2HB PHE 108 2HB PHE 108 -7.005 -0.256 -4.388 844 HD1 PHE 108 HD1 PHE 108 -9.097 -0.281 -1.367 845 HD2 PHE 108 HD2 PHE 108 -7.876 -2.429 -4.831 846 HE1 PHE 108 HE1 PHE 108 -10.935 -1.878 -1.018 847 HE2 PHE 108 HE2 PHE 108 -9.712 -4.031 -4.489 848 HZ PHE 108 HZ PHE 108 -11.244 -3.757 -2.581 849 H THR 109 H THR 109 -4.728 1.165 -1.240 850 HA THR 109 HA THR 109 -5.983 0.471 1.322 851 HB THR 109 HB THR 109 -4.118 1.527 2.400 852 HG1 THR 109 HG1 THR 109 -3.395 2.408 -0.193 853 1HG2 THR 109 1HG2 THR 109 -3.741 -0.627 0.634 854 2HG2 THR 109 2HG2 THR 109 -2.799 -0.208 2.064 855 3HG2 THR 109 3HG2 THR 109 -2.328 0.418 0.485 856 H ALA 110 H ALA 110 -7.315 1.841 2.339 857 HA ALA 110 HA ALA 110 -7.686 4.512 1.152 858 1HB ALA 110 1HB ALA 110 -9.751 3.627 0.854 859 2HB ALA 110 2HB ALA 110 -9.961 4.186 2.514 860 3HB ALA 110 3HB ALA 110 -9.581 2.493 2.195 861 H GLY 111 H GLY 111 -6.900 6.115 2.339 862 1HA GLY 111 1HA GLY 111 -6.525 5.727 5.216 863 2HA GLY 111 2HA GLY 111 -5.808 7.001 4.241 864 H VAL 112 H VAL 112 -7.256 7.191 6.776 865 HA VAL 112 HA VAL 112 -9.269 9.142 5.910 866 HB VAL 112 HB VAL 112 -10.685 8.425 7.892 867 1HG1 VAL 112 1HG1 VAL 112 -11.725 7.877 5.946 868 2HG1 VAL 112 2HG1 VAL 112 -11.407 6.248 6.544 869 3HG1 VAL 112 3HG1 VAL 112 -10.344 6.967 5.334 870 1HG2 VAL 112 1HG2 VAL 112 -8.859 7.048 8.921 871 2HG2 VAL 112 2HG2 VAL 112 -9.126 5.858 7.648 872 3HG2 VAL 112 3HG2 VAL 112 -10.417 6.233 8.789 873 H THR 113 H THR 113 -9.120 11.038 6.937 874 HA THR 113 HA THR 113 -7.742 11.147 9.527 875 HB THR 113 HB THR 113 -6.033 11.770 7.984 876 HG1 THR 113 HG1 THR 113 -6.466 13.211 9.828 877 1HG2 THR 113 1HG2 THR 113 -7.874 13.813 6.776 878 2HG2 THR 113 2HG2 THR 113 -7.515 12.248 6.047 879 3HG2 THR 113 3HG2 THR 113 -6.224 13.427 6.288 880 H ALA 114 H ALA 114 -9.235 11.878 10.891 881 HA ALA 114 HA ALA 114 -11.072 13.989 9.981 882 1HB ALA 114 1HB ALA 114 -12.718 13.088 11.240 883 2HB ALA 114 2HB ALA 114 -11.615 12.595 12.526 884 3HB ALA 114 3HB ALA 114 -11.748 11.626 11.059 885 H ARG 115 H ARG 115 -11.196 15.911 11.031 886 HA ARG 115 HA ARG 115 -9.899 16.301 13.588 887 1HB ARG 115 1HB ARG 115 -8.738 17.254 11.029 888 2HB ARG 115 2HB ARG 115 -8.734 18.394 12.368 889 1HG ARG 115 1HG ARG 115 -7.776 16.208 13.611 890 2HG ARG 115 2HG ARG 115 -7.181 15.926 11.974 891 1HD ARG 115 1HD ARG 115 -5.642 17.532 12.156 892 2HD ARG 115 2HD ARG 115 -6.807 18.678 12.819 893 HE ARG 115 HE ARG 115 -4.945 17.052 14.284 894 1HH1 ARG 115 1HH1 ARG 115 -7.974 18.776 14.444 895 2HH1 ARG 115 2HH1 ARG 115 -7.911 18.981 16.162 896 1HH2 ARG 115 1HH2 ARG 115 -4.860 17.320 16.544 897 2HH2 ARG 115 2HH2 ARG 115 -6.143 18.155 17.355 898 H ASP 116 H ASP 116 -11.467 17.304 14.661 899 HA ASP 116 HA ASP 116 -12.316 19.902 14.044 900 1HB ASP 116 1HB ASP 116 -13.932 17.727 12.892 901 2HB ASP 116 2HB ASP 116 -14.855 18.912 13.810 902 HD2 ASP 116 HD2 ASP 116 -13.736 21.453 11.520 903 H ASN 117 H ASN 117 -13.132 16.855 15.624 904 HA ASN 117 HA ASN 117 -13.778 16.359 17.746 905 1HB ASN 117 1HB ASN 117 -12.422 18.992 18.063 906 2HB ASN 117 2HB ASN 117 -13.389 18.407 19.414 907 1HD2 ASN 117 1HD2 ASN 117 -11.046 17.104 17.084 908 2HD2 ASN 117 2HD2 ASN 117 -10.123 16.224 18.249 909 H TRP 118 H TRP 118 -15.722 17.320 15.922 910 HA TRP 118 HA TRP 118 -17.808 17.991 17.780 911 1HB TRP 118 1HB TRP 118 -16.538 20.162 16.753 912 2HB TRP 118 2HB TRP 118 -17.788 19.915 15.539 913 HD1 TRP 118 HD1 TRP 118 -20.285 19.215 17.173 914 HE1 TRP 118 HE1 TRP 118 -21.333 20.878 18.833 915 HE3 TRP 118 HE3 TRP 118 -16.219 22.202 18.005 916 HZ2 TRP 118 HZ2 TRP 118 -20.542 23.156 20.302 917 HZ3 TRP 118 HZ3 TRP 118 -16.449 24.101 19.552 918 HH2 TRP 118 HH2 TRP 118 -18.566 24.568 20.675 919 H ASN 119 H ASN 119 -16.887 17.768 14.360 920 HA ASN 119 HA ASN 119 -19.542 16.757 13.688 921 1HB ASN 119 1HB ASN 119 -17.180 17.667 12.062 922 2HB ASN 119 2HB ASN 119 -18.489 16.749 11.322 923 1HD2 ASN 119 1HD2 ASN 119 -20.726 17.675 12.255 924 2HD2 ASN 119 2HD2 ASN 119 -20.903 19.374 12.001 925 H TYR 120 H TYR 120 -19.286 14.970 11.804 926 HA TYR 120 HA TYR 120 -17.439 12.899 12.771 927 1HB TYR 120 1HB TYR 120 -20.410 12.767 12.542 928 2HB TYR 120 2HB TYR 120 -19.483 11.322 12.152 929 HD1 TYR 120 HD1 TYR 120 -19.987 13.855 14.833 930 HD2 TYR 120 HD2 TYR 120 -18.757 9.901 13.856 931 HE1 TYR 120 HE1 TYR 120 -19.837 13.316 17.228 932 HE2 TYR 120 HE2 TYR 120 -18.603 9.350 16.248 933 HH TYR 120 HH TYR 120 -18.247 10.662 18.420 934 H ILE 121 H ILE 121 -17.119 14.582 10.517 935 HA ILE 121 HA ILE 121 -17.453 12.643 8.319 936 HB ILE 121 HB ILE 121 -17.245 15.635 7.996 937 1HG1 ILE 121 1HG1 ILE 121 -19.793 14.924 7.225 938 2HG1 ILE 121 2HG1 ILE 121 -19.538 13.928 8.653 939 1HG2 ILE 121 1HG2 ILE 121 -17.643 13.329 6.142 940 2HG2 ILE 121 2HG2 ILE 121 -16.581 14.727 5.984 941 3HG2 ILE 121 3HG2 ILE 121 -18.318 14.907 5.737 942 1HD1 ILE 121 1HD1 ILE 121 -20.354 16.569 8.588 943 2HD1 ILE 121 2HD1 ILE 121 -18.666 16.642 9.094 944 3HD1 ILE 121 3HD1 ILE 121 -19.816 15.661 10.002 945 HA PRO 122 HA PRO 122 -12.919 13.018 8.880 946 1HB PRO 122 1HB PRO 122 -12.347 10.565 7.875 947 2HB PRO 122 2HB PRO 122 -12.847 10.820 9.550 948 1HG PRO 122 1HG PRO 122 -14.474 9.918 7.204 949 2HG PRO 122 2HG PRO 122 -14.472 9.301 8.867 950 1HD PRO 122 1HD PRO 122 -16.365 11.005 7.944 951 2HD PRO 122 2HD PRO 122 -15.821 11.004 9.634 952 H LEU 123 H LEU 123 -11.205 12.030 7.094 953 HA LEU 123 HA LEU 123 -12.118 13.061 4.488 954 1HB LEU 123 1HB LEU 123 -10.482 14.498 5.886 955 2HB LEU 123 2HB LEU 123 -9.282 13.298 5.440 956 HG LEU 123 HG LEU 123 -10.178 13.838 2.997 957 1HD1 LEU 123 1HD1 LEU 123 -11.785 15.528 4.253 958 2HD1 LEU 123 2HD1 LEU 123 -11.113 15.883 2.662 959 3HD1 LEU 123 3HD1 LEU 123 -10.379 16.581 4.106 960 1HD2 LEU 123 1HD2 LEU 123 -8.426 15.803 3.086 961 2HD2 LEU 123 2HD2 LEU 123 -7.926 14.123 3.274 962 3HD2 LEU 123 3HD2 LEU 123 -8.117 15.150 4.694 963 HA PRO 124 HA PRO 124 -10.653 8.767 3.773 964 1HB PRO 124 1HB PRO 124 -12.432 8.198 1.821 965 2HB PRO 124 2HB PRO 124 -12.841 8.086 3.537 966 1HG PRO 124 1HG PRO 124 -13.437 10.278 1.585 967 2HG PRO 124 2HG PRO 124 -14.492 9.560 2.817 968 1HD PRO 124 1HD PRO 124 -13.197 11.924 3.173 969 2HD PRO 124 2HD PRO 124 -13.581 10.823 4.511 970 H VAL 125 H VAL 125 -9.408 7.931 2.103 971 HA VAL 125 HA VAL 125 -9.204 9.337 -0.421 972 HB VAL 125 HB VAL 125 -6.686 9.552 -0.164 973 1HG1 VAL 125 1HG1 VAL 125 -6.910 11.752 0.382 974 2HG1 VAL 125 2HG1 VAL 125 -7.950 11.418 1.766 975 3HG1 VAL 125 3HG1 VAL 125 -8.610 11.357 0.131 976 1HG2 VAL 125 1HG2 VAL 125 -7.389 9.352 2.765 977 2HG2 VAL 125 2HG2 VAL 125 -5.813 9.781 2.100 978 3HG2 VAL 125 3HG2 VAL 125 -6.467 8.163 1.845 979 H LEU 126 H LEU 126 -8.981 7.852 -1.954 980 HA LEU 126 HA LEU 126 -8.072 5.177 -1.224 981 1HB LEU 126 1HB LEU 126 -9.395 6.249 -3.714 982 2HB LEU 126 2HB LEU 126 -8.885 4.583 -3.519 983 HG LEU 126 HG LEU 126 -10.421 4.783 -1.341 984 1HD1 LEU 126 1HD1 LEU 126 -10.865 7.239 -2.339 985 2HD1 LEU 126 2HD1 LEU 126 -12.046 6.344 -1.382 986 3HD1 LEU 126 3HD1 LEU 126 -12.153 6.342 -3.143 987 1HD2 LEU 126 1HD2 LEU 126 -11.026 3.048 -2.661 988 2HD2 LEU 126 2HD2 LEU 126 -10.934 3.998 -4.143 989 3HD2 LEU 126 3HD2 LEU 126 -12.341 4.141 -3.090 990 H LEU 127 H LEU 127 -6.290 4.191 -2.050 991 HA LEU 127 HA LEU 127 -4.734 5.504 -4.130 992 1HB LEU 127 1HB LEU 127 -3.923 6.508 -2.048 993 2HB LEU 127 2HB LEU 127 -3.608 4.911 -1.392 994 HG LEU 127 HG LEU 127 -2.093 4.738 -3.584 995 1HD1 LEU 127 1HD1 LEU 127 -2.914 7.277 -3.902 996 2HD1 LEU 127 2HD1 LEU 127 -1.358 6.674 -4.473 997 3HD1 LEU 127 3HD1 LEU 127 -1.460 7.542 -2.942 998 1HD2 LEU 127 1HD2 LEU 127 -1.259 4.341 -1.379 999 2HD2 LEU 127 2HD2 LEU 127 -1.369 6.053 -0.973 1000 3HD2 LEU 127 3HD2 LEU 127 -0.191 5.503 -2.165 1001 HA PRO 128 HA PRO 128 -4.445 1.033 -4.767 1002 1HB PRO 128 1HB PRO 128 -4.018 1.103 -7.410 1003 2HB PRO 128 2HB PRO 128 -5.615 1.423 -6.725 1004 1HG PRO 128 1HG PRO 128 -3.554 3.356 -7.709 1005 2HG PRO 128 2HG PRO 128 -5.310 3.375 -7.951 1006 1HD PRO 128 1HD PRO 128 -3.997 4.882 -6.065 1007 2HD PRO 128 2HD PRO 128 -5.694 4.383 -5.934 1008 H LEU 129 H LEU 129 -2.726 -0.345 -4.874 1009 HA LEU 129 HA LEU 129 -0.182 0.542 -5.947 1010 1HB LEU 129 1HB LEU 129 0.957 -0.219 -3.773 1011 2HB LEU 129 2HB LEU 129 0.234 1.375 -3.821 1012 HG LEU 129 HG LEU 129 -0.146 0.051 -1.706 1013 1HD1 LEU 129 1HD1 LEU 129 -2.837 0.576 -2.773 1014 2HD1 LEU 129 2HD1 LEU 129 -1.681 1.901 -2.912 1015 3HD1 LEU 129 3HD1 LEU 129 -2.039 1.204 -1.332 1016 1HD2 LEU 129 1HD2 LEU 129 -0.585 -2.092 -3.031 1017 2HD2 LEU 129 2HD2 LEU 129 -2.207 -1.449 -3.288 1018 3HD2 LEU 129 3HD2 LEU 129 -1.629 -1.755 -1.650 1019 H ALA 130 H ALA 130 1.511 -1.338 -5.323 1020 HA ALA 130 HA ALA 130 0.151 -3.874 -5.967 1021 1HB ALA 130 1HB ALA 130 1.826 -2.604 -7.622 1022 2HB ALA 130 2HB ALA 130 1.690 -4.361 -7.556 1023 3HB ALA 130 3HB ALA 130 2.997 -3.546 -6.699 1024 H SER 131 H SER 131 0.816 -5.742 -4.936 1025 HA SER 131 HA SER 131 2.566 -5.329 -2.606 1026 1HB SER 131 1HB SER 131 0.031 -6.082 -2.446 1027 2HB SER 131 2HB SER 131 0.718 -7.671 -2.781 1028 HG SER 131 HG SER 131 0.877 -6.120 -0.516 1029 H VAL 132 H VAL 132 4.437 -6.383 -2.526 1030 HA VAL 132 HA VAL 132 4.758 -8.843 -4.097 1031 HB VAL 132 HB VAL 132 6.864 -6.685 -3.982 1032 1HG1 VAL 132 1HG1 VAL 132 7.252 -9.295 -4.408 1033 2HG1 VAL 132 2HG1 VAL 132 8.201 -8.043 -5.208 1034 3HG1 VAL 132 3HG1 VAL 132 6.848 -8.797 -6.052 1035 1HG2 VAL 132 1HG2 VAL 132 4.849 -7.310 -6.132 1036 2HG2 VAL 132 2HG2 VAL 132 6.300 -6.344 -6.401 1037 3HG2 VAL 132 3HG2 VAL 132 5.068 -5.788 -5.269 1038 H GLY 133 H GLY 133 5.256 -10.411 -2.715 1039 1HA GLY 133 1HA GLY 133 6.727 -9.733 -0.264 1040 2HA GLY 133 2HA GLY 133 5.773 -11.186 -0.518 1041 H TYR 134 H TYR 134 8.864 -9.914 -0.424 1042 HA TYR 134 HA TYR 134 9.944 -12.362 -1.642 1043 1HB TYR 134 1HB TYR 134 10.376 -9.638 -2.497 1044 2HB TYR 134 2HB TYR 134 11.896 -10.363 -1.985 1045 HD1 TYR 134 HD1 TYR 134 12.156 -12.907 -2.893 1046 HD2 TYR 134 HD2 TYR 134 9.868 -9.826 -4.731 1047 HE1 TYR 134 HE1 TYR 134 12.330 -14.073 -5.052 1048 HE2 TYR 134 HE2 TYR 134 10.035 -10.984 -6.893 1049 HH TYR 134 HH TYR 134 12.171 -13.613 -7.411 1050 H GLY 135 H GLY 135 10.910 -13.496 -0.100 1051 1HA GLY 135 1HA GLY 135 12.181 -14.034 1.734 1052 2HA GLY 135 2HA GLY 135 13.057 -12.540 1.430 1053 HA PRO 136 HA PRO 136 11.012 -11.927 5.489 1054 1HB PRO 136 1HB PRO 136 13.041 -10.602 6.657 1055 2HB PRO 136 2HB PRO 136 13.027 -12.365 6.522 1056 1HG PRO 136 1HG PRO 136 14.460 -10.347 4.837 1057 2HG PRO 136 2HG PRO 136 15.052 -11.891 5.477 1058 1HD PRO 136 1HD PRO 136 14.175 -11.564 2.913 1059 2HD PRO 136 2HD PRO 136 14.080 -13.104 3.789 1060 H VAL 137 H VAL 137 11.939 -9.915 2.960 1061 HA VAL 137 HA VAL 137 10.824 -7.545 4.313 1062 HB VAL 137 HB VAL 137 12.620 -7.522 1.890 1063 1HG1 VAL 137 1HG1 VAL 137 12.910 -5.107 2.755 1064 2HG1 VAL 137 2HG1 VAL 137 11.420 -5.415 3.646 1065 3HG1 VAL 137 3HG1 VAL 137 11.434 -5.525 1.886 1066 1HG2 VAL 137 1HG2 VAL 137 14.465 -7.023 3.275 1067 2HG2 VAL 137 2HG2 VAL 137 13.685 -8.426 4.006 1068 3HG2 VAL 137 3HG2 VAL 137 13.441 -6.821 4.697 1069 H THR 138 H THR 138 9.469 -6.147 3.061 1070 HA THR 138 HA THR 138 8.215 -7.454 0.738 1071 HB THR 138 HB THR 138 6.167 -5.991 1.781 1072 HG1 THR 138 HG1 THR 138 7.509 -7.125 4.002 1073 1HG2 THR 138 1HG2 THR 138 5.983 -8.315 1.079 1074 2HG2 THR 138 2HG2 THR 138 5.238 -8.052 2.657 1075 3HG2 THR 138 3HG2 THR 138 6.819 -8.825 2.546 1076 H PHE 139 H PHE 139 7.547 -6.128 -0.936 1077 HA PHE 139 HA PHE 139 8.307 -3.290 -0.706 1078 1HB PHE 139 1HB PHE 139 9.434 -5.247 -2.399 1079 2HB PHE 139 2HB PHE 139 8.449 -4.215 -3.430 1080 HD1 PHE 139 HD1 PHE 139 9.041 -1.929 -3.830 1081 HD2 PHE 139 HD2 PHE 139 11.329 -4.333 -1.164 1082 HE1 PHE 139 HE1 PHE 139 10.831 -0.240 -3.847 1083 HE2 PHE 139 HE2 PHE 139 13.121 -2.647 -1.176 1084 HZ PHE 139 HZ PHE 139 12.874 -0.598 -2.519 1085 H GLN 140 H GLN 140 7.018 -1.784 -1.756 1086 HA GLN 140 HA GLN 140 4.555 -2.794 -3.002 1087 1HB GLN 140 1HB GLN 140 4.804 -0.783 -0.777 1088 2HB GLN 140 2HB GLN 140 3.400 -0.813 -1.834 1089 1HG GLN 140 1HG GLN 140 3.505 -3.404 -1.125 1090 2HG GLN 140 2HG GLN 140 4.198 -2.658 0.315 1091 1HE2 GLN 140 1HE2 GLN 140 2.093 -3.782 1.030 1092 2HE2 GLN 140 2HE2 GLN 140 0.697 -2.765 1.096 1093 H MET 141 H MET 141 3.555 -1.364 -4.494 1094 HA MET 141 HA MET 141 5.224 0.902 -5.352 1095 1HB MET 141 1HB MET 141 5.249 -1.376 -6.738 1096 2HB MET 141 2HB MET 141 3.788 -0.680 -7.423 1097 1HG MET 141 1HG MET 141 5.130 0.352 -8.856 1098 2HG MET 141 2HG MET 141 5.551 1.416 -7.515 1099 1HE MET 141 1HE MET 141 8.569 -0.892 -6.103 1100 2HE MET 141 2HE MET 141 6.868 -0.698 -5.680 1101 3HE MET 141 3HE MET 141 7.904 0.721 -5.845 1102 H THR 142 H THR 142 4.097 2.720 -5.274 1103 HA THR 142 HA THR 142 1.181 2.614 -5.355 1104 HB THR 142 HB THR 142 2.968 4.982 -4.781 1105 HG1 THR 142 HG1 THR 142 3.292 4.094 -2.928 1106 1HG2 THR 142 1HG2 THR 142 0.083 4.519 -4.071 1107 2HG2 THR 142 2HG2 THR 142 0.663 5.583 -5.352 1108 3HG2 THR 142 3HG2 THR 142 1.053 5.935 -3.669 1109 H TYR 143 H TYR 143 0.173 2.897 -7.224 1110 HA TYR 143 HA TYR 143 1.162 4.922 -9.088 1111 1HB TYR 143 1HB TYR 143 2.065 2.713 -9.816 1112 2HB TYR 143 2HB TYR 143 0.412 2.129 -9.972 1113 HD1 TYR 143 HD1 TYR 143 2.498 5.014 -11.125 1114 HD2 TYR 143 HD2 TYR 143 -0.523 2.173 -12.079 1115 HE1 TYR 143 HE1 TYR 143 2.418 5.880 -13.426 1116 HE2 TYR 143 HE2 TYR 143 -0.610 3.031 -14.381 1117 HH TYR 143 HH TYR 143 -0.063 5.104 -15.597 1118 H ILE 144 H ILE 144 -0.443 6.241 -9.599 1119 HA ILE 144 HA ILE 144 -3.205 5.282 -9.324 1120 HB ILE 144 HB ILE 144 -2.288 8.149 -9.500 1121 1HG1 ILE 144 1HG1 ILE 144 -2.956 6.551 -7.019 1122 2HG1 ILE 144 2HG1 ILE 144 -1.326 6.988 -7.520 1123 1HG2 ILE 144 1HG2 ILE 144 -4.824 7.246 -8.227 1124 2HG2 ILE 144 2HG2 ILE 144 -4.727 7.311 -9.987 1125 3HG2 ILE 144 3HG2 ILE 144 -4.445 8.768 -9.033 1126 1HD1 ILE 144 1HD1 ILE 144 -2.739 8.402 -5.764 1127 2HD1 ILE 144 2HD1 ILE 144 -3.265 9.196 -7.249 1128 3HD1 ILE 144 3HD1 ILE 144 -1.550 9.129 -6.845 1129 HA PRO 145 HA PRO 145 -2.941 5.486 -13.872 1130 1HB PRO 145 1HB PRO 145 -5.126 3.939 -14.317 1131 2HB PRO 145 2HB PRO 145 -3.532 3.267 -13.952 1132 1HG PRO 145 1HG PRO 145 -5.871 3.692 -12.132 1133 2HG PRO 145 2HG PRO 145 -4.784 2.295 -12.249 1134 1HD PRO 145 1HD PRO 145 -4.526 4.180 -10.324 1135 2HD PRO 145 2HD PRO 145 -3.133 3.316 -11.004 1136 H GLY 146 H GLY 146 -3.828 7.011 -15.131 1137 1HA GLY 146 1HA GLY 146 -6.585 7.867 -14.637 1138 2HA GLY 146 2HA GLY 146 -5.320 9.080 -14.522 1139 H THR 147 H THR 147 -7.317 9.478 -16.300 1140 HA THR 147 HA THR 147 -6.080 8.846 -18.900 1141 HB THR 147 HB THR 147 -8.259 7.817 -18.736 1142 HG1 THR 147 HG1 THR 147 -8.451 10.176 -20.295 1143 1HG2 THR 147 1HG2 THR 147 -9.899 8.679 -17.541 1144 2HG2 THR 147 2HG2 THR 147 -10.040 9.994 -18.708 1145 3HG2 THR 147 3HG2 THR 147 -8.983 10.167 -17.307 1146 H TYR 148 H TYR 148 -5.122 10.520 -19.824 1147 HA TYR 148 HA TYR 148 -4.596 12.639 -20.465 1148 1HB TYR 148 1HB TYR 148 -7.223 12.387 -21.001 1149 2HB TYR 148 2HB TYR 148 -7.291 13.714 -19.847 1150 HD1 TYR 148 HD1 TYR 148 -7.437 15.777 -20.854 1151 HD2 TYR 148 HD2 TYR 148 -5.052 12.774 -22.698 1152 HE1 TYR 148 HE1 TYR 148 -6.832 17.359 -22.635 1153 HE2 TYR 148 HE2 TYR 148 -4.440 14.349 -24.484 1154 HH TYR 148 HH TYR 148 -5.010 17.676 -24.277 1155 H ASN 149 H ASN 149 -4.262 11.884 -17.700 1156 HA ASN 149 HA ASN 149 -4.692 14.453 -16.334 1157 1HB ASN 149 1HB ASN 149 -4.816 11.668 -15.465 1158 2HB ASN 149 2HB ASN 149 -3.810 12.659 -14.412 1159 1HD2 ASN 149 1HD2 ASN 149 -5.159 12.718 -12.688 1160 2HD2 ASN 149 2HD2 ASN 149 -6.704 13.490 -12.700 1161 H ASN 150 H ASN 150 -2.272 11.945 -16.962 1162 HA ASN 150 HA ASN 150 0.002 11.986 -16.984 1163 1HB ASN 150 1HB ASN 150 -0.760 14.782 -17.640 1164 2HB ASN 150 2HB ASN 150 0.917 14.503 -17.179 1165 1HD2 ASN 150 1HD2 ASN 150 -1.312 14.430 -19.672 1166 2HD2 ASN 150 2HD2 ASN 150 -0.369 13.573 -20.840 1167 H GLY 151 H GLY 151 1.982 13.092 -15.844 1168 1HA GLY 151 1HA GLY 151 2.985 13.874 -13.900 1169 2HA GLY 151 2HA GLY 151 1.390 14.230 -13.254 1170 H ASN 152 H ASN 152 2.174 11.084 -14.535 1171 HA ASN 152 HA ASN 152 1.576 9.877 -11.982 1172 1HB ASN 152 1HB ASN 152 2.427 8.563 -14.572 1173 2HB ASN 152 2HB ASN 152 1.725 7.755 -13.173 1174 1HD2 ASN 152 1HD2 ASN 152 -0.453 7.876 -12.810 1175 2HD2 ASN 152 2HD2 ASN 152 -1.567 8.533 -13.955 1176 H VAL 153 H VAL 153 3.030 9.453 -10.469 1177 HA VAL 153 HA VAL 153 5.830 9.019 -11.285 1178 HB VAL 153 HB VAL 153 6.429 9.931 -8.993 1179 1HG1 VAL 153 1HG1 VAL 153 6.609 11.137 -11.223 1180 2HG1 VAL 153 2HG1 VAL 153 6.576 12.146 -9.777 1181 3HG1 VAL 153 3HG1 VAL 153 5.127 11.978 -10.768 1182 1HG2 VAL 153 1HG2 VAL 153 3.782 9.822 -8.487 1183 2HG2 VAL 153 2HG2 VAL 153 3.942 11.512 -8.965 1184 3HG2 VAL 153 3HG2 VAL 153 4.902 10.879 -7.628 1185 H TYR 154 H TYR 154 6.599 7.082 -10.782 1186 HA TYR 154 HA TYR 154 5.083 5.228 -9.229 1187 1HB TYR 154 1HB TYR 154 7.933 4.958 -10.206 1188 2HB TYR 154 2HB TYR 154 6.864 3.652 -9.704 1189 HD1 TYR 154 HD1 TYR 154 4.516 3.687 -11.052 1190 HD2 TYR 154 HD2 TYR 154 8.217 5.230 -12.471 1191 HE1 TYR 154 HE1 TYR 154 3.723 3.444 -13.366 1192 HE2 TYR 154 HE2 TYR 154 7.434 4.992 -14.790 1193 HH TYR 154 HH TYR 154 5.310 4.860 -16.012 1194 H PHE 155 H PHE 155 5.008 5.205 -7.089 1195 HA PHE 155 HA PHE 155 7.320 6.197 -5.573 1196 1HB PHE 155 1HB PHE 155 4.540 6.644 -5.317 1197 2HB PHE 155 2HB PHE 155 5.022 5.687 -3.920 1198 HD1 PHE 155 HD1 PHE 155 6.391 8.561 -5.875 1199 HD2 PHE 155 HD2 PHE 155 5.549 6.893 -2.052 1200 HE1 PHE 155 HE1 PHE 155 7.275 10.590 -4.800 1201 HE2 PHE 155 HE2 PHE 155 6.430 8.919 -0.969 1202 HZ PHE 155 HZ PHE 155 7.294 10.771 -2.343 1203 H ALA 156 H ALA 156 8.344 4.958 -4.064 1204 HA ALA 156 HA ALA 156 7.607 2.111 -4.024 1205 1HB ALA 156 1HB ALA 156 9.904 2.926 -4.861 1206 2HB ALA 156 2HB ALA 156 9.850 1.563 -3.742 1207 3HB ALA 156 3HB ALA 156 10.271 3.172 -3.154 1208 H TRP 157 H TRP 157 7.302 1.031 -2.125 1209 HA TRP 157 HA TRP 157 7.573 2.571 0.368 1210 1HB TRP 157 1HB TRP 157 5.172 1.227 -0.755 1211 2HB TRP 157 2HB TRP 157 5.438 1.062 0.978 1212 HD1 TRP 157 HD1 TRP 157 5.088 3.881 -1.660 1213 HE1 TRP 157 HE1 TRP 157 4.029 5.921 -0.503 1214 HE3 TRP 157 HE3 TRP 157 4.892 2.090 3.124 1215 HZ2 TRP 157 HZ2 TRP 157 3.217 6.672 2.096 1216 HZ3 TRP 157 HZ3 TRP 157 3.960 3.532 4.886 1217 HH2 TRP 157 HH2 TRP 157 3.140 5.776 4.381 1218 H MET 158 H MET 158 8.079 1.389 2.220 1219 HA MET 158 HA MET 158 9.022 -1.351 1.694 1220 1HB MET 158 1HB MET 158 10.809 0.237 2.249 1221 2HB MET 158 2HB MET 158 9.990 0.644 3.750 1222 1HG MET 158 1HG MET 158 10.203 -2.045 3.992 1223 2HG MET 158 2HG MET 158 11.660 -1.667 3.074 1224 1HE MET 158 1HE MET 158 11.000 -1.179 7.479 1225 2HE MET 158 2HE MET 158 10.453 -2.416 6.348 1226 3HE MET 158 3HE MET 158 9.641 -0.852 6.404 1227 H ARG 159 H ARG 159 8.404 -3.004 3.000 1228 HA ARG 159 HA ARG 159 6.737 -2.368 5.335 1229 1HB ARG 159 1HB ARG 159 5.237 -2.895 3.471 1230 2HB ARG 159 2HB ARG 159 6.081 -4.415 3.208 1231 1HG ARG 159 1HG ARG 159 5.434 -4.907 5.671 1232 2HG ARG 159 2HG ARG 159 4.235 -3.637 5.420 1233 1HD ARG 159 1HD ARG 159 4.315 -5.555 3.234 1234 2HD ARG 159 2HD ARG 159 3.945 -6.308 4.784 1235 HE ARG 159 HE ARG 159 2.329 -4.093 4.647 1236 1HH1 ARG 159 1HH1 ARG 159 2.819 -6.961 2.718 1237 2HH1 ARG 159 2HH1 ARG 159 1.183 -7.010 2.152 1238 1HH2 ARG 159 1HH2 ARG 159 0.177 -4.157 3.902 1239 2HH2 ARG 159 2HH2 ARG 159 -0.317 -5.418 2.822 1240 H PHE 160 H PHE 160 6.873 -3.795 7.044 1241 HA PHE 160 HA PHE 160 8.774 -6.022 6.747 1242 1HB PHE 160 1HB PHE 160 9.848 -4.098 7.881 1243 2HB PHE 160 2HB PHE 160 8.595 -4.150 9.117 1244 HD1 PHE 160 HD1 PHE 160 11.104 -6.394 7.509 1245 HD2 PHE 160 HD2 PHE 160 9.040 -5.284 11.061 1246 HE1 PHE 160 HE1 PHE 160 12.442 -8.015 8.788 1247 HE2 PHE 160 HE2 PHE 160 10.374 -6.903 12.347 1248 HZ PHE 160 HZ PHE 160 12.079 -8.270 11.211 1249 H GLN 161 H GLN 161 8.385 -7.854 7.998 1250 HA GLN 161 HA GLN 161 5.803 -7.900 9.416 1251 1HB GLN 161 1HB GLN 161 6.969 -9.979 7.563 1252 2HB GLN 161 2HB GLN 161 5.602 -10.285 8.626 1253 1HG GLN 161 1HG GLN 161 5.303 -7.909 6.952 1254 2HG GLN 161 2HG GLN 161 5.434 -9.420 6.053 1255 1HE2 GLN 161 1HE2 GLN 161 3.710 -10.711 5.926 1256 2HE2 GLN 161 2HE2 GLN 161 2.225 -10.472 6.774 1257 H PHE 162 H PHE 162 5.833 -8.705 11.422 1258 HA PHE 162 HA PHE 162 8.312 -10.011 12.330 1259 1HB PHE 162 1HB PHE 162 7.510 -7.739 13.321 1260 2HB PHE 162 2HB PHE 162 6.337 -8.722 14.189 1261 HD1 PHE 162 HD1 PHE 162 9.972 -9.034 13.390 1262 HD2 PHE 162 HD2 PHE 162 6.931 -9.086 16.366 1263 HE1 PHE 162 HE1 PHE 162 11.666 -9.530 15.105 1264 HE2 PHE 162 HE2 PHE 162 8.619 -9.582 18.087 1265 HZ PHE 162 HZ PHE 162 10.989 -9.805 17.458 1266 H LEU 163 H LEU 163 8.153 -12.106 12.732 1267 HA LEU 163 HA LEU 163 5.631 -13.157 13.814 1268 1HB LEU 163 1HB LEU 163 7.290 -14.500 11.680 1269 2HB LEU 163 2HB LEU 163 5.828 -15.139 12.407 1270 HG LEU 163 HG LEU 163 5.604 -12.491 11.093 1271 1HD1 LEU 163 1HD1 LEU 163 5.757 -15.028 9.478 1272 2HD1 LEU 163 2HD1 LEU 163 7.041 -13.822 9.560 1273 3HD1 LEU 163 3HD1 LEU 163 5.470 -13.394 8.882 1274 1HD2 LEU 163 1HD2 LEU 163 3.421 -13.204 10.626 1275 2HD2 LEU 163 2HD2 LEU 163 3.761 -13.833 12.238 1276 3HD2 LEU 163 3HD2 LEU 163 3.837 -14.904 10.839 1277 H GLU 164 H GLU 164 5.893 -15.292 14.859 1278 HA GLU 164 HA GLU 164 8.578 -15.564 16.046 1279 1HB GLU 164 1HB GLU 164 5.871 -15.542 17.256 1280 2HB GLU 164 2HB GLU 164 7.008 -16.713 17.911 1281 1HG GLU 164 1HG GLU 164 8.240 -15.143 18.926 1282 2HG GLU 164 2HG GLU 164 8.088 -14.008 17.585 1283 HE2 GLU 164 HE2 GLU 164 6.152 -12.321 19.937 1284 H HIS 165 H HIS 165 9.569 -17.444 15.738 1285 HA HIS 165 HA HIS 165 8.014 -19.679 14.648 1286 1HB HIS 165 1HB HIS 165 11.016 -19.310 14.693 1287 2HB HIS 165 2HB HIS 165 10.124 -20.553 13.821 1288 HD1 HIS 165 HD1 HIS 165 9.964 -16.741 13.907 1289 HD2 HIS 165 HD2 HIS 165 10.010 -19.903 11.212 1290 HE1 HIS 165 HE1 HIS 165 9.840 -15.685 11.628 1291 HE2 HIS 165 HE2 HIS 165 9.958 -17.613 10.011 1292 H HIS 166 H HIS 166 8.037 -19.009 17.489 1293 HA HIS 166 HA HIS 166 8.157 -20.048 19.508 1294 1HB HIS 166 1HB HIS 166 8.083 -22.256 17.544 1295 2HB HIS 166 2HB HIS 166 8.662 -22.689 19.149 1296 HD1 HIS 166 HD1 HIS 166 5.604 -21.615 17.305 1297 HD2 HIS 166 HD2 HIS 166 6.731 -22.570 21.188 1298 HE1 HIS 166 HE1 HIS 166 3.454 -21.873 18.584 1299 HE2 HIS 166 HE2 HIS 166 4.164 -22.365 20.951 1300 H HIS 167 H HIS 167 9.867 -19.427 20.661 1301 HA HIS 167 HA HIS 167 12.261 -21.030 20.621 1302 1HB HIS 167 1HB HIS 167 12.163 -18.478 19.232 1303 2HB HIS 167 2HB HIS 167 13.381 -18.478 20.504 1304 HD1 HIS 167 HD1 HIS 167 15.536 -19.656 20.014 1305 HD2 HIS 167 HD2 HIS 167 12.562 -20.568 17.259 1306 HE1 HIS 167 HE1 HIS 167 16.677 -20.981 18.208 1307 HE2 HIS 167 HE2 HIS 167 14.842 -21.597 16.596 1308 H HIS 168 H HIS 168 10.993 -17.889 21.738 1309 HA HIS 168 HA HIS 168 12.283 -18.247 24.315 1310 1HB HIS 168 1HB HIS 168 10.561 -16.004 23.242 1311 2HB HIS 168 2HB HIS 168 11.356 -15.995 24.812 1312 HD1 HIS 168 HD1 HIS 168 13.848 -15.462 24.867 1313 HD2 HIS 168 HD2 HIS 168 12.300 -15.714 21.019 1314 HE1 HIS 168 HE1 HIS 168 15.649 -14.565 23.358 1315 HE2 HIS 168 HE2 HIS 168 14.656 -14.649 21.043 1316 H HIS 169 H HIS 169 11.275 -18.670 26.223 1317 HA HIS 169 HA HIS 169 8.366 -18.796 26.323 1318 1HB HIS 169 1HB HIS 169 9.715 -21.087 25.713 1319 2HB HIS 169 2HB HIS 169 9.648 -21.191 27.469 1320 HD1 HIS 169 HD1 HIS 169 6.721 -19.624 27.311 1321 HD2 HIS 169 HD2 HIS 169 7.862 -23.254 25.641 1322 HE1 HIS 169 HE1 HIS 169 4.584 -20.904 26.960 1323 HE2 HIS 169 HE2 HIS 169 5.307 -23.129 26.026 1324 H HIS 170 H HIS 170 10.262 -17.057 27.552 1325 HA HIS 170 HA HIS 170 10.605 -17.901 30.287 1326 1HB HIS 170 1HB HIS 170 11.394 -15.575 28.640 1327 2HB HIS 170 2HB HIS 170 11.131 -15.242 30.349 1328 HD1 HIS 170 HD1 HIS 170 13.561 -14.908 30.980 1329 HD2 HIS 170 HD2 HIS 170 12.852 -18.549 29.109 1330 HE1 HIS 170 HE1 HIS 170 15.686 -16.226 31.247 1331 HE2 HIS 170 HE2 HIS 170 15.262 -18.392 30.032 Start of MODEL 17 1 1H MET 1 1H MET 1 -8.305 -34.594 9.990 2 2H MET 1 2H MET 1 -7.721 -33.615 11.273 3 H MET 1 H MET 1 -8.595 -35.135 11.339 4 3H MET 1 3H MET 1 -8.396 -35.156 11.607 5 HA MET 1 HA MET 1 -6.634 -36.234 10.484 6 1HB MET 1 1HB MET 1 -5.874 -33.390 9.852 7 2HB MET 1 2HB MET 1 -4.686 -34.685 9.799 8 1HG MET 1 1HG MET 1 -6.052 -35.858 8.139 9 2HG MET 1 2HG MET 1 -7.219 -34.538 8.179 10 1HE MET 1 1HE MET 1 -6.026 -33.604 4.815 11 2HE MET 1 2HE MET 1 -6.984 -32.703 5.990 12 3HE MET 1 3HE MET 1 -7.205 -34.445 5.821 13 H ASN 2 H ASN 2 -6.290 -37.044 12.515 14 HA ASN 2 HA ASN 2 -5.280 -37.344 14.530 15 1HB ASN 2 1HB ASN 2 -3.412 -35.300 13.327 16 2HB ASN 2 2HB ASN 2 -3.121 -36.048 14.894 17 1HD2 ASN 2 1HD2 ASN 2 -3.624 -36.747 11.479 18 2HD2 ASN 2 2HD2 ASN 2 -2.702 -38.207 11.456 19 H ALA 3 H ALA 3 -6.880 -36.654 15.896 20 HA ALA 3 HA ALA 3 -7.621 -34.006 16.392 21 1HB ALA 3 1HB ALA 3 -8.561 -34.926 18.537 22 2HB ALA 3 2HB ALA 3 -7.850 -36.477 18.094 23 3HB ALA 3 3HB ALA 3 -9.084 -35.748 17.067 24 H ASP 4 H ASP 4 -4.859 -35.772 17.437 25 HA ASP 4 HA ASP 4 -4.310 -34.179 19.762 26 1HB ASP 4 1HB ASP 4 -2.045 -35.307 19.618 27 2HB ASP 4 2HB ASP 4 -3.424 -36.391 19.775 28 HD2 ASP 4 HD2 ASP 4 -3.041 -37.323 16.339 29 H GLU 5 H GLU 5 -2.940 -34.390 16.490 30 HA GLU 5 HA GLU 5 -1.279 -32.073 16.897 31 1HB GLU 5 1HB GLU 5 -1.926 -33.553 14.340 32 2HB GLU 5 2HB GLU 5 -0.634 -32.380 14.560 33 1HG GLU 5 1HG GLU 5 0.493 -33.851 16.103 34 2HG GLU 5 2HG GLU 5 -0.837 -35.006 16.017 35 HE2 GLU 5 HE2 GLU 5 0.292 -35.350 12.474 36 H TRP 6 H TRP 6 -4.453 -32.741 15.676 37 HA TRP 6 HA TRP 6 -4.786 -30.393 14.119 38 1HB TRP 6 1HB TRP 6 -6.212 -32.486 14.025 39 2HB TRP 6 2HB TRP 6 -6.979 -31.933 15.509 40 HD1 TRP 6 HD1 TRP 6 -8.625 -29.835 15.337 41 HE1 TRP 6 HE1 TRP 6 -9.820 -28.742 13.336 42 HE3 TRP 6 HE3 TRP 6 -5.932 -31.939 11.535 43 HZ2 TRP 6 HZ2 TRP 6 -9.645 -28.770 10.519 44 HZ3 TRP 6 HZ3 TRP 6 -6.510 -31.353 9.215 45 HH2 TRP 6 HH2 TRP 6 -8.328 -29.802 8.720 46 H MET 7 H MET 7 -5.180 -31.117 17.520 47 HA MET 7 HA MET 7 -6.559 -28.672 18.127 48 1HB MET 7 1HB MET 7 -6.266 -29.334 20.470 49 2HB MET 7 2HB MET 7 -6.898 -30.661 19.504 50 1HG MET 7 1HG MET 7 -4.920 -31.853 19.607 51 2HG MET 7 2HG MET 7 -3.962 -30.425 19.993 52 1HE MET 7 1HE MET 7 -3.618 -33.229 21.689 53 2HE MET 7 2HE MET 7 -3.350 -32.404 23.225 54 3HE MET 7 3HE MET 7 -2.688 -31.731 21.736 55 H THR 8 H THR 8 -3.242 -29.761 18.059 56 HA THR 8 HA THR 8 -2.141 -27.624 19.570 57 HB THR 8 HB THR 8 -0.002 -28.332 18.281 58 HG1 THR 8 HG1 THR 8 -0.135 -30.151 17.114 59 1HG2 THR 8 1HG2 THR 8 -0.612 -29.082 20.588 60 2HG2 THR 8 2HG2 THR 8 0.377 -30.211 19.662 61 3HG2 THR 8 3HG2 THR 8 -1.351 -30.503 19.852 62 H THR 9 H THR 9 -2.646 -28.152 16.109 63 HA THR 9 HA THR 9 -1.372 -25.736 15.295 64 HB THR 9 HB THR 9 -2.907 -26.261 13.182 65 HG1 THR 9 HG1 THR 9 -4.029 -27.909 14.473 66 1HG2 THR 9 1HG2 THR 9 -0.317 -27.139 14.017 67 2HG2 THR 9 2HG2 THR 9 -0.912 -26.780 12.396 68 3HG2 THR 9 3HG2 THR 9 -1.109 -28.398 13.069 69 H PHE 10 H PHE 10 -4.658 -26.632 16.133 70 HA PHE 10 HA PHE 10 -5.835 -24.187 15.224 71 1HB PHE 10 1HB PHE 10 -6.795 -26.670 16.018 72 2HB PHE 10 2HB PHE 10 -7.337 -25.587 17.294 73 HD1 PHE 10 HD1 PHE 10 -8.323 -27.045 14.365 74 HD2 PHE 10 HD2 PHE 10 -8.214 -23.221 16.230 75 HE1 PHE 10 HE1 PHE 10 -10.179 -26.298 12.932 76 HE2 PHE 10 HE2 PHE 10 -10.070 -22.467 14.802 77 HZ PHE 10 HZ PHE 10 -11.056 -24.006 13.151 78 H ARG 11 H ARG 11 -4.429 -25.326 18.209 79 HA ARG 11 HA ARG 11 -5.473 -23.489 20.016 80 1HB ARG 11 1HB ARG 11 -3.651 -25.518 20.152 81 2HB ARG 11 2HB ARG 11 -2.622 -24.114 20.388 82 1HG ARG 11 1HG ARG 11 -4.255 -23.389 22.181 83 2HG ARG 11 2HG ARG 11 -4.958 -25.003 22.050 84 1HD ARG 11 1HD ARG 11 -2.550 -25.845 22.391 85 2HD ARG 11 2HD ARG 11 -2.212 -24.210 22.959 86 HE ARG 11 HE ARG 11 -3.358 -24.672 24.888 87 1HH1 ARG 11 1HH1 ARG 11 -4.055 -27.147 22.528 88 2HH1 ARG 11 2HH1 ARG 11 -4.889 -28.163 23.655 89 1HH2 ARG 11 1HH2 ARG 11 -4.455 -26.009 26.373 90 2HH2 ARG 11 2HH2 ARG 11 -5.116 -27.517 25.837 91 H GLU 12 H GLU 12 -2.978 -23.108 17.602 92 HA GLU 12 HA GLU 12 -2.000 -20.611 18.612 93 1HB GLU 12 1HB GLU 12 -0.795 -22.314 17.080 94 2HB GLU 12 2HB GLU 12 -1.682 -21.544 15.772 95 1HG GLU 12 1HG GLU 12 -0.305 -19.672 17.545 96 2HG GLU 12 2HG GLU 12 0.764 -20.779 16.685 97 HE2 GLU 12 HE2 GLU 12 0.514 -18.774 13.931 98 H ASN 13 H ASN 13 -4.359 -21.609 16.200 99 HA ASN 13 HA ASN 13 -4.797 -19.017 15.116 100 1HB ASN 13 1HB ASN 13 -6.406 -21.568 15.047 101 2HB ASN 13 2HB ASN 13 -6.939 -20.092 14.247 102 1HD2 ASN 13 1HD2 ASN 13 -6.783 -21.826 12.481 103 2HD2 ASN 13 2HD2 ASN 13 -5.299 -21.857 11.596 104 H ILE 14 H ILE 14 -6.489 -20.958 17.558 105 HA ILE 14 HA ILE 14 -8.561 -19.105 18.047 106 HB ILE 14 HB ILE 14 -8.934 -20.331 20.147 107 1HG1 ILE 14 1HG1 ILE 14 -6.448 -21.873 19.369 108 2HG1 ILE 14 2HG1 ILE 14 -6.560 -20.736 20.708 109 1HG2 ILE 14 1HG2 ILE 14 -9.817 -22.170 19.121 110 2HG2 ILE 14 2HG2 ILE 14 -8.374 -22.461 18.151 111 3HG2 ILE 14 3HG2 ILE 14 -9.488 -21.168 17.708 112 1HD1 ILE 14 1HD1 ILE 14 -6.951 -22.578 21.913 113 2HD1 ILE 14 2HD1 ILE 14 -7.465 -23.513 20.508 114 3HD1 ILE 14 3HD1 ILE 14 -8.595 -22.413 21.298 115 H ALA 15 H ALA 15 -5.337 -19.491 19.399 116 HA ALA 15 HA ALA 15 -5.591 -17.774 21.601 117 1HB ALA 15 1HB ALA 15 -3.183 -17.696 21.631 118 2HB ALA 15 2HB ALA 15 -3.107 -18.262 19.962 119 3HB ALA 15 3HB ALA 15 -3.704 -19.333 21.232 120 H GLN 16 H GLN 16 -4.200 -17.076 18.387 121 HA GLN 16 HA GLN 16 -3.788 -14.352 18.758 122 1HB GLN 16 1HB GLN 16 -4.045 -16.158 16.430 123 2HB GLN 16 2HB GLN 16 -4.318 -14.451 16.105 124 1HG GLN 16 1HG GLN 16 -1.988 -15.172 15.732 125 2HG GLN 16 2HG GLN 16 -2.143 -13.881 16.921 126 1HE2 GLN 16 1HE2 GLN 16 -0.315 -14.271 18.059 127 2HE2 GLN 16 2HE2 GLN 16 -0.030 -15.712 18.968 128 H THR 17 H THR 17 -6.618 -16.018 17.398 129 HA THR 17 HA THR 17 -8.125 -13.705 16.862 130 HB THR 17 HB THR 17 -10.068 -15.230 16.791 131 HG1 THR 17 HG1 THR 17 -8.221 -17.168 17.724 132 1HG2 THR 17 1HG2 THR 17 -8.430 -17.086 15.444 133 2HG2 THR 17 2HG2 THR 17 -7.727 -15.486 15.208 134 3HG2 THR 17 3HG2 THR 17 -9.407 -15.786 14.763 135 H TRP 18 H TRP 18 -7.609 -15.544 19.780 136 HA TRP 18 HA TRP 18 -9.796 -14.682 21.294 137 1HB TRP 18 1HB TRP 18 -7.633 -16.312 21.742 138 2HB TRP 18 2HB TRP 18 -7.287 -14.947 22.798 139 HD1 TRP 18 HD1 TRP 18 -8.489 -14.921 25.076 140 HE1 TRP 18 HE1 TRP 18 -10.367 -16.306 26.162 141 HE3 TRP 18 HE3 TRP 18 -9.941 -17.654 21.006 142 HZ2 TRP 18 HZ2 TRP 18 -12.221 -18.293 25.395 143 HZ3 TRP 18 HZ3 TRP 18 -11.774 -19.275 21.266 144 HH2 TRP 18 HH2 TRP 18 -12.888 -19.587 23.416 145 H GLN 19 H GLN 19 -6.487 -13.350 21.213 146 HA GLN 19 HA GLN 19 -7.061 -11.128 22.849 147 1HB GLN 19 1HB GLN 19 -4.780 -11.923 22.490 148 2HB GLN 19 2HB GLN 19 -4.879 -11.501 20.787 149 1HG GLN 19 1HG GLN 19 -3.888 -9.603 21.406 150 2HG GLN 19 2HG GLN 19 -5.490 -9.130 21.969 151 1HE2 GLN 19 1HE2 GLN 19 -5.997 -9.871 24.242 152 2HE2 GLN 19 2HE2 GLN 19 -4.736 -9.695 25.410 153 H GLN 20 H GLN 20 -6.117 -10.865 19.428 154 HA GLN 20 HA GLN 20 -8.390 -9.679 18.409 155 1HB GLN 20 1HB GLN 20 -6.966 -7.914 20.179 156 2HB GLN 20 2HB GLN 20 -6.912 -7.273 18.542 157 1HG GLN 20 1HG GLN 20 -9.550 -8.098 18.921 158 2HG GLN 20 2HG GLN 20 -9.082 -7.312 20.428 159 1HE2 GLN 20 1HE2 GLN 20 -7.281 -5.443 19.394 160 2HE2 GLN 20 2HE2 GLN 20 -8.165 -4.283 18.468 161 HA PRO 21 HA PRO 21 -4.749 -8.529 15.517 162 1HB PRO 21 1HB PRO 21 -2.218 -8.601 16.434 163 2HB PRO 21 2HB PRO 21 -3.260 -7.192 16.668 164 1HG PRO 21 1HG PRO 21 -2.590 -9.391 18.587 165 2HG PRO 21 2HG PRO 21 -2.685 -7.644 18.876 166 1HD PRO 21 1HD PRO 21 -4.685 -9.383 19.523 167 2HD PRO 21 2HD PRO 21 -4.968 -7.681 19.106 168 H GLU 22 H GLU 22 -3.599 -9.836 14.078 169 HA GLU 22 HA GLU 22 -3.285 -12.634 14.939 170 1HB GLU 22 1HB GLU 22 -4.244 -11.371 12.428 171 2HB GLU 22 2HB GLU 22 -3.312 -12.853 12.266 172 1HG GLU 22 1HG GLU 22 -5.076 -13.506 14.242 173 2HG GLU 22 2HG GLU 22 -6.038 -12.438 13.221 174 HE2 GLU 22 HE2 GLU 22 -5.579 -16.061 12.039 175 H HIS 23 H HIS 23 -1.750 -9.935 13.338 176 HA HIS 23 HA HIS 23 0.837 -11.192 13.687 177 1HB HIS 23 1HB HIS 23 -0.367 -10.643 11.000 178 2HB HIS 23 2HB HIS 23 1.370 -10.467 11.219 179 HD1 HIS 23 HD1 HIS 23 1.881 -12.902 13.049 180 HD2 HIS 23 HD2 HIS 23 -0.464 -12.992 9.619 181 HE1 HIS 23 HE1 HIS 23 1.861 -15.306 12.311 182 HE2 HIS 23 HE2 HIS 23 0.364 -15.349 10.285 183 H TYR 24 H TYR 24 2.552 -9.557 12.629 184 HA TYR 24 HA TYR 24 1.710 -6.817 13.280 185 1HB TYR 24 1HB TYR 24 3.722 -8.459 14.622 186 2HB TYR 24 2HB TYR 24 4.357 -6.910 14.079 187 HD1 TYR 24 HD1 TYR 24 4.037 -5.015 15.385 188 HD2 TYR 24 HD2 TYR 24 1.507 -8.383 15.978 189 HE1 TYR 24 HE1 TYR 24 3.039 -3.912 17.344 190 HE2 TYR 24 HE2 TYR 24 0.502 -7.291 17.938 191 HH TYR 24 HH TYR 24 1.789 -4.895 19.571 192 H ASP 25 H ASP 25 2.649 -5.189 12.090 193 HA ASP 25 HA ASP 25 4.629 -5.954 10.064 194 1HB ASP 25 1HB ASP 25 2.133 -4.342 9.487 195 2HB ASP 25 2HB ASP 25 3.405 -4.730 8.334 196 HD2 ASP 25 HD2 ASP 25 2.337 -8.169 8.432 197 H LEU 26 H LEU 26 5.656 -4.042 9.033 198 HA LEU 26 HA LEU 26 5.612 -1.656 10.743 199 1HB LEU 26 1HB LEU 26 7.650 -3.541 10.786 200 2HB LEU 26 2HB LEU 26 8.274 -2.275 9.746 201 HG LEU 26 HG LEU 26 8.999 -1.876 12.008 202 1HD1 LEU 26 1HD1 LEU 26 6.883 0.168 11.854 203 2HD1 LEU 26 2HD1 LEU 26 7.889 -0.017 10.416 204 3HD1 LEU 26 3HD1 LEU 26 8.633 0.347 11.973 205 1HD2 LEU 26 1HD2 LEU 26 7.008 -1.221 13.624 206 2HD2 LEU 26 2HD2 LEU 26 7.590 -2.881 13.492 207 3HD2 LEU 26 3HD2 LEU 26 6.138 -2.384 12.622 208 H TYR 27 H TYR 27 5.680 0.231 9.666 209 HA TYR 27 HA TYR 27 6.226 0.125 6.771 210 1HB TYR 27 1HB TYR 27 3.960 1.208 8.271 211 2HB TYR 27 2HB TYR 27 4.653 2.366 7.142 212 HD1 TYR 27 HD1 TYR 27 4.579 1.960 4.740 213 HD2 TYR 27 HD2 TYR 27 2.862 -0.803 7.481 214 HE1 TYR 27 HE1 TYR 27 3.366 0.887 2.890 215 HE2 TYR 27 HE2 TYR 27 1.645 -1.884 5.639 216 HH TYR 27 HH TYR 27 2.204 -1.974 2.867 217 H ILE 28 H ILE 28 8.070 1.108 6.301 218 HA ILE 28 HA ILE 28 8.666 3.681 7.581 219 HB ILE 28 HB ILE 28 11.072 3.061 7.700 220 1HG1 ILE 28 1HG1 ILE 28 10.104 0.221 7.327 221 2HG1 ILE 28 2HG1 ILE 28 10.854 1.164 6.043 222 1HG2 ILE 28 1HG2 ILE 28 10.251 2.961 9.803 223 2HG2 ILE 28 2HG2 ILE 28 10.564 1.238 9.598 224 3HG2 ILE 28 3HG2 ILE 28 8.937 1.872 9.356 225 1HD1 ILE 28 1HD1 ILE 28 12.151 0.480 8.670 226 2HD1 ILE 28 2HD1 ILE 28 12.899 1.331 7.318 227 3HD1 ILE 28 3HD1 ILE 28 12.426 -0.358 7.142 228 HA PRO 29 HA PRO 29 9.500 5.289 3.570 229 1HB PRO 29 1HB PRO 29 12.065 6.299 4.704 230 2HB PRO 29 2HB PRO 29 10.798 7.171 3.835 231 1HG PRO 29 1HG PRO 29 11.045 7.417 6.473 232 2HG PRO 29 2HG PRO 29 9.445 7.343 5.713 233 1HD PRO 29 1HD PRO 29 10.918 5.245 7.240 234 2HD PRO 29 2HD PRO 29 9.178 5.592 7.186 235 H ALA 30 H ALA 30 10.684 4.843 1.719 236 HA ALA 30 HA ALA 30 12.448 2.539 1.908 237 1HB ALA 30 1HB ALA 30 12.137 2.274 -0.428 238 2HB ALA 30 2HB ALA 30 11.526 3.919 -0.602 239 3HB ALA 30 3HB ALA 30 10.564 2.706 0.243 240 H ILE 31 H ILE 31 14.208 3.719 2.920 241 HA ILE 31 HA ILE 31 15.785 5.251 0.956 242 HB ILE 31 HB ILE 31 15.006 6.702 2.780 243 1HG1 ILE 31 1HG1 ILE 31 17.880 6.432 3.438 244 2HG1 ILE 31 2HG1 ILE 31 17.496 6.596 1.727 245 1HG2 ILE 31 1HG2 ILE 31 15.163 6.226 4.975 246 2HG2 ILE 31 2HG2 ILE 31 16.731 5.438 4.801 247 3HG2 ILE 31 3HG2 ILE 31 15.255 4.562 4.398 248 1HD1 ILE 31 1HD1 ILE 31 15.978 8.568 2.820 249 2HD1 ILE 31 2HD1 ILE 31 17.590 8.785 2.140 250 3HD1 ILE 31 3HD1 ILE 31 17.389 8.566 3.879 251 H THR 32 H THR 32 17.826 4.594 0.587 252 HA THR 32 HA THR 32 18.671 2.053 1.516 253 HB THR 32 HB THR 32 19.360 2.768 -0.664 254 HG1 THR 32 HG1 THR 32 21.505 2.309 -0.526 255 1HG2 THR 32 1HG2 THR 32 19.752 5.286 0.499 256 2HG2 THR 32 2HG2 THR 32 19.978 4.821 -1.188 257 3HG2 THR 32 3HG2 THR 32 21.333 4.743 -0.063 258 H TRP 33 H TRP 33 19.407 1.640 3.485 259 HA TRP 33 HA TRP 33 20.909 3.727 4.909 260 1HB TRP 33 1HB TRP 33 20.402 2.314 6.946 261 2HB TRP 33 2HB TRP 33 19.005 3.058 6.176 262 HD1 TRP 33 HD1 TRP 33 17.347 1.412 4.801 263 HE1 TRP 33 HE1 TRP 33 16.901 -1.112 5.042 264 HE3 TRP 33 HE3 TRP 33 21.483 0.112 7.510 265 HZ2 TRP 33 HZ2 TRP 33 18.139 -3.355 6.226 266 HZ3 TRP 33 HZ3 TRP 33 21.777 -2.242 8.157 267 HH2 TRP 33 HH2 TRP 33 20.138 -3.940 7.528 268 H HIS 34 H HIS 34 22.070 2.016 2.865 269 HA HIS 34 HA HIS 34 23.601 -0.036 4.127 270 1HB HIS 34 1HB HIS 34 22.977 0.419 1.571 271 2HB HIS 34 2HB HIS 34 24.550 1.208 1.594 272 HD1 HIS 34 HD1 HIS 34 22.956 -2.075 1.375 273 HD2 HIS 34 HD2 HIS 34 26.717 -0.586 2.325 274 HE1 HIS 34 HE1 HIS 34 24.515 -4.043 1.228 275 HE2 HIS 34 HE2 HIS 34 26.799 -3.100 1.723 276 H ALA 35 H ALA 35 24.625 3.053 2.658 277 HA ALA 35 HA ALA 35 27.201 3.004 3.824 278 1HB ALA 35 1HB ALA 35 26.902 5.606 3.271 279 2HB ALA 35 2HB ALA 35 25.591 4.951 2.291 280 3HB ALA 35 3HB ALA 35 27.244 4.393 2.037 281 H ARG 36 H ARG 36 27.959 3.740 5.723 282 HA ARG 36 HA ARG 36 26.006 4.907 7.587 283 1HB ARG 36 1HB ARG 36 27.439 2.676 7.966 284 2HB ARG 36 2HB ARG 36 28.602 3.847 8.571 285 1HG ARG 36 1HG ARG 36 25.782 3.933 9.540 286 2HG ARG 36 2HG ARG 36 26.903 2.734 10.190 287 1HD ARG 36 1HD ARG 36 28.366 5.067 10.260 288 2HD ARG 36 2HD ARG 36 26.739 5.603 10.676 289 HE ARG 36 HE ARG 36 28.503 4.045 12.294 290 1HH1 ARG 36 1HH1 ARG 36 25.141 4.659 11.589 291 2HH1 ARG 36 2HH1 ARG 36 24.591 4.155 13.152 292 1HH2 ARG 36 1HH2 ARG 36 27.781 3.380 14.350 293 2HH2 ARG 36 2HH2 ARG 36 26.091 3.429 14.720 294 H PHE 37 H PHE 37 26.630 6.639 8.945 295 HA PHE 37 HA PHE 37 29.146 7.921 8.783 296 1HB PHE 37 1HB PHE 37 28.108 8.429 6.502 297 2HB PHE 37 2HB PHE 37 26.955 9.436 7.371 298 HD1 PHE 37 HD1 PHE 37 27.645 11.509 8.409 299 HD2 PHE 37 HD2 PHE 37 30.427 9.074 6.301 300 HE1 PHE 37 HE1 PHE 37 29.239 13.382 8.358 301 HE2 PHE 37 HE2 PHE 37 32.027 10.942 6.248 302 HZ PHE 37 HZ PHE 37 31.435 13.099 7.277 303 H ALA 38 H ALA 38 28.530 7.588 11.059 304 HA ALA 38 HA ALA 38 26.572 9.514 12.076 305 1HB ALA 38 1HB ALA 38 26.295 7.273 12.907 306 2HB ALA 38 2HB ALA 38 26.843 8.309 14.225 307 3HB ALA 38 3HB ALA 38 27.979 7.218 13.431 308 H TYR 39 H TYR 39 27.679 11.450 11.945 309 HA TYR 39 HA TYR 39 30.187 11.646 13.469 310 1HB TYR 39 1HB TYR 39 29.891 12.423 10.962 311 2HB TYR 39 2HB TYR 39 29.205 13.858 11.714 312 HD1 TYR 39 HD1 TYR 39 32.088 11.699 12.701 313 HD2 TYR 39 HD2 TYR 39 30.758 15.564 11.516 314 HE1 TYR 39 HE1 TYR 39 34.354 12.583 13.064 315 HE2 TYR 39 HE2 TYR 39 33.020 16.459 11.876 316 HH TYR 39 HH TYR 39 35.740 14.434 12.388 317 H ASP 40 H ASP 40 29.198 11.764 15.516 318 HA ASP 40 HA ASP 40 27.170 13.648 16.150 319 1HB ASP 40 1HB ASP 40 27.801 13.135 18.523 320 2HB ASP 40 2HB ASP 40 27.439 11.711 17.551 321 HD2 ASP 40 HD2 ASP 40 30.760 10.637 17.679 322 H LYS 41 H LYS 41 27.292 15.658 17.089 323 HA LYS 41 HA LYS 41 29.666 16.846 18.049 324 1HB LYS 41 1HB LYS 41 29.225 16.980 15.182 325 2HB LYS 41 2HB LYS 41 29.293 18.584 15.898 326 1HG LYS 41 1HG LYS 41 31.387 16.567 16.572 327 2HG LYS 41 2HG LYS 41 31.464 17.450 15.046 328 1HD LYS 41 1HD LYS 41 32.741 18.744 16.518 329 2HD LYS 41 2HD LYS 41 31.176 19.560 16.478 330 1HE LYS 41 1HE LYS 41 30.551 18.647 18.578 331 2HE LYS 41 2HE LYS 41 31.911 17.524 18.570 332 1HZ LYS 41 1HZ LYS 41 32.318 19.394 20.041 333 2HZ LYS 41 2HZ LYS 41 32.112 20.482 18.763 334 3HZ LYS 41 3HZ LYS 41 33.417 19.406 18.755 335 H GLU 42 H GLU 42 26.541 17.414 16.492 336 HA GLU 42 HA GLU 42 25.614 18.945 18.722 337 1HB GLU 42 1HB GLU 42 25.095 20.986 17.275 338 2HB GLU 42 2HB GLU 42 26.759 20.782 17.803 339 1HG GLU 42 1HG GLU 42 27.528 20.438 15.714 340 2HG GLU 42 2HG GLU 42 26.073 19.585 15.200 341 HE2 GLU 42 HE2 GLU 42 25.846 23.555 15.062 342 H LYS 43 H LYS 43 23.715 17.936 18.907 343 HA LYS 43 HA LYS 43 22.115 17.468 16.489 344 1HB LYS 43 1HB LYS 43 21.993 16.233 19.241 345 2HB LYS 43 2HB LYS 43 20.789 15.941 17.994 346 1HG LYS 43 1HG LYS 43 22.490 14.977 16.551 347 2HG LYS 43 2HG LYS 43 23.724 15.308 17.768 348 1HD LYS 43 1HD LYS 43 22.375 13.874 19.349 349 2HD LYS 43 2HD LYS 43 21.404 13.396 17.955 350 1HE LYS 43 1HE LYS 43 22.913 11.731 17.796 351 2HE LYS 43 2HE LYS 43 23.889 12.961 16.993 352 1HZ LYS 43 1HZ LYS 43 25.030 11.696 18.804 353 2HZ LYS 43 2HZ LYS 43 24.006 12.459 19.913 354 3HZ LYS 43 3HZ LYS 43 25.075 13.378 18.979 355 H THR 44 H THR 44 22.032 18.928 19.692 356 HA THR 44 HA THR 44 19.564 20.330 18.906 357 HB THR 44 HB THR 44 18.966 18.720 20.599 358 HG1 THR 44 HG1 THR 44 17.884 20.571 20.968 359 1HG2 THR 44 1HG2 THR 44 20.666 18.037 21.899 360 2HG2 THR 44 2HG2 THR 44 20.070 19.312 22.960 361 3HG2 THR 44 3HG2 THR 44 21.447 19.617 21.903 362 H ASP 45 H ASP 45 22.235 21.231 18.493 363 HA ASP 45 HA ASP 45 22.622 23.293 20.533 364 1HB ASP 45 1HB ASP 45 24.523 21.825 19.606 365 2HB ASP 45 2HB ASP 45 24.408 22.817 18.154 366 HD2 ASP 45 HD2 ASP 45 25.578 25.644 19.951 367 H ARG 46 H ARG 46 22.678 23.135 16.967 368 HA ARG 46 HA ARG 46 21.298 25.733 16.923 369 1HB ARG 46 1HB ARG 46 23.920 25.066 15.873 370 2HB ARG 46 2HB ARG 46 22.854 25.651 14.602 371 1HG ARG 46 1HG ARG 46 24.150 27.457 15.603 372 2HG ARG 46 2HG ARG 46 22.419 27.676 15.868 373 1HD ARG 46 1HD ARG 46 22.610 27.472 18.098 374 2HD ARG 46 2HD ARG 46 23.798 26.175 17.978 375 HE ARG 46 HE ARG 46 25.207 28.353 17.235 376 1HH1 ARG 46 1HH1 ARG 46 23.183 27.670 19.996 377 2HH1 ARG 46 2HH1 ARG 46 24.067 28.714 21.058 378 1HH2 ARG 46 1HH2 ARG 46 26.371 29.724 18.632 379 2HH2 ARG 46 2HH2 ARG 46 25.876 29.879 20.285 380 H TYR 47 H TYR 47 22.182 22.864 15.023 381 HA TYR 47 HA TYR 47 20.333 23.243 12.947 382 1HB TYR 47 1HB TYR 47 22.328 21.470 13.399 383 2HB TYR 47 2HB TYR 47 20.931 20.452 13.730 384 HD1 TYR 47 HD1 TYR 47 20.012 19.287 11.963 385 HD2 TYR 47 HD2 TYR 47 22.111 22.899 11.159 386 HE1 TYR 47 HE1 TYR 47 19.703 18.922 9.550 387 HE2 TYR 47 HE2 TYR 47 21.807 22.546 8.744 388 HH TYR 47 HH TYR 47 21.053 19.731 7.378 389 H ASN 48 H ASN 48 18.420 21.881 12.502 390 HA ASN 48 HA ASN 48 16.813 21.568 14.946 391 1HB ASN 48 1HB ASN 48 16.178 22.429 12.164 392 2HB ASN 48 2HB ASN 48 14.933 21.561 13.057 393 1HD2 ASN 48 1HD2 ASN 48 13.584 23.324 13.189 394 2HD2 ASN 48 2HD2 ASN 48 13.922 24.686 14.196 395 H GLU 49 H GLU 49 15.089 19.868 14.812 396 HA GLU 49 HA GLU 49 16.317 17.367 14.057 397 1HB GLU 49 1HB GLU 49 13.768 18.093 15.487 398 2HB GLU 49 2HB GLU 49 14.132 16.435 15.029 399 1HG GLU 49 1HG GLU 49 15.804 16.227 16.563 400 2HG GLU 49 2HG GLU 49 16.183 17.949 16.549 401 HE2 GLU 49 HE2 GLU 49 13.844 16.616 19.330 402 H ARG 50 H ARG 50 15.338 15.774 12.713 403 HA ARG 50 HA ARG 50 14.002 16.937 10.414 404 1HB ARG 50 1HB ARG 50 15.511 14.453 10.980 405 2HB ARG 50 2HB ARG 50 14.243 14.326 9.769 406 1HG ARG 50 1HG ARG 50 15.309 16.344 8.657 407 2HG ARG 50 2HG ARG 50 16.681 16.073 9.734 408 1HD ARG 50 1HD ARG 50 17.241 14.071 8.736 409 2HD ARG 50 2HD ARG 50 15.610 13.802 8.122 410 HE ARG 50 HE ARG 50 16.509 16.026 6.801 411 1HH1 ARG 50 1HH1 ARG 50 17.619 12.737 7.163 412 2HH1 ARG 50 2HH1 ARG 50 18.377 12.690 5.608 413 1HH2 ARG 50 1HH2 ARG 50 17.506 15.966 4.754 414 2HH2 ARG 50 2HH2 ARG 50 18.315 14.523 4.240 415 HA PRO 51 HA PRO 51 9.845 15.638 10.997 416 1HB PRO 51 1HB PRO 51 10.097 13.893 8.593 417 2HB PRO 51 2HB PRO 51 8.897 15.138 8.959 418 1HG PRO 51 1HG PRO 51 10.846 15.609 7.209 419 2HG PRO 51 2HG PRO 51 10.309 16.871 8.334 420 1HD PRO 51 1HD PRO 51 12.772 15.186 8.406 421 2HD PRO 51 2HD PRO 51 12.546 16.880 8.888 422 H TRP 52 H TRP 52 11.486 12.805 9.569 423 HA TRP 52 HA TRP 52 11.618 10.630 10.218 424 1HB TRP 52 1HB TRP 52 11.921 12.198 12.637 425 2HB TRP 52 2HB TRP 52 11.174 10.642 12.983 426 HD1 TRP 52 HD1 TRP 52 13.267 9.568 14.153 427 HE1 TRP 52 HE1 TRP 52 15.567 8.791 13.297 428 HE3 TRP 52 HE3 TRP 52 13.189 11.742 9.525 429 HZ2 TRP 52 HZ2 TRP 52 17.140 9.064 10.968 430 HZ3 TRP 52 HZ3 TRP 52 15.131 11.436 8.046 431 HH2 TRP 52 HH2 TRP 52 17.064 10.125 8.753 432 H GLY 53 H GLY 53 9.861 9.662 9.342 433 1HA GLY 53 1HA GLY 53 7.402 9.629 10.984 434 2HA GLY 53 2HA GLY 53 7.391 9.576 9.228 435 H GLY 54 H GLY 54 6.040 7.676 10.679 436 1HA GLY 54 1HA GLY 54 7.003 5.285 9.584 437 2HA GLY 54 2HA GLY 54 7.509 5.346 11.266 438 H GLY 55 H GLY 55 5.975 3.294 10.721 439 1HA GLY 55 1HA GLY 55 3.728 3.622 12.386 440 2HA GLY 55 2HA GLY 55 3.195 3.649 10.712 441 H PHE 56 H PHE 56 2.039 1.712 11.812 442 HA PHE 56 HA PHE 56 3.590 -0.683 11.117 443 1HB PHE 56 1HB PHE 56 2.406 -1.855 13.036 444 2HB PHE 56 2HB PHE 56 3.664 -0.711 13.490 445 HD1 PHE 56 HD1 PHE 56 2.928 1.646 14.150 446 HD2 PHE 56 HD2 PHE 56 0.263 -1.663 13.907 447 HE1 PHE 56 HE1 PHE 56 1.329 2.834 15.594 448 HE2 PHE 56 HE2 PHE 56 -1.342 -0.480 15.351 449 HZ PHE 56 HZ PHE 56 -0.810 1.771 16.196 450 H GLY 57 H GLY 57 2.012 -2.650 11.046 451 1HA GLY 57 1HA GLY 57 -0.655 -1.903 10.120 452 2HA GLY 57 2HA GLY 57 0.412 -2.645 8.937 453 H LEU 58 H LEU 58 -2.007 -3.794 9.607 454 HA LEU 58 HA LEU 58 -1.112 -6.226 11.004 455 1HB LEU 58 1HB LEU 58 -3.787 -4.851 11.233 456 2HB LEU 58 2HB LEU 58 -3.474 -6.475 11.815 457 HG LEU 58 HG LEU 58 -1.697 -4.302 12.798 458 1HD1 LEU 58 1HD1 LEU 58 -4.609 -4.438 13.266 459 2HD1 LEU 58 2HD1 LEU 58 -3.508 -3.063 13.341 460 3HD1 LEU 58 3HD1 LEU 58 -3.591 -4.200 14.686 461 1HD2 LEU 58 1HD2 LEU 58 -1.849 -6.930 13.318 462 2HD2 LEU 58 2HD2 LEU 58 -2.941 -6.316 14.561 463 3HD2 LEU 58 3HD2 LEU 58 -1.275 -5.742 14.488 464 H SER 59 H SER 59 -2.893 -8.022 10.561 465 HA SER 59 HA SER 59 -3.830 -7.893 7.797 466 1HB SER 59 1HB SER 59 -2.838 -10.390 7.728 467 2HB SER 59 2HB SER 59 -1.918 -8.986 7.188 468 HG SER 59 HG SER 59 -0.592 -10.007 8.585 469 H ARG 60 H ARG 60 -5.463 -9.412 7.290 470 HA ARG 60 HA ARG 60 -6.459 -11.128 9.415 471 1HB ARG 60 1HB ARG 60 -7.595 -8.546 8.849 472 2HB ARG 60 2HB ARG 60 -8.762 -9.802 8.459 473 1HG ARG 60 1HG ARG 60 -8.802 -10.606 10.655 474 2HG ARG 60 2HG ARG 60 -7.311 -9.765 11.081 475 1HD ARG 60 1HD ARG 60 -8.364 -7.781 11.409 476 2HD ARG 60 2HD ARG 60 -9.572 -8.093 10.164 477 HE ARG 60 HE ARG 60 -9.827 -8.599 12.948 478 1HH1 ARG 60 1HH1 ARG 60 -10.741 -9.832 9.813 479 2HH1 ARG 60 2HH1 ARG 60 -12.176 -10.606 10.396 480 1HH2 ARG 60 1HH2 ARG 60 -11.714 -9.616 13.717 481 2HH2 ARG 60 2HH2 ARG 60 -12.729 -10.482 12.613 482 H TRP 61 H TRP 61 -8.457 -12.351 8.619 483 HA TRP 61 HA TRP 61 -8.041 -13.042 5.788 484 1HB TRP 61 1HB TRP 61 -8.841 -14.699 8.170 485 2HB TRP 61 2HB TRP 61 -9.169 -15.244 6.528 486 HD1 TRP 61 HD1 TRP 61 -6.149 -14.257 8.740 487 HE1 TRP 61 HE1 TRP 61 -4.095 -15.572 7.916 488 HE3 TRP 61 HE3 TRP 61 -8.233 -16.555 4.677 489 HZ2 TRP 61 HZ2 TRP 61 -3.446 -17.348 5.821 490 HZ3 TRP 61 HZ3 TRP 61 -6.828 -18.046 3.316 491 HH2 TRP 61 HH2 TRP 61 -4.483 -18.433 3.877 492 H ASP 62 H ASP 62 -9.744 -13.118 4.401 493 HA ASP 62 HA ASP 62 -12.354 -12.279 5.482 494 1HB ASP 62 1HB ASP 62 -11.011 -11.650 2.856 495 2HB ASP 62 2HB ASP 62 -12.733 -11.393 3.119 496 HD2 ASP 62 HD2 ASP 62 -10.562 -8.489 4.092 497 H GLU 63 H GLU 63 -13.995 -13.635 5.250 498 HA GLU 63 HA GLU 63 -13.769 -16.213 4.263 499 1HB GLU 63 1HB GLU 63 -15.641 -14.898 5.691 500 2HB GLU 63 2HB GLU 63 -16.463 -14.995 4.140 501 1HG GLU 63 1HG GLU 63 -16.814 -17.199 4.317 502 2HG GLU 63 2HG GLU 63 -15.235 -17.499 5.039 503 HE2 GLU 63 HE2 GLU 63 -18.332 -17.327 7.375 504 H LYS 64 H LYS 64 -14.322 -13.278 2.539 505 HA LYS 64 HA LYS 64 -15.354 -14.650 0.189 506 1HB LYS 64 1HB LYS 64 -15.079 -11.823 1.053 507 2HB LYS 64 2HB LYS 64 -15.024 -12.136 -0.676 508 1HG LYS 64 1HG LYS 64 -17.238 -12.086 -0.657 509 2HG LYS 64 2HG LYS 64 -17.192 -13.618 0.219 510 1HD LYS 64 1HD LYS 64 -17.028 -10.951 1.603 511 2HD LYS 64 2HD LYS 64 -18.563 -11.752 1.263 512 1HE LYS 64 1HE LYS 64 -18.276 -12.739 3.252 513 2HE LYS 64 2HE LYS 64 -17.110 -13.761 2.413 514 1HZ LYS 64 1HZ LYS 64 -15.531 -11.759 3.011 515 2HZ LYS 64 2HZ LYS 64 -15.822 -13.013 4.107 516 3HZ LYS 64 3HZ LYS 64 -16.650 -11.547 4.263 517 H GLY 65 H GLY 65 -12.583 -15.110 1.209 518 1HA GLY 65 1HA GLY 65 -10.521 -15.501 0.287 519 2HA GLY 65 2HA GLY 65 -11.265 -15.214 -1.280 520 H ASN 66 H ASN 66 -10.713 -13.104 1.536 521 HA ASN 66 HA ASN 66 -9.047 -11.393 -0.181 522 1HB ASN 66 1HB ASN 66 -11.564 -10.710 1.193 523 2HB ASN 66 2HB ASN 66 -10.256 -9.556 1.433 524 1HD2 ASN 66 1HD2 ASN 66 -12.349 -11.076 -0.897 525 2HD2 ASN 66 2HD2 ASN 66 -12.076 -9.946 -2.175 526 H TRP 67 H TRP 67 -7.588 -9.985 0.981 527 HA TRP 67 HA TRP 67 -6.932 -11.007 3.668 528 1HB TRP 67 1HB TRP 67 -5.177 -10.307 1.339 529 2HB TRP 67 2HB TRP 67 -4.548 -10.173 2.977 530 HD1 TRP 67 HD1 TRP 67 -6.127 -12.854 0.666 531 HE1 TRP 67 HE1 TRP 67 -5.152 -15.143 1.327 532 HE3 TRP 67 HE3 TRP 67 -3.327 -11.414 4.695 533 HZ2 TRP 67 HZ2 TRP 67 -3.425 -16.199 3.294 534 HZ3 TRP 67 HZ3 TRP 67 -2.043 -13.124 5.911 535 HH2 TRP 67 HH2 TRP 67 -2.093 -15.467 5.224 536 H HIS 68 H HIS 68 -7.847 -9.468 4.939 537 HA HIS 68 HA HIS 68 -7.833 -6.694 4.355 538 1HB HIS 68 1HB HIS 68 -9.495 -7.744 5.844 539 2HB HIS 68 2HB HIS 68 -8.225 -8.082 7.016 540 HD1 HIS 68 HD1 HIS 68 -8.265 -6.468 8.874 541 HD2 HIS 68 HD2 HIS 68 -9.443 -4.714 5.296 542 HE1 HIS 68 HE1 HIS 68 -8.774 -4.071 9.436 543 HE2 HIS 68 HE2 HIS 68 -9.566 -3.051 7.273 544 H GLY 69 H GLY 69 -6.545 -5.041 5.111 545 1HA GLY 69 1HA GLY 69 -4.215 -5.772 6.746 546 2HA GLY 69 2HA GLY 69 -3.951 -4.996 5.191 547 H LEU 70 H LEU 70 -3.923 -4.383 8.345 548 HA LEU 70 HA LEU 70 -5.313 -1.828 8.290 549 1HB LEU 70 1HB LEU 70 -5.338 -3.407 10.270 550 2HB LEU 70 2HB LEU 70 -3.659 -2.979 10.530 551 HG LEU 70 HG LEU 70 -5.628 -0.756 10.362 552 1HD1 LEU 70 1HD1 LEU 70 -6.516 -1.038 12.477 553 2HD1 LEU 70 2HD1 LEU 70 -5.266 -2.184 12.964 554 3HD1 LEU 70 3HD1 LEU 70 -6.532 -2.683 11.841 555 1HD2 LEU 70 1HD2 LEU 70 -2.971 -1.311 11.521 556 2HD2 LEU 70 2HD2 LEU 70 -4.024 -0.247 12.454 557 3HD2 LEU 70 3HD2 LEU 70 -3.609 0.161 10.789 558 H TYR 71 H TYR 71 -4.292 0.176 8.669 559 HA TYR 71 HA TYR 71 -1.375 0.239 8.432 560 1HB TYR 71 1HB TYR 71 -3.208 1.885 6.677 561 2HB TYR 71 2HB TYR 71 -1.448 1.907 6.662 562 HD1 TYR 71 HD1 TYR 71 -4.438 0.159 5.561 563 HD2 TYR 71 HD2 TYR 71 -0.192 -0.022 5.767 564 HE1 TYR 71 HE1 TYR 71 -4.437 -1.622 3.866 565 HE2 TYR 71 HE2 TYR 71 -0.179 -1.803 4.072 566 HH TYR 71 HH TYR 71 -2.434 -2.433 2.048 567 H ALA 72 H ALA 72 -0.577 1.493 9.971 568 HA ALA 72 HA ALA 72 -2.069 3.894 10.773 569 1HB ALA 72 1HB ALA 72 -1.173 3.329 13.152 570 2HB ALA 72 2HB ALA 72 -1.096 1.680 12.528 571 3HB ALA 72 3HB ALA 72 -2.635 2.542 12.555 572 H MET 73 H MET 73 -0.792 5.529 10.196 573 HA MET 73 HA MET 73 2.091 5.313 10.766 574 1HB MET 73 1HB MET 73 0.604 6.539 8.478 575 2HB MET 73 2HB MET 73 2.156 7.215 8.952 576 1HG MET 73 1HG MET 73 3.300 5.234 8.447 577 2HG MET 73 2HG MET 73 1.811 4.293 8.384 578 1HE MET 73 1HE MET 73 2.377 3.783 4.778 579 2HE MET 73 2HE MET 73 0.939 3.578 5.776 580 3HE MET 73 3HE MET 73 2.529 3.179 6.429 581 H ALA 74 H ALA 74 3.173 7.389 11.227 582 HA ALA 74 HA ALA 74 1.517 9.561 12.186 583 1HB ALA 74 1HB ALA 74 3.197 7.940 14.096 584 2HB ALA 74 2HB ALA 74 1.441 8.097 14.105 585 3HB ALA 74 3HB ALA 74 2.452 9.494 14.473 586 H PHE 75 H PHE 75 2.576 11.485 12.163 587 HA PHE 75 HA PHE 75 5.480 11.415 11.665 588 1HB PHE 75 1HB PHE 75 3.300 12.758 10.165 589 2HB PHE 75 2HB PHE 75 4.785 13.677 10.386 590 HD1 PHE 75 HD1 PHE 75 3.480 10.436 9.139 591 HD2 PHE 75 HD2 PHE 75 6.632 13.293 9.024 592 HE1 PHE 75 HE1 PHE 75 4.504 9.223 7.260 593 HE2 PHE 75 HE2 PHE 75 7.662 12.086 7.144 594 HZ PHE 75 HZ PHE 75 6.598 10.048 6.259 595 H LYS 76 H LYS 76 6.651 13.335 12.294 596 HA LYS 76 HA LYS 76 5.417 14.638 14.622 597 1HB LYS 76 1HB LYS 76 8.156 13.723 13.981 598 2HB LYS 76 2HB LYS 76 8.045 15.245 14.856 599 1HG LYS 76 1HG LYS 76 6.482 13.964 16.451 600 2HG LYS 76 2HG LYS 76 7.163 12.516 15.706 601 1HD LYS 76 1HD LYS 76 8.613 12.794 17.459 602 2HD LYS 76 2HD LYS 76 9.443 13.732 16.217 603 1HE LYS 76 1HE LYS 76 7.593 15.459 17.476 604 2HE LYS 76 2HE LYS 76 8.440 14.586 18.753 605 1HZ LYS 76 1HZ LYS 76 10.474 15.429 18.092 606 2HZ LYS 76 2HZ LYS 76 9.448 16.753 17.859 607 3HZ LYS 76 3HZ LYS 76 9.940 15.821 16.535 608 H ASP 77 H ASP 77 4.452 16.449 13.863 609 HA ASP 77 HA ASP 77 5.345 18.046 11.747 610 1HB ASP 77 1HB ASP 77 3.456 18.454 14.030 611 2HB ASP 77 2HB ASP 77 3.925 19.845 13.056 612 HD2 ASP 77 HD2 ASP 77 1.766 17.014 11.288 613 H SER 78 H SER 78 6.370 20.088 11.716 614 HA SER 78 HA SER 78 8.521 20.314 13.612 615 1HB SER 78 1HB SER 78 7.765 21.687 11.068 616 2HB SER 78 2HB SER 78 8.916 22.477 12.146 617 HG SER 78 HG SER 78 10.015 21.162 10.679 618 H TRP 79 H TRP 79 5.370 21.302 13.732 619 HA TRP 79 HA TRP 79 6.028 23.386 15.679 620 1HB TRP 79 1HB TRP 79 4.608 23.770 13.148 621 2HB TRP 79 2HB TRP 79 3.705 24.352 14.543 622 HD1 TRP 79 HD1 TRP 79 6.210 25.482 12.137 623 HE1 TRP 79 HE1 TRP 79 7.392 27.616 12.959 624 HE3 TRP 79 HE3 TRP 79 4.716 25.407 17.027 625 HZ2 TRP 79 HZ2 TRP 79 7.657 29.074 15.361 626 HZ3 TRP 79 HZ3 TRP 79 5.479 27.209 18.520 627 HH2 TRP 79 HH2 TRP 79 6.919 29.003 17.703 628 H ASN 80 H ASN 80 3.463 21.382 14.262 629 HA ASN 80 HA ASN 80 1.887 21.509 16.682 630 1HB ASN 80 1HB ASN 80 1.488 20.633 13.925 631 2HB ASN 80 2HB ASN 80 0.782 19.522 15.094 632 1HD2 ASN 80 1HD2 ASN 80 -1.320 19.932 15.017 633 2HD2 ASN 80 2HD2 ASN 80 -2.046 21.486 15.229 634 H LYS 81 H LYS 81 0.874 19.030 17.012 635 HA LYS 81 HA LYS 81 3.159 17.591 18.115 636 1HB LYS 81 1HB LYS 81 0.351 17.906 18.814 637 2HB LYS 81 2HB LYS 81 0.850 16.220 18.845 638 1HG LYS 81 1HG LYS 81 2.274 18.439 20.297 639 2HG LYS 81 2HG LYS 81 1.068 17.374 21.023 640 1HD LYS 81 1HD LYS 81 2.450 15.511 20.885 641 2HD LYS 81 2HD LYS 81 3.457 16.229 19.627 642 1HE LYS 81 1HE LYS 81 4.888 16.609 21.319 643 2HE LYS 81 2HE LYS 81 3.839 17.986 21.652 644 1HZ LYS 81 1HZ LYS 81 2.555 16.180 23.034 645 2HZ LYS 81 2HZ LYS 81 3.880 17.004 23.687 646 3HZ LYS 81 3HZ LYS 81 4.076 15.440 23.076 647 H TRP 82 H TRP 82 2.361 15.029 18.223 648 HA TRP 82 HA TRP 82 2.974 14.039 15.664 649 1HB TRP 82 1HB TRP 82 1.828 12.674 18.105 650 2HB TRP 82 2HB TRP 82 2.316 11.810 16.651 651 HD1 TRP 82 HD1 TRP 82 4.326 14.698 18.233 652 HE1 TRP 82 HE1 TRP 82 6.622 13.780 18.949 653 HE3 TRP 82 HE3 TRP 82 3.576 9.744 17.215 654 HZ2 TRP 82 HZ2 TRP 82 7.941 11.287 19.065 655 HZ3 TRP 82 HZ3 TRP 82 5.406 8.158 17.657 656 HH2 TRP 82 HH2 TRP 82 7.542 8.916 18.563 657 H GLU 83 H GLU 83 1.748 13.595 13.946 658 HA GLU 83 HA GLU 83 -1.157 13.856 14.223 659 1HB GLU 83 1HB GLU 83 0.217 15.240 12.554 660 2HB GLU 83 2HB GLU 83 0.364 13.753 11.627 661 1HG GLU 83 1HG GLU 83 -2.187 13.654 11.725 662 2HG GLU 83 2HG GLU 83 -2.101 15.336 12.245 663 HE2 GLU 83 HE2 GLU 83 -1.638 14.517 8.456 664 HA PRO 84 HA PRO 84 -1.348 9.422 13.635 665 1HB PRO 84 1HB PRO 84 -3.996 9.126 13.930 666 2HB PRO 84 2HB PRO 84 -2.952 9.517 15.302 667 1HG PRO 84 1HG PRO 84 -4.700 11.322 13.676 668 2HG PRO 84 2HG PRO 84 -4.461 11.280 15.433 669 1HD PRO 84 1HD PRO 84 -3.212 13.059 13.754 670 2HD PRO 84 2HD PRO 84 -2.559 12.549 15.323 671 H ILE 85 H ILE 85 -2.341 7.898 12.150 672 HA ILE 85 HA ILE 85 -3.711 9.005 9.830 673 HB ILE 85 HB ILE 85 -1.181 7.403 9.463 674 1HG1 ILE 85 1HG1 ILE 85 -1.612 10.381 9.130 675 2HG1 ILE 85 2HG1 ILE 85 -0.656 9.618 10.398 676 1HG2 ILE 85 1HG2 ILE 85 -3.295 8.421 7.691 677 2HG2 ILE 85 2HG2 ILE 85 -2.211 7.044 7.495 678 3HG2 ILE 85 3HG2 ILE 85 -1.645 8.672 7.123 679 1HD1 ILE 85 1HD1 ILE 85 0.336 10.581 8.070 680 2HD1 ILE 85 2HD1 ILE 85 0.126 8.873 7.679 681 3HD1 ILE 85 3HD1 ILE 85 1.113 9.347 9.062 682 H ALA 86 H ALA 86 -5.393 7.716 9.508 683 HA ALA 86 HA ALA 86 -5.231 4.907 10.316 684 1HB ALA 86 1HB ALA 86 -7.181 5.591 11.226 685 2HB ALA 86 2HB ALA 86 -7.809 5.216 9.621 686 3HB ALA 86 3HB ALA 86 -7.407 6.880 10.044 687 H GLY 87 H GLY 87 -5.793 3.206 8.932 688 1HA GLY 87 1HA GLY 87 -6.388 3.750 6.149 689 2HA GLY 87 2HA GLY 87 -4.787 3.086 6.438 690 H TYR 88 H TYR 88 -7.196 2.004 5.040 691 HA TYR 88 HA TYR 88 -7.027 -0.658 6.134 692 1HB TYR 88 1HB TYR 88 -9.615 0.891 6.176 693 2HB TYR 88 2HB TYR 88 -9.566 -0.868 6.206 694 HD1 TYR 88 HD1 TYR 88 -8.095 -1.926 8.092 695 HD2 TYR 88 HD2 TYR 88 -9.575 2.062 8.176 696 HE1 TYR 88 HE1 TYR 88 -7.814 -1.881 10.534 697 HE2 TYR 88 HE2 TYR 88 -9.298 2.119 10.619 698 HH TYR 88 HH TYR 88 -8.819 -0.610 12.480 699 H GLY 89 H GLY 89 -6.666 -1.865 4.398 700 1HA GLY 89 1HA GLY 89 -8.356 -1.458 2.030 701 2HA GLY 89 2HA GLY 89 -6.610 -1.451 1.830 702 H TRP 90 H TRP 90 -8.031 -3.237 0.400 703 HA TRP 90 HA TRP 90 -7.498 -5.787 1.779 704 1HB TRP 90 1HB TRP 90 -9.576 -5.315 -0.367 705 2HB TRP 90 2HB TRP 90 -9.304 -6.809 0.523 706 HD1 TRP 90 HD1 TRP 90 -9.539 -6.278 3.407 707 HE1 TRP 90 HE1 TRP 90 -11.552 -5.129 4.524 708 HE3 TRP 90 HE3 TRP 90 -11.451 -3.845 -0.665 709 HZ2 TRP 90 HZ2 TRP 90 -13.670 -3.418 3.779 710 HZ3 TRP 90 HZ3 TRP 90 -13.473 -2.473 -0.377 711 HH2 TRP 90 HH2 TRP 90 -14.559 -2.266 1.799 712 H GLU 91 H GLU 91 -5.900 -6.919 0.913 713 HA GLU 91 HA GLU 91 -5.183 -6.413 -1.899 714 1HB GLU 91 1HB GLU 91 -3.442 -7.401 0.367 715 2HB GLU 91 2HB GLU 91 -2.913 -7.170 -1.295 716 1HG GLU 91 1HG GLU 91 -4.158 -4.813 -0.088 717 2HG GLU 91 2HG GLU 91 -2.670 -5.340 0.697 718 HE2 GLU 91 HE2 GLU 91 -2.361 -3.376 -2.607 719 H SER 92 H SER 92 -4.514 -8.194 -3.195 720 HA SER 92 HA SER 92 -5.630 -10.763 -2.284 721 1HB SER 92 1HB SER 92 -6.488 -9.360 -4.414 722 2HB SER 92 2HB SER 92 -5.205 -10.291 -5.185 723 HG SER 92 HG SER 92 -7.576 -11.171 -3.983 724 H THR 93 H THR 93 -4.215 -12.330 -1.930 725 HA THR 93 HA THR 93 -1.457 -12.047 -2.626 726 HB THR 93 HB THR 93 -2.039 -13.141 -0.555 727 HG1 THR 93 HG1 THR 93 -0.214 -13.943 -1.843 728 1HG2 THR 93 1HG2 THR 93 -3.942 -14.576 -2.172 729 2HG2 THR 93 2HG2 THR 93 -3.851 -14.401 -0.420 730 3HG2 THR 93 3HG2 THR 93 -2.936 -15.674 -1.229 731 H TRP 94 H TRP 94 -0.238 -13.238 -4.081 732 HA TRP 94 HA TRP 94 -1.535 -15.174 -5.804 733 1HB TRP 94 1HB TRP 94 -1.335 -12.450 -6.592 734 2HB TRP 94 2HB TRP 94 -0.188 -13.365 -7.564 735 HD1 TRP 94 HD1 TRP 94 -3.954 -13.147 -6.814 736 HE1 TRP 94 HE1 TRP 94 -5.233 -14.245 -8.759 737 HE3 TRP 94 HE3 TRP 94 0.014 -15.016 -9.441 738 HZ2 TRP 94 HZ2 TRP 94 -4.638 -15.710 -11.097 739 HZ3 TRP 94 HZ3 TRP 94 -0.427 -16.253 -11.522 740 HH2 TRP 94 HH2 TRP 94 -2.706 -16.593 -12.331 741 H ARG 95 H ARG 95 -0.127 -16.792 -5.593 742 HA ARG 95 HA ARG 95 2.746 -16.188 -5.787 743 1HB ARG 95 1HB ARG 95 1.183 -18.215 -4.276 744 2HB ARG 95 2HB ARG 95 2.760 -18.704 -4.879 745 1HG ARG 95 1HG ARG 95 3.568 -16.493 -3.768 746 2HG ARG 95 2HG ARG 95 2.069 -16.635 -2.847 747 1HD ARG 95 1HD ARG 95 2.885 -19.092 -2.468 748 2HD ARG 95 2HD ARG 95 4.465 -18.417 -2.867 749 HE ARG 95 HE ARG 95 4.494 -17.376 -0.830 750 1HH1 ARG 95 1HH1 ARG 95 1.227 -18.391 -1.525 751 2HH1 ARG 95 2HH1 ARG 95 0.633 -17.986 0.050 752 1HH2 ARG 95 1HH2 ARG 95 3.714 -16.844 1.242 753 2HH2 ARG 95 2HH2 ARG 95 2.044 -17.107 1.621 754 HA PRO 96 HA PRO 96 2.881 -18.319 -9.656 755 1HB PRO 96 1HB PRO 96 5.488 -19.019 -9.743 756 2HB PRO 96 2HB PRO 96 4.951 -17.345 -9.927 757 1HG PRO 96 1HG PRO 96 6.051 -18.728 -7.509 758 2HG PRO 96 2HG PRO 96 6.418 -17.110 -8.137 759 1HD PRO 96 1HD PRO 96 4.706 -17.543 -6.069 760 2HD PRO 96 2HD PRO 96 4.534 -16.182 -7.195 761 H LEU 97 H LEU 97 3.876 -20.437 -10.598 762 HA LEU 97 HA LEU 97 3.226 -22.599 -8.714 763 1HB LEU 97 1HB LEU 97 1.874 -22.260 -10.853 764 2HB LEU 97 2HB LEU 97 3.296 -22.816 -11.714 765 HG LEU 97 HG LEU 97 3.067 -24.865 -10.037 766 1HD1 LEU 97 1HD1 LEU 97 1.037 -25.246 -9.134 767 2HD1 LEU 97 2HD1 LEU 97 0.178 -24.478 -10.469 768 3HD1 LEU 97 3HD1 LEU 97 0.912 -23.489 -9.208 769 1HD2 LEU 97 1HD2 LEU 97 2.784 -24.550 -12.665 770 2HD2 LEU 97 2HD2 LEU 97 1.110 -24.928 -12.260 771 3HD2 LEU 97 3HD2 LEU 97 2.396 -26.063 -11.845 772 H ALA 98 H ALA 98 5.584 -22.040 -8.062 773 HA ALA 98 HA ALA 98 7.218 -24.196 -8.833 774 1HB ALA 98 1HB ALA 98 7.748 -21.582 -10.182 775 2HB ALA 98 2HB ALA 98 7.778 -23.213 -10.850 776 3HB ALA 98 3HB ALA 98 9.084 -22.667 -9.797 777 H ASP 99 H ASP 99 7.815 -20.783 -7.968 778 HA ASP 99 HA ASP 99 9.290 -21.733 -5.609 779 1HB ASP 99 1HB ASP 99 9.413 -19.027 -6.958 780 2HB ASP 99 2HB ASP 99 10.416 -19.564 -5.613 781 HD2 ASP 99 HD2 ASP 99 12.004 -20.118 -8.936 782 H GLU 100 H GLU 100 8.595 -21.269 -3.612 783 HA GLU 100 HA GLU 100 6.139 -19.688 -3.366 784 1HB GLU 100 1HB GLU 100 6.674 -22.141 -2.394 785 2HB GLU 100 2HB GLU 100 7.214 -21.169 -1.032 786 1HG GLU 100 1HG GLU 100 5.068 -20.210 -0.750 787 2HG GLU 100 2HG GLU 100 4.502 -20.863 -2.287 788 HE2 GLU 100 HE2 GLU 100 4.742 -23.357 0.800 789 H ASN 101 H ASN 101 8.665 -18.373 -3.728 790 HA ASN 101 HA ASN 101 9.094 -17.153 -1.085 791 1HB ASN 101 1HB ASN 101 11.077 -18.145 -2.279 792 2HB ASN 101 2HB ASN 101 10.866 -16.916 -3.523 793 1HD2 ASN 101 1HD2 ASN 101 12.351 -15.419 -3.303 794 2HD2 ASN 101 2HD2 ASN 101 12.876 -14.711 -1.817 795 H PHE 102 H PHE 102 8.843 -16.291 -4.532 796 HA PHE 102 HA PHE 102 8.553 -13.510 -4.058 797 1HB PHE 102 1HB PHE 102 9.147 -14.890 -6.249 798 2HB PHE 102 2HB PHE 102 7.413 -14.753 -6.518 799 HD1 PHE 102 HD1 PHE 102 10.469 -13.287 -7.202 800 HD2 PHE 102 HD2 PHE 102 6.495 -12.268 -6.071 801 HE1 PHE 102 HE1 PHE 102 10.795 -11.024 -8.110 802 HE2 PHE 102 HE2 PHE 102 6.814 -10.003 -6.977 803 HZ PHE 102 HZ PHE 102 8.966 -9.379 -7.999 804 H HIS 103 H HIS 103 6.872 -12.497 -3.209 805 HA HIS 103 HA HIS 103 4.225 -13.769 -3.362 806 1HB HIS 103 1HB HIS 103 5.292 -13.218 -1.102 807 2HB HIS 103 2HB HIS 103 5.005 -11.528 -1.501 808 HD1 HIS 103 HD1 HIS 103 2.457 -10.815 -1.765 809 HD2 HIS 103 HD2 HIS 103 3.111 -14.584 -0.142 810 HE1 HIS 103 HE1 HIS 103 0.275 -11.478 -0.705 811 HE2 HIS 103 HE2 HIS 103 0.722 -13.723 0.349 812 H LEU 104 H LEU 104 2.555 -12.779 -4.345 813 HA LEU 104 HA LEU 104 3.059 -10.109 -5.485 814 1HB LEU 104 1HB LEU 104 2.625 -12.331 -6.902 815 2HB LEU 104 2HB LEU 104 0.956 -11.874 -6.618 816 HG LEU 104 HG LEU 104 2.797 -9.784 -7.662 817 1HD1 LEU 104 1HD1 LEU 104 1.824 -12.155 -9.224 818 2HD1 LEU 104 2HD1 LEU 104 3.455 -11.491 -9.130 819 3HD1 LEU 104 3HD1 LEU 104 2.193 -10.611 -9.992 820 1HD2 LEU 104 1HD2 LEU 104 -0.099 -10.441 -7.711 821 2HD2 LEU 104 2HD2 LEU 104 0.570 -9.517 -9.057 822 3HD2 LEU 104 3HD2 LEU 104 0.708 -8.903 -7.409 823 H GLY 105 H GLY 105 1.639 -8.492 -5.117 824 1HA GLY 105 1HA GLY 105 -0.911 -9.169 -3.803 825 2HA GLY 105 2HA GLY 105 0.154 -7.965 -3.090 826 H LEU 106 H LEU 106 -2.618 -8.116 -4.584 827 HA LEU 106 HA LEU 106 -2.295 -5.499 -5.813 828 1HB LEU 106 1HB LEU 106 -2.064 -7.503 -7.508 829 2HB LEU 106 2HB LEU 106 -3.813 -7.534 -7.383 830 HG LEU 106 HG LEU 106 -3.065 -6.237 -9.321 831 1HD1 LEU 106 1HD1 LEU 106 -4.098 -4.104 -7.569 832 2HD1 LEU 106 2HD1 LEU 106 -5.042 -5.594 -7.620 833 3HD1 LEU 106 3HD1 LEU 106 -4.709 -4.709 -9.109 834 1HD2 LEU 106 1HD2 LEU 106 -2.026 -4.059 -7.599 835 2HD2 LEU 106 2HD2 LEU 106 -1.588 -4.511 -9.247 836 3HD2 LEU 106 3HD2 LEU 106 -0.974 -5.446 -7.883 837 H GLY 107 H GLY 107 -3.941 -4.209 -5.285 838 1HA GLY 107 1HA GLY 107 -6.646 -4.937 -5.226 839 2HA GLY 107 2HA GLY 107 -6.018 -5.069 -3.590 840 H PHE 108 H PHE 108 -7.567 -3.393 -3.067 841 HA PHE 108 HA PHE 108 -6.674 -0.712 -3.901 842 1HB PHE 108 1HB PHE 108 -9.393 -1.521 -2.849 843 2HB PHE 108 2HB PHE 108 -8.928 0.082 -3.412 844 HD1 PHE 108 HD1 PHE 108 -8.941 0.628 -5.709 845 HD2 PHE 108 HD2 PHE 108 -9.543 -3.397 -4.467 846 HE1 PHE 108 HE1 PHE 108 -9.641 0.032 -7.992 847 HE2 PHE 108 HE2 PHE 108 -10.245 -4.000 -6.747 848 HZ PHE 108 HZ PHE 108 -10.295 -2.285 -8.512 849 H THR 109 H THR 109 -6.950 0.999 -2.245 850 HA THR 109 HA THR 109 -6.783 0.022 0.511 851 HB THR 109 HB THR 109 -4.771 1.916 -0.717 852 HG1 THR 109 HG1 THR 109 -3.439 0.257 -0.839 853 1HG2 THR 109 1HG2 THR 109 -4.114 0.653 1.819 854 2HG2 THR 109 2HG2 THR 109 -5.477 1.769 1.916 855 3HG2 THR 109 3HG2 THR 109 -3.924 2.327 1.295 856 H ALA 110 H ALA 110 -8.221 1.097 1.672 857 HA ALA 110 HA ALA 110 -8.807 3.896 0.956 858 1HB ALA 110 1HB ALA 110 -10.569 1.634 1.675 859 2HB ALA 110 2HB ALA 110 -10.852 2.995 0.590 860 3HB ALA 110 3HB ALA 110 -10.998 3.213 2.334 861 H GLY 111 H GLY 111 -7.946 5.263 2.371 862 1HA GLY 111 1HA GLY 111 -7.989 4.508 5.229 863 2HA GLY 111 2HA GLY 111 -6.624 5.339 4.499 864 H VAL 112 H VAL 112 -8.116 6.248 6.748 865 HA VAL 112 HA VAL 112 -9.409 8.647 5.624 866 HB VAL 112 HB VAL 112 -10.507 8.822 7.913 867 1HG1 VAL 112 1HG1 VAL 112 -11.173 6.576 6.022 868 2HG1 VAL 112 2HG1 VAL 112 -11.829 8.213 6.033 869 3HG1 VAL 112 3HG1 VAL 112 -12.234 7.092 7.332 870 1HG2 VAL 112 1HG2 VAL 112 -10.315 7.204 9.466 871 2HG2 VAL 112 2HG2 VAL 112 -8.811 6.835 8.622 872 3HG2 VAL 112 3HG2 VAL 112 -10.272 5.913 8.265 873 H THR 113 H THR 113 -8.771 10.639 6.321 874 HA THR 113 HA THR 113 -6.665 10.755 8.369 875 HB THR 113 HB THR 113 -6.531 12.628 6.052 876 HG1 THR 113 HG1 THR 113 -5.884 11.164 4.694 877 1HG2 THR 113 1HG2 THR 113 -4.307 11.202 7.472 878 2HG2 THR 113 2HG2 THR 113 -4.974 12.739 8.023 879 3HG2 THR 113 3HG2 THR 113 -4.209 12.626 6.438 880 H ALA 114 H ALA 114 -6.847 12.375 9.818 881 HA ALA 114 HA ALA 114 -9.197 14.102 9.583 882 1HB ALA 114 1HB ALA 114 -7.590 14.141 12.059 883 2HB ALA 114 2HB ALA 114 -8.380 12.616 11.663 884 3HB ALA 114 3HB ALA 114 -9.339 14.085 11.839 885 H ARG 115 H ARG 115 -9.105 16.304 9.571 886 HA ARG 115 HA ARG 115 -6.856 17.850 10.252 887 1HB ARG 115 1HB ARG 115 -6.009 16.734 8.154 888 2HB ARG 115 2HB ARG 115 -7.263 17.593 7.271 889 1HG ARG 115 1HG ARG 115 -6.223 19.710 8.344 890 2HG ARG 115 2HG ARG 115 -4.822 18.670 8.611 891 1HD ARG 115 1HD ARG 115 -4.428 19.721 6.545 892 2HD ARG 115 2HD ARG 115 -4.971 18.092 6.142 893 HE ARG 115 HE ARG 115 -7.256 19.548 6.097 894 1HH1 ARG 115 1HH1 ARG 115 -4.148 19.909 4.553 895 2HH1 ARG 115 2HH1 ARG 115 -4.794 20.705 3.157 896 1HH2 ARG 115 1HH2 ARG 115 -8.108 20.595 4.263 897 2HH2 ARG 115 2HH2 ARG 115 -7.042 21.095 2.993 898 H ASP 116 H ASP 116 -8.412 19.106 11.254 899 HA ASP 116 HA ASP 116 -9.478 21.244 9.789 900 1HB ASP 116 1HB ASP 116 -11.038 19.085 9.350 901 2HB ASP 116 2HB ASP 116 -11.795 19.708 10.813 902 HD2 ASP 116 HD2 ASP 116 -12.815 21.374 7.550 903 H ASN 117 H ASN 117 -11.450 22.228 11.263 904 HA ASN 117 HA ASN 117 -10.205 22.548 13.880 905 1HB ASN 117 1HB ASN 117 -10.818 24.542 12.504 906 2HB ASN 117 2HB ASN 117 -12.512 24.090 12.674 907 1HD2 ASN 117 1HD2 ASN 117 -13.048 25.969 13.746 908 2HD2 ASN 117 2HD2 ASN 117 -12.559 26.286 15.372 909 H TRP 118 H TRP 118 -13.459 21.965 12.552 910 HA TRP 118 HA TRP 118 -14.319 20.982 15.173 911 1HB TRP 118 1HB TRP 118 -15.864 21.711 12.681 912 2HB TRP 118 2HB TRP 118 -16.605 21.000 14.111 913 HD1 TRP 118 HD1 TRP 118 -13.988 23.856 14.011 914 HE1 TRP 118 HE1 TRP 118 -15.002 25.903 15.197 915 HE3 TRP 118 HE3 TRP 118 -18.667 22.019 14.945 916 HZ2 TRP 118 HZ2 TRP 118 -17.459 26.641 16.372 917 HZ3 TRP 118 HZ3 TRP 118 -20.290 23.459 16.105 918 HH2 TRP 118 HH2 TRP 118 -19.697 25.723 16.804 919 H ASN 119 H ASN 119 -13.801 18.903 15.461 920 HA ASN 119 HA ASN 119 -13.461 16.998 13.428 921 1HB ASN 119 1HB ASN 119 -13.966 16.705 16.389 922 2HB ASN 119 2HB ASN 119 -13.650 15.331 15.335 923 1HD2 ASN 119 1HD2 ASN 119 -12.111 16.330 17.588 924 2HD2 ASN 119 2HD2 ASN 119 -10.535 16.681 16.977 925 H TYR 120 H TYR 120 -15.023 16.406 12.072 926 HA TYR 120 HA TYR 120 -17.592 15.551 13.217 927 1HB TYR 120 1HB TYR 120 -17.100 17.483 10.996 928 2HB TYR 120 2HB TYR 120 -18.487 16.405 10.868 929 HD1 TYR 120 HD1 TYR 120 -17.697 19.591 11.693 930 HD2 TYR 120 HD2 TYR 120 -19.692 16.239 13.393 931 HE1 TYR 120 HE1 TYR 120 -18.997 21.103 13.133 932 HE2 TYR 120 HE2 TYR 120 -20.997 17.742 14.838 933 HH TYR 120 HH TYR 120 -20.261 20.641 15.619 934 H ILE 121 H ILE 121 -16.111 15.639 9.974 935 HA ILE 121 HA ILE 121 -16.358 12.706 9.877 936 HB ILE 121 HB ILE 121 -16.857 12.946 7.425 937 1HG1 ILE 121 1HG1 ILE 121 -17.891 15.684 7.885 938 2HG1 ILE 121 2HG1 ILE 121 -16.144 15.535 7.723 939 1HG2 ILE 121 1HG2 ILE 121 -19.018 14.266 9.018 940 2HG2 ILE 121 2HG2 ILE 121 -18.533 12.605 9.365 941 3HG2 ILE 121 3HG2 ILE 121 -19.148 13.029 7.768 942 1HD1 ILE 121 1HD1 ILE 121 -17.429 16.029 5.616 943 2HD1 ILE 121 2HD1 ILE 121 -18.061 14.385 5.721 944 3HD1 ILE 121 3HD1 ILE 121 -16.326 14.656 5.547 945 HA PRO 122 HA PRO 122 -12.094 12.959 8.664 946 1HB PRO 122 1HB PRO 122 -11.710 10.414 7.881 947 2HB PRO 122 2HB PRO 122 -11.937 10.845 9.580 948 1HG PRO 122 1HG PRO 122 -13.913 9.727 7.629 949 2HG PRO 122 2HG PRO 122 -13.644 9.287 9.325 950 1HD PRO 122 1HD PRO 122 -15.654 10.942 8.497 951 2HD PRO 122 2HD PRO 122 -14.909 11.034 10.106 952 H LEU 123 H LEU 123 -10.693 12.187 6.738 953 HA LEU 123 HA LEU 123 -12.184 12.724 4.254 954 1HB LEU 123 1HB LEU 123 -9.547 13.640 5.265 955 2HB LEU 123 2HB LEU 123 -9.670 13.318 3.546 956 HG LEU 123 HG LEU 123 -11.744 15.053 4.798 957 1HD1 LEU 123 1HD1 LEU 123 -10.104 16.326 5.690 958 2HD1 LEU 123 2HD1 LEU 123 -9.985 16.920 4.034 959 3HD1 LEU 123 3HD1 LEU 123 -8.866 15.685 4.610 960 1HD2 LEU 123 1HD2 LEU 123 -10.467 14.684 2.124 961 2HD2 LEU 123 2HD2 LEU 123 -11.242 16.217 2.522 962 3HD2 LEU 123 3HD2 LEU 123 -12.176 14.722 2.558 963 HA PRO 124 HA PRO 124 -10.676 8.413 3.752 964 1HB PRO 124 1HB PRO 124 -12.677 7.669 2.069 965 2HB PRO 124 2HB PRO 124 -12.840 7.647 3.829 966 1HG PRO 124 1HG PRO 124 -13.778 9.702 1.864 967 2HG PRO 124 2HG PRO 124 -14.622 9.033 3.272 968 1HD PRO 124 1HD PRO 124 -13.400 11.445 3.325 969 2HD PRO 124 2HD PRO 124 -13.496 10.395 4.754 970 H VAL 125 H VAL 125 -9.668 7.409 2.000 971 HA VAL 125 HA VAL 125 -9.751 8.681 -0.613 972 HB VAL 125 HB VAL 125 -7.214 8.736 -0.689 973 1HG1 VAL 125 1HG1 VAL 125 -8.938 10.680 -0.262 974 2HG1 VAL 125 2HG1 VAL 125 -7.200 10.962 -0.160 975 3HG1 VAL 125 3HG1 VAL 125 -8.144 10.732 1.312 976 1HG2 VAL 125 1HG2 VAL 125 -5.939 8.428 1.149 977 2HG2 VAL 125 2HG2 VAL 125 -7.319 7.473 1.690 978 3HG2 VAL 125 3HG2 VAL 125 -7.135 9.142 2.229 979 H LEU 126 H LEU 126 -9.819 7.135 -2.098 980 HA LEU 126 HA LEU 126 -8.620 4.520 -1.459 981 1HB LEU 126 1HB LEU 126 -11.232 4.941 -1.869 982 2HB LEU 126 2HB LEU 126 -10.730 4.727 -3.534 983 HG LEU 126 HG LEU 126 -9.869 2.688 -1.541 984 1HD1 LEU 126 1HD1 LEU 126 -12.020 1.465 -2.012 985 2HD1 LEU 126 2HD1 LEU 126 -12.663 2.994 -2.610 986 3HD1 LEU 126 3HD1 LEU 126 -12.150 2.850 -0.929 987 1HD2 LEU 126 1HD2 LEU 126 -9.028 2.153 -3.599 988 2HD2 LEU 126 2HD2 LEU 126 -10.384 2.874 -4.465 989 3HD2 LEU 126 3HD2 LEU 126 -10.575 1.310 -3.673 990 H LEU 127 H LEU 127 -6.970 3.915 -2.686 991 HA LEU 127 HA LEU 127 -6.862 4.702 -5.489 992 1HB LEU 127 1HB LEU 127 -4.478 5.153 -3.707 993 2HB LEU 127 2HB LEU 127 -4.676 5.635 -5.381 994 HG LEU 127 HG LEU 127 -6.667 7.065 -4.385 995 1HD1 LEU 127 1HD1 LEU 127 -5.877 5.957 -2.072 996 2HD1 LEU 127 2HD1 LEU 127 -6.622 7.552 -2.182 997 3HD1 LEU 127 3HD1 LEU 127 -4.867 7.404 -2.072 998 1HD2 LEU 127 1HD2 LEU 127 -5.149 8.362 -5.448 999 2HD2 LEU 127 2HD2 LEU 127 -3.772 7.580 -4.670 1000 3HD2 LEU 127 3HD2 LEU 127 -4.709 8.791 -3.794 1001 HA PRO 128 HA PRO 128 -5.268 0.658 -6.170 1002 1HB PRO 128 1HB PRO 128 -3.195 1.807 -7.945 1003 2HB PRO 128 2HB PRO 128 -4.466 0.637 -8.311 1004 1HG PRO 128 1HG PRO 128 -4.619 3.158 -9.182 1005 2HG PRO 128 2HG PRO 128 -6.064 2.279 -8.649 1006 1HD PRO 128 1HD PRO 128 -4.472 4.364 -7.206 1007 2HD PRO 128 2HD PRO 128 -6.232 4.132 -7.272 1008 H LEU 129 H LEU 129 -3.663 -0.727 -5.483 1009 HA LEU 129 HA LEU 129 -1.088 0.331 -4.656 1010 1HB LEU 129 1HB LEU 129 -2.768 0.590 -2.743 1011 2HB LEU 129 2HB LEU 129 -2.754 -1.160 -2.643 1012 HG LEU 129 HG LEU 129 -0.128 -0.763 -2.482 1013 1HD1 LEU 129 1HD1 LEU 129 0.306 1.237 -1.087 1014 2HD1 LEU 129 2HD1 LEU 129 -1.337 1.784 -1.422 1015 3HD1 LEU 129 3HD1 LEU 129 -0.176 1.626 -2.738 1016 1HD2 LEU 129 1HD2 LEU 129 -0.312 -1.274 -0.252 1017 2HD2 LEU 129 2HD2 LEU 129 -1.914 -1.729 -0.830 1018 3HD2 LEU 129 3HD2 LEU 129 -1.680 -0.189 -0.003 1019 H ALA 130 H ALA 130 0.509 -1.249 -4.411 1020 HA ALA 130 HA ALA 130 -0.237 -4.038 -4.843 1021 1HB ALA 130 1HB ALA 130 1.703 -2.587 -6.639 1022 2HB ALA 130 2HB ALA 130 0.086 -3.128 -7.090 1023 3HB ALA 130 3HB ALA 130 1.332 -4.310 -6.688 1024 H SER 131 H SER 131 1.036 -5.425 -3.754 1025 HA SER 131 HA SER 131 3.494 -4.342 -2.540 1026 1HB SER 131 1HB SER 131 3.074 -5.561 -0.565 1027 2HB SER 131 2HB SER 131 1.502 -4.896 -1.008 1028 HG SER 131 HG SER 131 0.794 -6.858 -1.147 1029 H VAL 132 H VAL 132 5.284 -5.731 -2.323 1030 HA VAL 132 HA VAL 132 5.159 -8.245 -3.840 1031 HB VAL 132 HB VAL 132 7.437 -6.282 -4.093 1032 1HG1 VAL 132 1HG1 VAL 132 8.323 -8.356 -4.583 1033 2HG1 VAL 132 2HG1 VAL 132 7.793 -7.807 -6.173 1034 3HG1 VAL 132 3HG1 VAL 132 6.812 -8.957 -5.265 1035 1HG2 VAL 132 1HG2 VAL 132 6.598 -5.578 -6.178 1036 2HG2 VAL 132 2HG2 VAL 132 5.219 -5.516 -5.078 1037 3HG2 VAL 132 3HG2 VAL 132 5.384 -6.857 -6.212 1038 H GLY 133 H GLY 133 5.808 -9.859 -2.585 1039 1HA GLY 133 1HA GLY 133 7.488 -9.281 -0.261 1040 2HA GLY 133 2HA GLY 133 6.588 -10.763 -0.547 1041 H TYR 134 H TYR 134 9.615 -9.406 -0.490 1042 HA TYR 134 HA TYR 134 10.727 -11.705 -1.932 1043 1HB TYR 134 1HB TYR 134 10.722 -9.358 -3.181 1044 2HB TYR 134 2HB TYR 134 12.146 -9.093 -2.179 1045 HD1 TYR 134 HD1 TYR 134 13.546 -11.576 -2.135 1046 HD2 TYR 134 HD2 TYR 134 11.362 -9.834 -5.344 1047 HE1 TYR 134 HE1 TYR 134 14.917 -12.835 -3.743 1048 HE2 TYR 134 HE2 TYR 134 12.726 -11.088 -6.961 1049 HH TYR 134 HH TYR 134 15.583 -12.749 -6.059 1050 H GLY 135 H GLY 135 11.878 -12.821 -0.508 1051 1HA GLY 135 1HA GLY 135 13.315 -13.333 1.207 1052 2HA GLY 135 2HA GLY 135 14.091 -11.794 0.866 1053 HA PRO 136 HA PRO 136 12.398 -11.378 5.110 1054 1HB PRO 136 1HB PRO 136 14.426 -9.888 6.084 1055 2HB PRO 136 2HB PRO 136 14.524 -11.648 5.954 1056 1HG PRO 136 1HG PRO 136 15.640 -9.550 4.133 1057 2HG PRO 136 2HG PRO 136 16.401 -11.040 4.721 1058 1HD PRO 136 1HD PRO 136 15.280 -10.818 2.252 1059 2HD PRO 136 2HD PRO 136 15.342 -12.346 3.153 1060 H VAL 137 H VAL 137 12.989 -9.250 2.551 1061 HA VAL 137 HA VAL 137 11.815 -6.989 4.032 1062 HB VAL 137 HB VAL 137 12.677 -5.584 2.124 1063 1HG1 VAL 137 1HG1 VAL 137 14.572 -5.146 3.279 1064 2HG1 VAL 137 2HG1 VAL 137 15.072 -6.837 3.316 1065 3HG1 VAL 137 3HG1 VAL 137 13.845 -6.256 4.441 1066 1HG2 VAL 137 1HG2 VAL 137 14.224 -8.095 1.486 1067 2HG2 VAL 137 2HG2 VAL 137 14.478 -6.511 0.754 1068 3HG2 VAL 137 3HG2 VAL 137 12.963 -7.373 0.488 1069 H THR 138 H THR 138 10.222 -5.699 2.954 1070 HA THR 138 HA THR 138 8.827 -7.082 0.760 1071 HB THR 138 HB THR 138 6.754 -5.911 2.003 1072 HG1 THR 138 HG1 THR 138 7.043 -6.230 4.258 1073 1HG2 THR 138 1HG2 THR 138 7.173 -8.314 3.455 1074 2HG2 THR 138 2HG2 THR 138 7.719 -8.550 1.795 1075 3HG2 THR 138 3HG2 THR 138 6.072 -8.004 2.112 1076 H PHE 139 H PHE 139 8.508 -5.847 -0.966 1077 HA PHE 139 HA PHE 139 9.021 -2.986 -0.773 1078 1HB PHE 139 1HB PHE 139 9.698 -4.868 -2.660 1079 2HB PHE 139 2HB PHE 139 8.329 -4.059 -3.414 1080 HD1 PHE 139 HD1 PHE 139 11.768 -4.045 -3.162 1081 HD2 PHE 139 HD2 PHE 139 8.452 -1.378 -3.123 1082 HE1 PHE 139 HE1 PHE 139 13.246 -2.202 -3.851 1083 HE2 PHE 139 HE2 PHE 139 9.924 0.469 -3.812 1084 HZ PHE 139 HZ PHE 139 12.325 0.058 -4.178 1085 H GLN 140 H GLN 140 7.569 -1.392 -1.329 1086 HA GLN 140 HA GLN 140 4.827 -2.220 -1.966 1087 1HB GLN 140 1HB GLN 140 5.749 -0.995 0.495 1088 2HB GLN 140 2HB GLN 140 4.550 0.013 -0.304 1089 1HG GLN 140 1HG GLN 140 4.026 -2.901 0.039 1090 2HG GLN 140 2HG GLN 140 3.819 -1.806 1.405 1091 1HE2 GLN 140 1HE2 GLN 140 2.458 -3.045 -1.432 1092 2HE2 GLN 140 2HE2 GLN 140 1.054 -2.040 -1.490 1093 H MET 141 H MET 141 3.617 -0.733 -3.155 1094 HA MET 141 HA MET 141 4.745 1.836 -3.847 1095 1HB MET 141 1HB MET 141 4.817 -0.493 -5.691 1096 2HB MET 141 2HB MET 141 4.360 1.060 -6.379 1097 1HG MET 141 1HG MET 141 6.436 2.040 -5.568 1098 2HG MET 141 2HG MET 141 6.893 0.493 -4.856 1099 1HE MET 141 1HE MET 141 9.208 1.592 -7.173 1100 2HE MET 141 2HE MET 141 9.403 -0.155 -7.321 1101 3HE MET 141 3HE MET 141 8.982 0.557 -5.762 1102 H THR 142 H THR 142 3.188 3.277 -4.315 1103 HA THR 142 HA THR 142 0.465 2.233 -4.736 1104 HB THR 142 HB THR 142 0.760 3.384 -2.579 1105 HG1 THR 142 HG1 THR 142 -0.982 4.798 -2.837 1106 1HG2 THR 142 1HG2 THR 142 1.056 5.830 -2.541 1107 2HG2 THR 142 2HG2 THR 142 1.474 5.777 -4.254 1108 3HG2 THR 142 3HG2 THR 142 2.497 4.963 -3.071 1109 H TYR 143 H TYR 143 -0.695 2.941 -6.442 1110 HA TYR 143 HA TYR 143 0.642 4.820 -8.263 1111 1HB TYR 143 1HB TYR 143 -1.631 2.962 -8.961 1112 2HB TYR 143 2HB TYR 143 -0.536 3.793 -10.061 1113 HD1 TYR 143 HD1 TYR 143 -0.916 0.965 -7.758 1114 HD2 TYR 143 HD2 TYR 143 1.695 2.942 -10.474 1115 HE1 TYR 143 HE1 TYR 143 0.548 -1.010 -7.779 1116 HE2 TYR 143 HE2 TYR 143 3.167 0.971 -10.503 1117 HH TYR 143 HH TYR 143 3.058 -1.438 -8.263 1118 H ILE 144 H ILE 144 -0.683 6.349 -9.447 1119 HA ILE 144 HA ILE 144 -2.855 7.382 -7.773 1120 HB ILE 144 HB ILE 144 -0.986 8.913 -8.265 1121 1HG1 ILE 144 1HG1 ILE 144 -2.539 10.712 -9.443 1122 2HG1 ILE 144 2HG1 ILE 144 -3.776 9.491 -9.157 1123 1HG2 ILE 144 1HG2 ILE 144 -0.971 7.827 -10.747 1124 2HG2 ILE 144 2HG2 ILE 144 -0.189 9.348 -10.319 1125 3HG2 ILE 144 3HG2 ILE 144 -1.793 9.357 -11.052 1126 1HD1 ILE 144 1HD1 ILE 144 -2.315 9.779 -6.761 1127 2HD1 ILE 144 2HD1 ILE 144 -3.989 10.230 -7.088 1128 3HD1 ILE 144 3HD1 ILE 144 -2.693 11.397 -7.354 1129 HA PRO 145 HA PRO 145 -5.780 6.060 -10.863 1130 1HB PRO 145 1HB PRO 145 -7.943 7.421 -9.968 1131 2HB PRO 145 2HB PRO 145 -7.318 5.982 -9.153 1132 1HG PRO 145 1HG PRO 145 -6.897 8.871 -8.484 1133 2HG PRO 145 2HG PRO 145 -7.250 7.512 -7.400 1134 1HD PRO 145 1HD PRO 145 -4.750 8.501 -7.734 1135 2HD PRO 145 2HD PRO 145 -5.062 6.790 -7.386 1136 H GLY 146 H GLY 146 -6.149 6.776 -12.869 1137 1HA GLY 146 1HA GLY 146 -7.305 8.889 -13.914 1138 2HA GLY 146 2HA GLY 146 -5.793 9.632 -13.413 1139 H THR 147 H THR 147 -6.986 9.199 -16.101 1140 HA THR 147 HA THR 147 -4.859 7.544 -17.289 1141 HB THR 147 HB THR 147 -6.531 7.808 -19.344 1142 HG1 THR 147 HG1 THR 147 -8.673 7.794 -18.578 1143 1HG2 THR 147 1HG2 THR 147 -7.644 5.733 -18.725 1144 2HG2 THR 147 2HG2 THR 147 -7.037 5.898 -17.078 1145 3HG2 THR 147 3HG2 THR 147 -5.910 5.657 -18.413 1146 H TYR 148 H TYR 148 -4.480 10.269 -16.437 1147 HA TYR 148 HA TYR 148 -4.685 12.126 -18.523 1148 1HB TYR 148 1HB TYR 148 -3.997 12.380 -15.981 1149 2HB TYR 148 2HB TYR 148 -2.369 12.248 -16.639 1150 HD1 TYR 148 HD1 TYR 148 -5.546 14.123 -17.237 1151 HD2 TYR 148 HD2 TYR 148 -1.293 14.187 -17.288 1152 HE1 TYR 148 HE1 TYR 148 -5.595 16.511 -17.818 1153 HE2 TYR 148 HE2 TYR 148 -1.330 16.576 -17.868 1154 HH TYR 148 HH TYR 148 -3.083 18.154 -19.064 1155 H ASN 149 H ASN 149 -2.749 13.131 -19.631 1156 HA ASN 149 HA ASN 149 -1.162 10.977 -20.833 1157 1HB ASN 149 1HB ASN 149 -0.804 12.530 -22.703 1158 2HB ASN 149 2HB ASN 149 -2.521 12.300 -22.383 1159 1HD2 ASN 149 1HD2 ASN 149 -3.646 13.966 -21.234 1160 2HD2 ASN 149 2HD2 ASN 149 -3.099 15.601 -21.328 1161 H ASN 150 H ASN 150 0.872 10.757 -20.205 1162 HA ASN 150 HA ASN 150 2.959 11.198 -19.420 1163 1HB ASN 150 1HB ASN 150 2.422 13.155 -21.323 1164 2HB ASN 150 2HB ASN 150 3.026 14.064 -19.940 1165 1HD2 ASN 150 1HD2 ASN 150 5.132 13.762 -19.252 1166 2HD2 ASN 150 2HD2 ASN 150 6.313 12.952 -20.218 1167 H GLY 151 H GLY 151 4.223 12.649 -17.858 1168 1HA GLY 151 1HA GLY 151 4.371 13.830 -15.873 1169 2HA GLY 151 2HA GLY 151 2.675 14.258 -16.043 1170 H ASN 152 H ASN 152 3.747 10.941 -16.151 1171 HA ASN 152 HA ASN 152 2.066 10.303 -13.897 1172 1HB ASN 152 1HB ASN 152 2.800 7.950 -14.378 1173 2HB ASN 152 2HB ASN 152 2.041 8.766 -15.742 1174 1HD2 ASN 152 1HD2 ASN 152 3.171 9.078 -17.579 1175 2HD2 ASN 152 2HD2 ASN 152 4.795 8.542 -17.823 1176 H VAL 153 H VAL 153 2.739 9.307 -11.965 1177 HA VAL 153 HA VAL 153 5.570 9.140 -11.365 1178 HB VAL 153 HB VAL 153 5.080 11.504 -10.905 1179 1HG1 VAL 153 1HG1 VAL 153 3.359 10.872 -8.587 1180 2HG1 VAL 153 2HG1 VAL 153 2.616 10.738 -10.181 1181 3HG1 VAL 153 3HG1 VAL 153 3.341 12.262 -9.671 1182 1HG2 VAL 153 1HG2 VAL 153 5.566 9.792 -8.470 1183 2HG2 VAL 153 2HG2 VAL 153 5.836 11.533 -8.535 1184 3HG2 VAL 153 3HG2 VAL 153 6.776 10.455 -9.568 1185 H TYR 154 H TYR 154 5.947 7.481 -10.038 1186 HA TYR 154 HA TYR 154 3.665 6.364 -8.547 1187 1HB TYR 154 1HB TYR 154 6.143 4.908 -9.486 1188 2HB TYR 154 2HB TYR 154 4.719 4.190 -8.740 1189 HD1 TYR 154 HD1 TYR 154 6.303 4.287 -11.698 1190 HD2 TYR 154 HD2 TYR 154 2.471 5.238 -10.114 1191 HE1 TYR 154 HE1 TYR 154 5.310 3.963 -13.923 1192 HE2 TYR 154 HE2 TYR 154 1.466 4.915 -12.336 1193 HH TYR 154 HH TYR 154 2.356 3.372 -14.552 1194 H PHE 155 H PHE 155 3.850 5.951 -6.399 1195 HA PHE 155 HA PHE 155 6.305 6.907 -5.101 1196 1HB PHE 155 1HB PHE 155 4.130 8.012 -4.526 1197 2HB PHE 155 2HB PHE 155 3.584 6.480 -3.854 1198 HD1 PHE 155 HD1 PHE 155 6.135 9.138 -3.509 1199 HD2 PHE 155 HD2 PHE 155 4.164 5.842 -1.677 1200 HE1 PHE 155 HE1 PHE 155 7.171 9.722 -1.356 1201 HE2 PHE 155 HE2 PHE 155 5.196 6.420 0.482 1202 HZ PHE 155 HZ PHE 155 6.701 8.362 0.644 1203 H ALA 156 H ALA 156 7.532 5.595 -3.879 1204 HA ALA 156 HA ALA 156 6.622 2.813 -3.559 1205 1HB ALA 156 1HB ALA 156 8.727 2.068 -3.972 1206 2HB ALA 156 2HB ALA 156 9.490 3.487 -3.255 1207 3HB ALA 156 3HB ALA 156 8.804 3.580 -4.877 1208 H TRP 157 H TRP 157 7.632 1.681 -1.636 1209 HA TRP 157 HA TRP 157 8.342 3.288 0.633 1210 1HB TRP 157 1HB TRP 157 5.602 2.890 0.184 1211 2HB TRP 157 2HB TRP 157 6.030 1.755 1.459 1212 HD1 TRP 157 HD1 TRP 157 8.334 3.903 2.624 1213 HE1 TRP 157 HE1 TRP 157 7.453 5.800 4.124 1214 HE3 TRP 157 HE3 TRP 157 3.413 3.818 1.238 1215 HZ2 TRP 157 HZ2 TRP 157 4.998 7.090 4.650 1216 HZ3 TRP 157 HZ3 TRP 157 1.864 5.416 2.287 1217 HH2 TRP 157 HH2 TRP 157 2.642 7.018 3.958 1218 H MET 158 H MET 158 8.735 1.949 2.575 1219 HA MET 158 HA MET 158 9.513 -0.781 1.795 1220 1HB MET 158 1HB MET 158 10.797 1.298 3.480 1221 2HB MET 158 2HB MET 158 10.973 -0.369 4.009 1222 1HG MET 158 1HG MET 158 11.611 0.479 1.207 1223 2HG MET 158 2HG MET 158 12.788 0.599 2.514 1224 1HE MET 158 1HE MET 158 14.427 -0.902 1.066 1225 2HE MET 158 2HE MET 158 14.541 -2.550 1.685 1226 3HE MET 158 3HE MET 158 14.507 -1.188 2.805 1227 H ARG 159 H ARG 159 8.889 -2.503 3.004 1228 HA ARG 159 HA ARG 159 7.313 -1.965 5.430 1229 1HB ARG 159 1HB ARG 159 6.112 -2.665 3.137 1230 2HB ARG 159 2HB ARG 159 6.522 -4.268 3.731 1231 1HG ARG 159 1HG ARG 159 5.386 -3.643 5.885 1232 2HG ARG 159 2HG ARG 159 4.801 -2.195 5.062 1233 1HD ARG 159 1HD ARG 159 3.056 -3.746 4.850 1234 2HD ARG 159 2HD ARG 159 3.879 -3.782 3.291 1235 HE ARG 159 HE ARG 159 5.069 -5.766 4.743 1236 1HH1 ARG 159 1HH1 ARG 159 1.787 -5.022 3.817 1237 2HH1 ARG 159 2HH1 ARG 159 1.288 -6.680 3.783 1238 1HH2 ARG 159 1HH2 ARG 159 4.414 -7.947 4.699 1239 2HH2 ARG 159 2HH2 ARG 159 2.780 -8.341 4.285 1240 H PHE 160 H PHE 160 7.291 -3.645 6.995 1241 HA PHE 160 HA PHE 160 9.283 -5.767 6.608 1242 1HB PHE 160 1HB PHE 160 9.886 -3.564 8.069 1243 2HB PHE 160 2HB PHE 160 9.172 -4.582 9.315 1244 HD1 PHE 160 HD1 PHE 160 11.716 -4.666 6.600 1245 HD2 PHE 160 HD2 PHE 160 10.479 -6.151 10.392 1246 HE1 PHE 160 HE1 PHE 160 13.843 -5.886 6.812 1247 HE2 PHE 160 HE2 PHE 160 12.603 -7.373 10.611 1248 HZ PHE 160 HZ PHE 160 14.288 -7.241 8.819 1249 H GLN 161 H GLN 161 8.826 -7.699 7.593 1250 HA GLN 161 HA GLN 161 6.120 -7.951 8.672 1251 1HB GLN 161 1HB GLN 161 8.030 -9.783 7.317 1252 2HB GLN 161 2HB GLN 161 6.916 -10.497 8.474 1253 1HG GLN 161 1HG GLN 161 5.323 -8.839 6.928 1254 2HG GLN 161 2HG GLN 161 6.445 -9.568 5.780 1255 1HE2 GLN 161 1HE2 GLN 161 4.175 -10.324 8.371 1256 2HE2 GLN 161 2HE2 GLN 161 3.725 -11.879 7.769 1257 H PHE 162 H PHE 162 5.835 -7.992 10.791 1258 HA PHE 162 HA PHE 162 8.068 -8.829 12.507 1259 1HB PHE 162 1HB PHE 162 5.942 -6.803 12.749 1260 2HB PHE 162 2HB PHE 162 6.253 -7.722 14.218 1261 HD1 PHE 162 HD1 PHE 162 8.249 -6.090 11.513 1262 HD2 PHE 162 HD2 PHE 162 7.729 -6.773 15.681 1263 HE1 PHE 162 HE1 PHE 162 10.196 -4.660 11.987 1264 HE2 PHE 162 HE2 PHE 162 9.673 -5.345 16.163 1265 HZ PHE 162 HZ PHE 162 10.909 -4.285 14.314 1266 H LEU 163 H LEU 163 7.952 -10.707 13.539 1267 HA LEU 163 HA LEU 163 5.306 -11.967 13.852 1268 1HB LEU 163 1HB LEU 163 7.458 -12.925 12.431 1269 2HB LEU 163 2HB LEU 163 7.625 -13.750 13.970 1270 HG LEU 163 HG LEU 163 6.375 -15.146 12.462 1271 1HD1 LEU 163 1HD1 LEU 163 5.680 -14.765 14.950 1272 2HD1 LEU 163 2HD1 LEU 163 4.665 -15.732 13.880 1273 3HD1 LEU 163 3HD1 LEU 163 4.235 -14.057 14.229 1274 1HD2 LEU 163 1HD2 LEU 163 4.723 -14.465 11.084 1275 2HD2 LEU 163 2HD2 LEU 163 5.489 -12.891 11.298 1276 3HD2 LEU 163 3HD2 LEU 163 4.070 -13.319 12.255 1277 H GLU 164 H GLU 164 4.803 -12.948 15.792 1278 HA GLU 164 HA GLU 164 6.650 -12.365 18.012 1279 1HB GLU 164 1HB GLU 164 3.645 -12.665 18.136 1280 2HB GLU 164 2HB GLU 164 4.704 -12.204 19.460 1281 1HG GLU 164 1HG GLU 164 5.333 -10.315 17.631 1282 2HG GLU 164 2HG GLU 164 3.638 -10.604 17.245 1283 HE2 GLU 164 HE2 GLU 164 2.633 -9.381 20.395 1284 H HIS 165 H HIS 165 7.720 -14.178 18.489 1285 HA HIS 165 HA HIS 165 6.256 -16.725 18.506 1286 1HB HIS 165 1HB HIS 165 9.135 -15.997 18.143 1287 2HB HIS 165 2HB HIS 165 8.731 -17.587 18.784 1288 HD1 HIS 165 HD1 HIS 165 7.157 -19.085 17.189 1289 HD2 HIS 165 HD2 HIS 165 8.955 -15.776 15.430 1290 HE1 HIS 165 HE1 HIS 165 7.005 -19.475 14.709 1291 HE2 HIS 165 HE2 HIS 165 8.174 -17.501 13.668 1292 H HIS 166 H HIS 166 7.389 -18.298 20.206 1293 HA HIS 166 HA HIS 166 6.603 -17.376 22.748 1294 1HB HIS 166 1HB HIS 166 8.178 -19.790 21.858 1295 2HB HIS 166 2HB HIS 166 7.776 -19.499 23.547 1296 HD1 HIS 166 HD1 HIS 166 5.190 -18.550 21.085 1297 HD2 HIS 166 HD2 HIS 166 6.160 -21.851 23.414 1298 HE1 HIS 166 HE1 HIS 166 3.152 -20.022 21.046 1299 HE2 HIS 166 HE2 HIS 166 3.794 -22.055 22.390 1300 H HIS 167 H HIS 167 9.788 -17.767 21.255 1301 HA HIS 167 HA HIS 167 11.008 -16.485 23.600 1302 1HB HIS 167 1HB HIS 167 13.154 -17.318 22.707 1303 2HB HIS 167 2HB HIS 167 12.006 -18.622 22.989 1304 HD1 HIS 167 HD1 HIS 167 10.721 -19.470 20.742 1305 HD2 HIS 167 HD2 HIS 167 14.210 -17.279 20.204 1306 HE1 HIS 167 HE1 HIS 167 11.452 -19.940 18.383 1307 HE2 HIS 167 HE2 HIS 167 13.611 -18.671 18.107 1308 H HIS 168 H HIS 168 11.753 -14.467 23.481 1309 HA HIS 168 HA HIS 168 12.530 -13.326 20.920 1310 1HB HIS 168 1HB HIS 168 11.110 -11.274 21.404 1311 2HB HIS 168 2HB HIS 168 10.239 -12.710 20.877 1312 HD1 HIS 168 HD1 HIS 168 8.048 -12.045 22.011 1313 HD2 HIS 168 HD2 HIS 168 11.264 -12.287 24.630 1314 HE1 HIS 168 HE1 HIS 168 7.046 -11.941 24.315 1315 HE2 HIS 168 HE2 HIS 168 9.019 -12.002 25.882 1316 H HIS 169 H HIS 169 14.006 -14.051 23.245 1317 HA HIS 169 HA HIS 169 14.897 -11.393 24.153 1318 1HB HIS 169 1HB HIS 169 13.984 -13.542 25.725 1319 2HB HIS 169 2HB HIS 169 15.730 -13.500 25.941 1320 HD1 HIS 169 HD1 HIS 169 13.613 -10.417 25.466 1321 HD2 HIS 169 HD2 HIS 169 15.716 -12.385 28.462 1322 HE1 HIS 169 HE1 HIS 169 13.636 -8.835 27.422 1323 HE2 HIS 169 HE2 HIS 169 14.987 -10.013 29.193 1324 H HIS 170 H HIS 170 16.106 -14.751 24.029 1325 HA HIS 170 HA HIS 170 18.320 -14.000 22.364 1326 1HB HIS 170 1HB HIS 170 20.091 -14.584 23.952 1327 2HB HIS 170 2HB HIS 170 19.142 -13.225 24.545 1328 HD1 HIS 170 HD1 HIS 170 17.650 -13.639 26.627 1329 HD2 HIS 170 HD2 HIS 170 19.942 -16.911 25.485 1330 HE1 HIS 170 HE1 HIS 170 17.543 -15.242 28.561 1331 HE2 HIS 170 HE2 HIS 170 19.008 -17.176 27.882 Start of MODEL 18 1 1H MET 1 1H MET 1 -11.991 -42.114 24.002 2 2H MET 1 2H MET 1 -10.411 -41.746 23.442 3 H MET 1 H MET 1 -11.518 -41.535 24.927 4 3H MET 1 3H MET 1 -10.834 -41.449 25.078 5 HA MET 1 HA MET 1 -11.292 -43.888 25.233 6 1HB MET 1 1HB MET 1 -10.959 -43.792 22.551 7 2HB MET 1 2HB MET 1 -9.328 -44.229 23.041 8 1HG MET 1 1HG MET 1 -10.715 -45.984 24.511 9 2HG MET 1 2HG MET 1 -11.828 -45.784 23.158 10 1HE MET 1 1HE MET 1 -10.829 -46.326 20.397 11 2HE MET 1 2HE MET 1 -9.070 -46.359 20.262 12 3HE MET 1 3HE MET 1 -9.873 -44.968 20.991 13 H ASN 2 H ASN 2 -8.453 -42.089 24.082 14 HA ASN 2 HA ASN 2 -6.978 -43.088 26.431 15 1HB ASN 2 1HB ASN 2 -5.911 -42.411 23.682 16 2HB ASN 2 2HB ASN 2 -4.905 -42.798 25.075 17 1HD2 ASN 2 1HD2 ASN 2 -6.106 -44.877 26.225 18 2HD2 ASN 2 2HD2 ASN 2 -6.193 -46.224 25.148 19 H ALA 3 H ALA 3 -7.848 -41.241 27.574 20 HA ALA 3 HA ALA 3 -7.541 -38.578 26.846 21 1HB ALA 3 1HB ALA 3 -8.895 -38.837 28.677 22 2HB ALA 3 2HB ALA 3 -7.410 -38.278 29.449 23 3HB ALA 3 3HB ALA 3 -7.812 -39.995 29.453 24 H ASP 4 H ASP 4 -5.161 -40.853 27.885 25 HA ASP 4 HA ASP 4 -3.234 -38.915 28.763 26 1HB ASP 4 1HB ASP 4 -3.310 -41.311 29.539 27 2HB ASP 4 2HB ASP 4 -2.733 -41.782 27.943 28 HD2 ASP 4 HD2 ASP 4 0.270 -39.809 28.857 29 H GLU 5 H GLU 5 -3.391 -41.094 25.944 30 HA GLU 5 HA GLU 5 -1.247 -39.794 24.593 31 1HB GLU 5 1HB GLU 5 -3.366 -41.607 23.428 32 2HB GLU 5 2HB GLU 5 -1.805 -41.225 22.714 33 1HG GLU 5 1HG GLU 5 -1.736 -42.384 25.420 34 2HG GLU 5 2HG GLU 5 -2.301 -43.446 24.132 35 HE2 GLU 5 HE2 GLU 5 1.416 -43.362 24.461 36 H TRP 6 H TRP 6 -4.675 -39.299 24.763 37 HA TRP 6 HA TRP 6 -4.838 -37.717 22.364 38 1HB TRP 6 1HB TRP 6 -6.720 -39.068 23.571 39 2HB TRP 6 2HB TRP 6 -6.883 -37.618 24.557 40 HD1 TRP 6 HD1 TRP 6 -7.022 -35.266 22.789 41 HE1 TRP 6 HE1 TRP 6 -8.680 -35.001 20.837 42 HE3 TRP 6 HE3 TRP 6 -8.135 -40.192 21.994 43 HZ2 TRP 6 HZ2 TRP 6 -10.251 -36.661 19.181 44 HZ3 TRP 6 HZ3 TRP 6 -9.725 -40.769 20.207 45 HH2 TRP 6 HH2 TRP 6 -10.761 -39.039 18.830 46 H MET 7 H MET 7 -4.294 -37.142 25.763 47 HA MET 7 HA MET 7 -4.860 -34.403 25.876 48 1HB MET 7 1HB MET 7 -3.302 -36.328 27.490 49 2HB MET 7 2HB MET 7 -2.847 -34.639 27.676 50 1HG MET 7 1HG MET 7 -5.732 -35.240 27.795 51 2HG MET 7 2HG MET 7 -4.746 -35.833 29.130 52 1HE MET 7 1HE MET 7 -5.336 -32.056 27.220 53 2HE MET 7 2HE MET 7 -6.523 -31.890 28.513 54 3HE MET 7 3HE MET 7 -6.559 -33.303 27.458 55 H THR 8 H THR 8 -1.819 -36.092 25.154 56 HA THR 8 HA THR 8 -0.201 -33.829 24.861 57 HB THR 8 HB THR 8 1.293 -35.295 23.551 58 HG1 THR 8 HG1 THR 8 -0.777 -37.218 23.766 59 1HG2 THR 8 1HG2 THR 8 1.689 -35.662 25.788 60 2HG2 THR 8 2HG2 THR 8 1.316 -37.284 25.201 61 3HG2 THR 8 3HG2 THR 8 0.091 -36.354 26.066 62 H THR 9 H THR 9 -2.259 -35.517 22.542 63 HA THR 9 HA THR 9 -1.439 -33.945 20.302 64 HB THR 9 HB THR 9 -3.664 -34.927 19.351 65 HG1 THR 9 HG1 THR 9 -4.612 -36.446 20.521 66 1HG2 THR 9 1HG2 THR 9 -1.625 -35.849 18.592 67 2HG2 THR 9 2HG2 THR 9 -2.638 -37.197 19.110 68 3HG2 THR 9 3HG2 THR 9 -1.325 -36.634 20.144 69 H PHE 10 H PHE 10 -3.913 -33.681 22.748 70 HA PHE 10 HA PHE 10 -5.511 -31.735 21.437 71 1HB PHE 10 1HB PHE 10 -5.818 -33.250 23.675 72 2HB PHE 10 2HB PHE 10 -5.448 -31.683 24.388 73 HD1 PHE 10 HD1 PHE 10 -7.152 -30.169 24.724 74 HD2 PHE 10 HD2 PHE 10 -7.655 -33.245 21.827 75 HE1 PHE 10 HE1 PHE 10 -9.485 -29.465 24.388 76 HE2 PHE 10 HE2 PHE 10 -9.990 -32.547 21.485 77 HZ PHE 10 HZ PHE 10 -10.907 -30.653 22.767 78 H ARG 11 H ARG 11 -3.065 -31.455 24.014 79 HA ARG 11 HA ARG 11 -3.103 -28.665 24.214 80 1HB ARG 11 1HB ARG 11 -1.178 -30.811 24.959 81 2HB ARG 11 2HB ARG 11 -0.589 -29.154 24.949 82 1HG ARG 11 1HG ARG 11 -3.147 -29.590 26.338 83 2HG ARG 11 2HG ARG 11 -1.727 -30.332 27.078 84 1HD ARG 11 1HD ARG 11 -0.596 -28.191 27.127 85 2HD ARG 11 2HD ARG 11 -1.948 -27.429 26.289 86 HE ARG 11 HE ARG 11 -3.039 -27.281 28.287 87 1HH1 ARG 11 1HH1 ARG 11 -0.505 -29.662 28.587 88 2HH1 ARG 11 2HH1 ARG 11 -0.738 -29.877 30.290 89 1HH2 ARG 11 1HH2 ARG 11 -3.346 -27.563 30.526 90 2HH2 ARG 11 2HH2 ARG 11 -2.351 -28.687 31.391 91 H GLU 12 H GLU 12 -1.507 -30.787 21.949 92 HA GLU 12 HA GLU 12 0.274 -28.808 20.902 93 1HB GLU 12 1HB GLU 12 -0.148 -31.603 20.582 94 2HB GLU 12 2HB GLU 12 -0.227 -30.868 18.987 95 1HG GLU 12 1HG GLU 12 2.001 -30.009 20.719 96 2HG GLU 12 2HG GLU 12 2.048 -31.672 20.134 97 HE2 GLU 12 HE2 GLU 12 2.447 -30.590 16.814 98 H ASN 13 H ASN 13 -2.820 -30.185 19.843 99 HA ASN 13 HA ASN 13 -3.029 -28.765 17.431 100 1HB ASN 13 1HB ASN 13 -4.917 -30.222 19.209 101 2HB ASN 13 2HB ASN 13 -5.613 -29.116 18.030 102 1HD2 ASN 13 1HD2 ASN 13 -3.288 -31.766 18.315 103 2HD2 ASN 13 2HD2 ASN 13 -3.627 -32.461 16.771 104 H ILE 14 H ILE 14 -4.078 -27.970 20.712 105 HA ILE 14 HA ILE 14 -5.390 -25.545 19.968 106 HB ILE 14 HB ILE 14 -4.353 -26.292 22.701 107 1HG1 ILE 14 1HG1 ILE 14 -7.168 -26.754 21.756 108 2HG1 ILE 14 2HG1 ILE 14 -5.922 -27.965 21.470 109 1HG2 ILE 14 1HG2 ILE 14 -5.007 -24.158 23.040 110 2HG2 ILE 14 2HG2 ILE 14 -6.607 -24.894 23.127 111 3HG2 ILE 14 3HG2 ILE 14 -6.062 -24.143 21.627 112 1HD1 ILE 14 1HD1 ILE 14 -5.744 -27.226 24.181 113 2HD1 ILE 14 2HD1 ILE 14 -6.275 -28.762 23.496 114 3HD1 ILE 14 3HD1 ILE 14 -7.449 -27.485 23.818 115 H ALA 15 H ALA 15 -2.133 -26.412 20.876 116 HA ALA 15 HA ALA 15 -1.213 -23.802 21.498 117 1HB ALA 15 1HB ALA 15 1.059 -24.819 21.109 118 2HB ALA 15 2HB ALA 15 0.229 -26.316 20.689 119 3HB ALA 15 3HB ALA 15 0.054 -25.634 22.305 120 H GLN 16 H GLN 16 -0.769 -25.807 18.579 121 HA GLN 16 HA GLN 16 0.521 -23.857 17.043 122 1HB GLN 16 1HB GLN 16 -0.965 -26.372 16.442 123 2HB GLN 16 2HB GLN 16 -0.603 -25.286 15.107 124 1HG GLN 16 1HG GLN 16 1.792 -25.470 16.466 125 2HG GLN 16 2HG GLN 16 1.131 -27.102 16.552 126 1HE2 GLN 16 1HE2 GLN 16 0.842 -28.277 14.666 127 2HE2 GLN 16 2HE2 GLN 16 1.567 -27.815 13.167 128 H THR 17 H THR 17 -2.869 -24.423 17.678 129 HA THR 17 HA THR 17 -3.863 -22.752 15.593 130 HB THR 17 HB THR 17 -5.998 -22.841 16.953 131 HG1 THR 17 HG1 THR 17 -5.002 -23.154 18.990 132 1HG2 THR 17 1HG2 THR 17 -6.292 -24.546 15.559 133 2HG2 THR 17 2HG2 THR 17 -5.821 -25.570 16.917 134 3HG2 THR 17 3HG2 THR 17 -4.620 -25.084 15.720 135 H TRP 18 H TRP 18 -2.806 -22.224 18.874 136 HA TRP 18 HA TRP 18 -3.965 -19.618 19.133 137 1HB TRP 18 1HB TRP 18 -2.270 -21.391 20.756 138 2HB TRP 18 2HB TRP 18 -1.937 -19.676 20.976 139 HD1 TRP 18 HD1 TRP 18 -4.038 -22.298 22.353 140 HE1 TRP 18 HE1 TRP 18 -6.037 -21.323 23.649 141 HE3 TRP 18 HE3 TRP 18 -3.833 -17.478 20.660 142 HZ2 TRP 18 HZ2 TRP 18 -7.351 -18.839 23.919 143 HZ3 TRP 18 HZ3 TRP 18 -5.497 -15.866 21.486 144 HH2 TRP 18 HH2 TRP 18 -7.220 -16.533 23.081 145 H GLN 19 H GLN 19 -0.722 -20.852 18.394 146 HA GLN 19 HA GLN 19 0.443 -18.259 18.133 147 1HB GLN 19 1HB GLN 19 2.360 -19.496 17.135 148 2HB GLN 19 2HB GLN 19 1.862 -20.113 18.704 149 1HG GLN 19 1HG GLN 19 0.780 -21.987 17.707 150 2HG GLN 19 2HG GLN 19 0.999 -21.320 16.089 151 1HE2 GLN 19 1HE2 GLN 19 2.814 -22.398 18.928 152 2HE2 GLN 19 2HE2 GLN 19 4.158 -23.034 18.048 153 H GLN 20 H GLN 20 -1.432 -20.252 16.060 154 HA GLN 20 HA GLN 20 -0.513 -19.577 13.535 155 1HB GLN 20 1HB GLN 20 -2.810 -20.825 14.639 156 2HB GLN 20 2HB GLN 20 -3.376 -19.615 13.495 157 1HG GLN 20 1HG GLN 20 -1.444 -20.747 12.026 158 2HG GLN 20 2HG GLN 20 -1.895 -22.120 13.034 159 1HE2 GLN 20 1HE2 GLN 20 -4.180 -22.700 13.079 160 2HE2 GLN 20 2HE2 GLN 20 -5.129 -22.466 11.656 161 HA PRO 21 HA PRO 21 -3.401 -15.721 13.441 162 1HB PRO 21 1HB PRO 21 -4.615 -14.964 15.749 163 2HB PRO 21 2HB PRO 21 -5.345 -16.097 14.607 164 1HG PRO 21 1HG PRO 21 -3.865 -16.658 17.148 165 2HG PRO 21 2HG PRO 21 -5.357 -17.396 16.537 166 1HD PRO 21 1HD PRO 21 -2.946 -18.603 16.320 167 2HD PRO 21 2HD PRO 21 -4.225 -18.806 15.106 168 H GLU 22 H GLU 22 -3.541 -13.497 14.924 169 HA GLU 22 HA GLU 22 -2.338 -11.764 15.769 170 1HB GLU 22 1HB GLU 22 -1.277 -14.116 17.232 171 2HB GLU 22 2HB GLU 22 -0.303 -12.652 17.290 172 1HG GLU 22 1HG GLU 22 -1.764 -11.573 18.610 173 2HG GLU 22 2HG GLU 22 -3.169 -12.274 17.811 174 HE2 GLU 22 HE2 GLU 22 -2.543 -15.227 19.914 175 H HIS 23 H HIS 23 -1.261 -10.667 14.268 176 HA HIS 23 HA HIS 23 1.443 -11.529 13.575 177 1HB HIS 23 1HB HIS 23 -0.595 -10.749 11.479 178 2HB HIS 23 2HB HIS 23 1.086 -11.186 11.191 179 HD1 HIS 23 HD1 HIS 23 1.658 -13.662 11.095 180 HD2 HIS 23 HD2 HIS 23 -2.293 -12.927 12.149 181 HE1 HIS 23 HE1 HIS 23 0.506 -15.896 10.988 182 HE2 HIS 23 HE2 HIS 23 -1.902 -15.412 11.547 183 H TYR 24 H TYR 24 2.858 -9.879 13.397 184 HA TYR 24 HA TYR 24 1.856 -7.204 13.950 185 1HB TYR 24 1HB TYR 24 4.351 -8.654 14.398 186 2HB TYR 24 2HB TYR 24 4.617 -7.027 13.781 187 HD1 TYR 24 HD1 TYR 24 4.772 -5.303 15.306 188 HD2 TYR 24 HD2 TYR 24 2.578 -8.789 16.372 189 HE1 TYR 24 HE1 TYR 24 4.424 -4.386 17.561 190 HE2 TYR 24 HE2 TYR 24 2.222 -7.881 18.630 191 HH TYR 24 HH TYR 24 3.951 -5.332 19.881 192 H ASP 25 H ASP 25 1.915 -5.519 12.565 193 HA ASP 25 HA ASP 25 3.186 -5.946 9.943 194 1HB ASP 25 1HB ASP 25 0.403 -5.142 10.605 195 2HB ASP 25 2HB ASP 25 1.171 -4.309 9.257 196 HD2 ASP 25 HD2 ASP 25 1.271 -7.266 7.364 197 H LEU 26 H LEU 26 4.684 -4.481 9.515 198 HA LEU 26 HA LEU 26 4.456 -1.824 10.771 199 1HB LEU 26 1HB LEU 26 6.962 -3.353 10.061 200 2HB LEU 26 2HB LEU 26 6.921 -1.727 10.716 201 HG LEU 26 HG LEU 26 5.586 -2.894 12.671 202 1HD1 LEU 26 1HD1 LEU 26 6.392 -5.151 13.106 203 2HD1 LEU 26 2HD1 LEU 26 7.247 -5.153 11.564 204 3HD1 LEU 26 3HD1 LEU 26 5.485 -5.083 11.595 205 1HD2 LEU 26 1HD2 LEU 26 8.568 -3.237 12.417 206 2HD2 LEU 26 2HD2 LEU 26 7.631 -3.063 13.901 207 3HD2 LEU 26 3HD2 LEU 26 7.775 -1.705 12.785 208 H TYR 27 H TYR 27 4.407 -0.115 9.454 209 HA TYR 27 HA TYR 27 5.259 -0.485 6.658 210 1HB TYR 27 1HB TYR 27 2.793 0.871 7.737 211 2HB TYR 27 2HB TYR 27 3.418 1.222 6.129 212 HD1 TYR 27 HD1 TYR 27 2.670 -0.040 4.337 213 HD2 TYR 27 HD2 TYR 27 2.396 -1.671 8.256 214 HE1 TYR 27 HE1 TYR 27 1.459 -1.983 3.438 215 HE2 TYR 27 HE2 TYR 27 1.185 -3.618 7.368 216 HH TYR 27 HH TYR 27 1.080 -4.401 4.136 217 H ILE 28 H ILE 28 7.003 0.712 6.311 218 HA ILE 28 HA ILE 28 7.005 3.495 7.225 219 HB ILE 28 HB ILE 28 9.460 3.262 7.772 220 1HG1 ILE 28 1HG1 ILE 28 8.890 0.336 8.149 221 2HG1 ILE 28 2HG1 ILE 28 9.489 0.932 6.604 222 1HG2 ILE 28 1HG2 ILE 28 9.054 2.613 10.023 223 2HG2 ILE 28 2HG2 ILE 28 7.654 1.647 9.558 224 3HG2 ILE 28 3HG2 ILE 28 7.590 3.405 9.440 225 1HD1 ILE 28 1HD1 ILE 28 11.321 0.134 7.932 226 2HD1 ILE 28 2HD1 ILE 28 10.850 1.176 9.275 227 3HD1 ILE 28 3HD1 ILE 28 11.438 1.886 7.772 228 HA PRO 29 HA PRO 29 8.162 4.359 3.036 229 1HB PRO 29 1HB PRO 29 9.824 6.508 4.259 230 2HB PRO 29 2HB PRO 29 8.609 6.614 2.978 231 1HG PRO 29 1HG PRO 29 8.060 7.459 5.441 232 2HG PRO 29 2HG PRO 29 6.838 6.610 4.476 233 1HD PRO 29 1HD PRO 29 8.490 5.608 6.752 234 2HD PRO 29 2HD PRO 29 6.807 5.237 6.328 235 H ALA 30 H ALA 30 10.040 4.438 1.648 236 HA ALA 30 HA ALA 30 12.235 2.852 2.720 237 1HB ALA 30 1HB ALA 30 12.866 3.087 0.130 238 2HB ALA 30 2HB ALA 30 11.132 3.393 0.032 239 3HB ALA 30 3HB ALA 30 11.723 1.888 0.736 240 H ILE 31 H ILE 31 11.594 6.055 1.483 241 HA ILE 31 HA ILE 31 14.444 6.737 1.744 242 HB ILE 31 HB ILE 31 12.281 8.360 0.399 243 1HG1 ILE 31 1HG1 ILE 31 14.371 7.116 -1.259 244 2HG1 ILE 31 2HG1 ILE 31 13.258 5.971 -0.518 245 1HG2 ILE 31 1HG2 ILE 31 13.842 9.912 -0.093 246 2HG2 ILE 31 2HG2 ILE 31 15.127 8.718 -0.279 247 3HG2 ILE 31 3HG2 ILE 31 14.645 9.249 1.331 248 1HD1 ILE 31 1HD1 ILE 31 11.976 6.362 -2.293 249 2HD1 ILE 31 2HD1 ILE 31 12.841 7.842 -2.708 250 3HD1 ILE 31 3HD1 ILE 31 11.564 7.878 -1.492 251 H THR 32 H THR 32 15.116 8.079 3.302 252 HA THR 32 HA THR 32 13.162 9.765 4.688 253 HB THR 32 HB THR 32 14.591 9.019 6.820 254 HG1 THR 32 HG1 THR 32 15.803 7.400 6.250 255 1HG2 THR 32 1HG2 THR 32 12.615 6.954 6.210 256 2HG2 THR 32 2HG2 THR 32 12.025 8.608 6.047 257 3HG2 THR 32 3HG2 THR 32 12.721 8.067 7.575 258 H TRP 33 H TRP 33 16.584 8.872 5.139 259 HA TRP 33 HA TRP 33 17.578 11.347 4.159 260 1HB TRP 33 1HB TRP 33 16.529 11.909 6.456 261 2HB TRP 33 2HB TRP 33 17.905 11.045 7.135 262 HD1 TRP 33 HD1 TRP 33 19.629 12.745 7.937 263 HE1 TRP 33 HE1 TRP 33 20.605 14.954 7.047 264 HE3 TRP 33 HE3 TRP 33 16.816 13.224 3.695 265 HZ2 TRP 33 HZ2 TRP 33 20.232 16.673 4.839 266 HZ3 TRP 33 HZ3 TRP 33 17.187 15.180 2.249 267 HH2 TRP 33 HH2 TRP 33 18.859 16.868 2.811 268 H HIS 34 H HIS 34 19.787 11.310 3.886 269 HA HIS 34 HA HIS 34 21.083 8.767 4.574 270 1HB HIS 34 1HB HIS 34 21.267 10.630 2.286 271 2HB HIS 34 2HB HIS 34 22.791 9.925 2.813 272 HD1 HIS 34 HD1 HIS 34 23.227 8.202 1.067 273 HD2 HIS 34 HD2 HIS 34 19.338 8.019 2.522 274 HE1 HIS 34 HE1 HIS 34 22.216 6.147 0.027 275 HE2 HIS 34 HE2 HIS 34 19.892 6.010 0.990 276 H ALA 35 H ALA 35 22.240 8.873 6.381 277 HA ALA 35 HA ALA 35 23.876 11.282 6.852 278 1HB ALA 35 1HB ALA 35 22.511 11.409 8.662 279 2HB ALA 35 2HB ALA 35 23.711 10.296 9.321 280 3HB ALA 35 3HB ALA 35 22.188 9.675 8.682 281 H ARG 36 H ARG 36 23.691 7.766 7.235 282 HA ARG 36 HA ARG 36 25.290 6.153 7.335 283 1HB ARG 36 1HB ARG 36 26.005 7.510 5.245 284 2HB ARG 36 2HB ARG 36 27.291 8.127 6.273 285 1HG ARG 36 1HG ARG 36 28.338 6.079 6.426 286 2HG ARG 36 2HG ARG 36 26.868 5.182 6.042 287 1HD ARG 36 1HD ARG 36 27.000 6.203 3.735 288 2HD ARG 36 2HD ARG 36 28.612 6.771 4.173 289 HE ARG 36 HE ARG 36 29.400 4.634 3.930 290 1HH1 ARG 36 1HH1 ARG 36 25.912 4.554 4.037 291 2HH1 ARG 36 2HH1 ARG 36 25.813 2.882 3.599 292 1HH2 ARG 36 1HH2 ARG 36 29.270 2.434 3.353 293 2HH2 ARG 36 2HH2 ARG 36 27.718 1.678 3.210 294 H PHE 37 H PHE 37 24.878 7.846 9.620 295 HA PHE 37 HA PHE 37 27.542 7.639 10.863 296 1HB PHE 37 1HB PHE 37 25.409 9.709 11.432 297 2HB PHE 37 2HB PHE 37 26.923 9.544 12.314 298 HD1 PHE 37 HD1 PHE 37 29.036 9.412 10.591 299 HD2 PHE 37 HD2 PHE 37 25.345 11.421 9.923 300 HE1 PHE 37 HE1 PHE 37 30.143 10.898 8.973 301 HE2 PHE 37 HE2 PHE 37 26.444 12.911 8.303 302 HZ PHE 37 HZ PHE 37 28.846 12.650 7.826 303 H ALA 38 H ALA 38 25.429 5.649 10.734 304 HA ALA 38 HA ALA 38 24.016 5.571 13.201 305 1HB ALA 38 1HB ALA 38 23.155 3.559 12.491 306 2HB ALA 38 2HB ALA 38 24.643 3.089 11.670 307 3HB ALA 38 3HB ALA 38 23.589 4.306 10.953 308 H TYR 39 H TYR 39 24.841 5.218 15.145 309 HA TYR 39 HA TYR 39 27.503 4.166 15.469 310 1HB TYR 39 1HB TYR 39 25.432 5.329 17.283 311 2HB TYR 39 2HB TYR 39 26.735 4.377 17.986 312 HD1 TYR 39 HD1 TYR 39 28.865 5.319 18.318 313 HD2 TYR 39 HD2 TYR 39 26.039 7.344 15.866 314 HE1 TYR 39 HE1 TYR 39 30.340 7.285 18.252 315 HE2 TYR 39 HE2 TYR 39 27.506 9.315 15.792 316 HH TYR 39 HH TYR 39 30.235 9.653 17.842 317 H ASP 40 H ASP 40 28.062 2.129 15.895 318 HA ASP 40 HA ASP 40 26.097 0.063 15.914 319 1HB ASP 40 1HB ASP 40 28.687 0.130 15.177 320 2HB ASP 40 2HB ASP 40 28.863 -0.564 16.786 321 HD2 ASP 40 HD2 ASP 40 26.526 -3.143 15.433 322 H LYS 41 H LYS 41 24.787 0.112 17.679 323 HA LYS 41 HA LYS 41 25.922 -0.805 20.169 324 1HB LYS 41 1HB LYS 41 25.036 1.977 19.790 325 2HB LYS 41 2HB LYS 41 24.360 1.181 21.204 326 1HG LYS 41 1HG LYS 41 26.385 0.996 22.246 327 2HG LYS 41 2HG LYS 41 27.288 0.978 20.728 328 1HD LYS 41 1HD LYS 41 25.796 3.442 21.514 329 2HD LYS 41 2HD LYS 41 27.341 3.084 22.288 330 1HE LYS 41 1HE LYS 41 27.147 2.938 19.319 331 2HE LYS 41 2HE LYS 41 27.221 4.522 20.088 332 1HZ LYS 41 1HZ LYS 41 29.410 3.573 19.429 333 2HZ LYS 41 2HZ LYS 41 29.194 2.367 20.596 334 3HZ LYS 41 3HZ LYS 41 29.299 3.988 21.066 335 H GLU 42 H GLU 42 22.905 0.784 19.115 336 HA GLU 42 HA GLU 42 20.732 0.116 19.177 337 1HB GLU 42 1HB GLU 42 22.031 -2.603 18.973 338 2HB GLU 42 2HB GLU 42 20.298 -2.334 18.850 339 1HG GLU 42 1HG GLU 42 21.277 -0.565 17.019 340 2HG GLU 42 2HG GLU 42 22.413 -1.906 16.886 341 HE2 GLU 42 HE2 GLU 42 20.069 -3.923 15.366 342 H LYS 43 H LYS 43 19.850 0.647 21.080 343 HA LYS 43 HA LYS 43 19.718 -1.385 23.148 344 1HB LYS 43 1HB LYS 43 21.676 0.462 23.429 345 2HB LYS 43 2HB LYS 43 20.345 1.303 24.212 346 1HG LYS 43 1HG LYS 43 20.102 -1.102 25.375 347 2HG LYS 43 2HG LYS 43 21.838 -1.092 25.058 348 1HD LYS 43 1HD LYS 43 20.677 1.368 26.225 349 2HD LYS 43 2HD LYS 43 20.753 -0.050 27.272 350 1HE LYS 43 1HE LYS 43 22.822 0.750 27.709 351 2HE LYS 43 2HE LYS 43 23.223 -0.131 26.234 352 1HZ LYS 43 1HZ LYS 43 23.087 2.732 26.706 353 2HZ LYS 43 2HZ LYS 43 22.473 2.208 25.220 354 3HZ LYS 43 3HZ LYS 43 24.072 1.854 25.647 355 H THR 44 H THR 44 18.200 -0.679 24.934 356 HA THR 44 HA THR 44 16.122 1.125 23.882 357 HB THR 44 HB THR 44 15.658 -1.489 25.333 358 HG1 THR 44 HG1 THR 44 15.388 -0.751 22.616 359 1HG2 THR 44 1HG2 THR 44 13.715 -0.502 25.862 360 2HG2 THR 44 2HG2 THR 44 13.301 -0.898 24.194 361 3HG2 THR 44 3HG2 THR 44 13.868 0.722 24.601 362 H ASP 45 H ASP 45 15.099 2.440 25.345 363 HA ASP 45 HA ASP 45 16.241 2.451 28.057 364 1HB ASP 45 1HB ASP 45 14.937 4.744 26.576 365 2HB ASP 45 2HB ASP 45 15.758 4.830 28.131 366 HD2 ASP 45 HD2 ASP 45 18.881 4.283 26.413 367 H ARG 46 H ARG 46 14.568 3.875 29.507 368 HA ARG 46 HA ARG 46 12.365 2.125 29.929 369 1HB ARG 46 1HB ARG 46 11.767 3.624 31.755 370 2HB ARG 46 2HB ARG 46 13.495 3.298 31.772 371 1HG ARG 46 1HG ARG 46 13.755 5.488 30.498 372 2HG ARG 46 2HG ARG 46 12.078 5.807 30.944 373 1HD ARG 46 1HD ARG 46 13.099 5.076 33.337 374 2HD ARG 46 2HD ARG 46 14.518 5.814 32.596 375 HE ARG 46 HE ARG 46 13.538 7.852 32.877 376 1HH1 ARG 46 1HH1 ARG 46 11.051 5.410 33.033 377 2HH1 ARG 46 2HH1 ARG 46 9.803 6.529 33.466 378 1HH2 ARG 46 1HH2 ARG 46 11.898 9.327 33.447 379 2HH2 ARG 46 2HH2 ARG 46 10.284 8.753 33.701 380 H TYR 47 H TYR 47 12.752 5.263 28.411 381 HA TYR 47 HA TYR 47 9.904 5.651 28.095 382 1HB TYR 47 1HB TYR 47 10.524 7.701 26.911 383 2HB TYR 47 2HB TYR 47 11.387 7.582 28.441 384 HD1 TYR 47 HD1 TYR 47 13.793 7.180 28.485 385 HD2 TYR 47 HD2 TYR 47 11.699 7.545 24.799 386 HE1 TYR 47 HE1 TYR 47 15.931 7.479 27.307 387 HE2 TYR 47 HE2 TYR 47 13.830 7.844 23.610 388 HH TYR 47 HH TYR 47 16.847 7.216 25.058 389 H ASN 48 H ASN 48 8.737 4.798 26.516 390 HA ASN 48 HA ASN 48 9.811 3.207 24.468 391 1HB ASN 48 1HB ASN 48 7.340 3.493 25.513 392 2HB ASN 48 2HB ASN 48 7.134 4.399 24.017 393 1HD2 ASN 48 1HD2 ASN 48 7.426 3.326 22.030 394 2HD2 ASN 48 2HD2 ASN 48 7.286 1.607 21.915 395 H GLU 49 H GLU 49 9.741 3.531 22.167 396 HA GLU 49 HA GLU 49 10.690 6.136 21.416 397 1HB GLU 49 1HB GLU 49 10.496 3.467 20.139 398 2HB GLU 49 2HB GLU 49 10.500 4.853 19.056 399 1HG GLU 49 1HG GLU 49 12.739 4.097 19.290 400 2HG GLU 49 2HG GLU 49 12.593 5.624 20.159 401 HE2 GLU 49 HE2 GLU 49 12.702 3.771 23.252 402 H ARG 50 H ARG 50 9.659 7.704 20.310 403 HA ARG 50 HA ARG 50 6.808 7.275 19.745 404 1HB ARG 50 1HB ARG 50 8.398 9.791 20.252 405 2HB ARG 50 2HB ARG 50 6.723 9.799 19.717 406 1HG ARG 50 1HG ARG 50 7.380 8.203 22.125 407 2HG ARG 50 2HG ARG 50 7.400 9.962 22.272 408 1HD ARG 50 1HD ARG 50 5.082 9.580 20.918 409 2HD ARG 50 2HD ARG 50 5.142 8.115 21.897 410 HE ARG 50 HE ARG 50 4.670 9.382 23.733 411 1HH1 ARG 50 1HH1 ARG 50 5.855 11.488 21.215 412 2HH1 ARG 50 2HH1 ARG 50 5.537 12.939 22.106 413 1HH2 ARG 50 1HH2 ARG 50 4.251 11.290 24.905 414 2HH2 ARG 50 2HH2 ARG 50 4.626 12.827 24.201 415 HA PRO 51 HA PRO 51 8.557 7.363 15.501 416 1HB PRO 51 1HB PRO 51 6.520 5.940 14.394 417 2HB PRO 51 2HB PRO 51 7.906 5.184 15.188 418 1HG PRO 51 1HG PRO 51 5.162 5.710 16.262 419 2HG PRO 51 2HG PRO 51 6.172 4.262 16.434 420 1HD PRO 51 1HD PRO 51 5.942 6.106 18.395 421 2HD PRO 51 2HD PRO 51 7.442 5.196 18.120 422 H TRP 52 H TRP 52 8.167 8.910 14.037 423 HA TRP 52 HA TRP 52 5.492 10.144 13.993 424 1HB TRP 52 1HB TRP 52 6.924 12.229 13.218 425 2HB TRP 52 2HB TRP 52 6.690 11.873 14.925 426 HD1 TRP 52 HD1 TRP 52 8.826 11.716 16.338 427 HE1 TRP 52 HE1 TRP 52 11.346 11.529 15.843 428 HE3 TRP 52 HE3 TRP 52 8.617 11.113 11.264 429 HZ2 TRP 52 HZ2 TRP 52 13.021 11.171 13.600 430 HZ3 TRP 52 HZ3 TRP 52 10.723 10.856 10.019 431 HH2 TRP 52 HH2 TRP 52 12.878 10.885 11.164 432 H GLY 53 H GLY 53 6.701 8.010 12.313 433 1HA GLY 53 1HA GLY 53 5.816 9.017 9.784 434 2HA GLY 53 2HA GLY 53 7.560 8.808 9.830 435 H GLY 54 H GLY 54 4.780 6.924 11.037 436 1HA GLY 54 1HA GLY 54 5.107 4.810 9.187 437 2HA GLY 54 2HA GLY 54 5.948 4.416 10.680 438 H GLY 55 H GLY 55 4.079 2.694 10.109 439 1HA GLY 55 1HA GLY 55 1.919 3.363 11.991 440 2HA GLY 55 2HA GLY 55 1.509 2.713 10.410 441 H PHE 56 H PHE 56 0.754 1.482 12.802 442 HA PHE 56 HA PHE 56 2.045 -1.098 12.444 443 1HB PHE 56 1HB PHE 56 1.758 0.032 15.227 444 2HB PHE 56 2HB PHE 56 2.589 -1.442 14.739 445 HD1 PHE 56 HD1 PHE 56 4.704 -1.257 13.404 446 HD2 PHE 56 HD2 PHE 56 2.867 2.098 15.272 447 HE1 PHE 56 HE1 PHE 56 6.818 -0.009 13.234 448 HE2 PHE 56 HE2 PHE 56 4.978 3.352 15.104 449 HZ PHE 56 HZ PHE 56 6.956 2.298 14.085 450 H GLY 57 H GLY 57 0.691 -2.806 12.783 451 1HA GLY 57 1HA GLY 57 -1.643 -2.728 14.375 452 2HA GLY 57 2HA GLY 57 -2.070 -2.411 12.700 453 H LEU 58 H LEU 58 -3.336 -4.415 13.012 454 HA LEU 58 HA LEU 58 -1.664 -6.824 12.732 455 1HB LEU 58 1HB LEU 58 -3.896 -7.996 13.275 456 2HB LEU 58 2HB LEU 58 -3.008 -7.226 14.575 457 HG LEU 58 HG LEU 58 -4.506 -5.268 14.424 458 1HD1 LEU 58 1HD1 LEU 58 -5.157 -5.360 12.121 459 2HD1 LEU 58 2HD1 LEU 58 -6.604 -5.518 13.117 460 3HD1 LEU 58 3HD1 LEU 58 -5.905 -6.942 12.346 461 1HD2 LEU 58 1HD2 LEU 58 -5.283 -6.585 16.102 462 2HD2 LEU 58 2HD2 LEU 58 -5.443 -8.004 15.066 463 3HD2 LEU 58 3HD2 LEU 58 -6.660 -6.728 15.007 464 H SER 59 H SER 59 -3.038 -8.602 11.489 465 HA SER 59 HA SER 59 -4.544 -7.538 9.261 466 1HB SER 59 1HB SER 59 -1.742 -8.567 8.968 467 2HB SER 59 2HB SER 59 -2.905 -8.816 7.666 468 HG SER 59 HG SER 59 -2.506 -6.842 7.110 469 H ARG 60 H ARG 60 -5.112 -9.383 7.700 470 HA ARG 60 HA ARG 60 -5.148 -12.008 8.955 471 1HB ARG 60 1HB ARG 60 -7.369 -10.222 9.106 472 2HB ARG 60 2HB ARG 60 -7.806 -11.547 8.037 473 1HG ARG 60 1HG ARG 60 -6.668 -11.929 10.795 474 2HG ARG 60 2HG ARG 60 -8.395 -11.893 10.433 475 1HD ARG 60 1HD ARG 60 -8.069 -13.782 8.874 476 2HD ARG 60 2HD ARG 60 -6.370 -13.844 9.340 477 HE ARG 60 HE ARG 60 -6.977 -14.925 11.259 478 1HH1 ARG 60 1HH1 ARG 60 -9.808 -13.416 9.887 479 2HH1 ARG 60 2HH1 ARG 60 -10.900 -14.156 11.009 480 1HH2 ARG 60 1HH2 ARG 60 -8.411 -15.899 12.736 481 2HH2 ARG 60 2HH2 ARG 60 -10.107 -15.565 12.627 482 H TRP 61 H TRP 61 -5.199 -13.656 7.507 483 HA TRP 61 HA TRP 61 -5.261 -12.894 4.672 484 1HB TRP 61 1HB TRP 61 -3.230 -14.062 5.745 485 2HB TRP 61 2HB TRP 61 -4.231 -15.511 5.747 486 HD1 TRP 61 HD1 TRP 61 -3.967 -12.904 2.897 487 HE1 TRP 61 HE1 TRP 61 -3.167 -14.123 0.776 488 HE3 TRP 61 HE3 TRP 61 -3.176 -17.550 4.880 489 HZ2 TRP 61 HZ2 TRP 61 -2.314 -16.712 0.041 490 HZ3 TRP 61 HZ3 TRP 61 -2.368 -19.342 3.400 491 HH2 TRP 61 HH2 TRP 61 -1.947 -18.929 1.030 492 H ASP 62 H ASP 62 -6.694 -13.765 3.273 493 HA ASP 62 HA ASP 62 -8.718 -15.567 4.409 494 1HB ASP 62 1HB ASP 62 -9.128 -13.184 3.209 495 2HB ASP 62 2HB ASP 62 -9.223 -14.244 1.806 496 HD2 ASP 62 HD2 ASP 62 -12.029 -15.897 3.342 497 H GLU 63 H GLU 63 -8.677 -17.617 3.806 498 HA GLU 63 HA GLU 63 -6.890 -18.711 1.978 499 1HB GLU 63 1HB GLU 63 -9.472 -19.768 3.119 500 2HB GLU 63 2HB GLU 63 -8.444 -20.732 2.067 501 1HG GLU 63 1HG GLU 63 -7.593 -21.417 4.033 502 2HG GLU 63 2HG GLU 63 -6.615 -19.961 3.851 503 HE2 GLU 63 HE2 GLU 63 -7.914 -18.656 6.728 504 H LYS 64 H LYS 64 -9.958 -17.225 1.442 505 HA LYS 64 HA LYS 64 -10.550 -18.448 -1.057 506 1HB LYS 64 1HB LYS 64 -11.891 -16.778 0.688 507 2HB LYS 64 2HB LYS 64 -11.598 -15.742 -0.702 508 1HG LYS 64 1HG LYS 64 -13.522 -16.625 -1.439 509 2HG LYS 64 2HG LYS 64 -12.489 -17.966 -1.938 510 1HD LYS 64 1HD LYS 64 -12.971 -19.115 0.172 511 2HD LYS 64 2HD LYS 64 -14.010 -17.776 0.662 512 1HE LYS 64 1HE LYS 64 -15.065 -18.373 -1.755 513 2HE LYS 64 2HE LYS 64 -14.504 -19.965 -1.245 514 1HZ LYS 64 1HZ LYS 64 -15.750 -19.665 0.829 515 2HZ LYS 64 2HZ LYS 64 -16.759 -19.617 -0.527 516 3HZ LYS 64 3HZ LYS 64 -16.338 -18.183 0.264 517 H GLY 65 H GLY 65 -8.508 -15.821 -0.073 518 1HA GLY 65 1HA GLY 65 -6.704 -15.361 -1.734 519 2HA GLY 65 2HA GLY 65 -7.992 -15.207 -2.918 520 H ASN 66 H ASN 66 -7.849 -13.954 0.395 521 HA ASN 66 HA ASN 66 -7.798 -11.228 -0.701 522 1HB ASN 66 1HB ASN 66 -9.552 -12.055 1.615 523 2HB ASN 66 2HB ASN 66 -9.534 -10.503 0.784 524 1HD2 ASN 66 1HD2 ASN 66 -11.248 -13.222 1.135 525 2HD2 ASN 66 2HD2 ASN 66 -12.050 -13.286 -0.395 526 H TRP 67 H TRP 67 -7.014 -9.605 0.763 527 HA TRP 67 HA TRP 67 -5.626 -10.594 3.144 528 1HB TRP 67 1HB TRP 67 -4.069 -10.581 1.134 529 2HB TRP 67 2HB TRP 67 -4.232 -8.827 1.131 530 HD1 TRP 67 HD1 TRP 67 -3.869 -8.023 4.058 531 HE1 TRP 67 HE1 TRP 67 -1.677 -8.461 5.333 532 HE3 TRP 67 HE3 TRP 67 -1.983 -11.790 1.162 533 HZ2 TRP 67 HZ2 TRP 67 0.557 -10.176 5.136 534 HZ3 TRP 67 HZ3 TRP 67 0.187 -12.775 1.773 535 HH2 TRP 67 HH2 TRP 67 1.430 -11.983 3.719 536 H HIS 68 H HIS 68 -6.765 -9.453 4.612 537 HA HIS 68 HA HIS 68 -7.193 -6.589 4.165 538 1HB HIS 68 1HB HIS 68 -8.413 -8.593 6.050 539 2HB HIS 68 2HB HIS 68 -8.596 -6.862 6.316 540 HD1 HIS 68 HD1 HIS 68 -10.964 -8.832 5.643 541 HD2 HIS 68 HD2 HIS 68 -9.019 -6.355 2.933 542 HE1 HIS 68 HE1 HIS 68 -12.596 -8.482 3.761 543 HE2 HIS 68 HE2 HIS 68 -11.429 -6.912 2.174 544 H GLY 69 H GLY 69 -6.264 -5.030 5.405 545 1HA GLY 69 1HA GLY 69 -4.696 -5.862 7.743 546 2HA GLY 69 2HA GLY 69 -3.882 -4.995 6.450 547 H LEU 70 H LEU 70 -5.082 -4.586 9.409 548 HA LEU 70 HA LEU 70 -5.877 -1.796 8.887 549 1HB LEU 70 1HB LEU 70 -7.778 -3.062 9.696 550 2HB LEU 70 2HB LEU 70 -6.841 -3.667 11.049 551 HG LEU 70 HG LEU 70 -6.615 -1.034 11.524 552 1HD1 LEU 70 1HD1 LEU 70 -7.894 -0.194 9.740 553 2HD1 LEU 70 2HD1 LEU 70 -8.945 -0.098 11.154 554 3HD1 LEU 70 3HD1 LEU 70 -9.164 -1.393 9.978 555 1HD2 LEU 70 1HD2 LEU 70 -8.899 -2.843 12.298 556 2HD2 LEU 70 2HD2 LEU 70 -8.530 -1.307 13.082 557 3HD2 LEU 70 3HD2 LEU 70 -7.369 -2.632 13.150 558 H TYR 71 H TYR 71 -4.661 -0.269 9.816 559 HA TYR 71 HA TYR 71 -3.287 -0.731 12.306 560 1HB TYR 71 1HB TYR 71 -1.032 -0.198 11.359 561 2HB TYR 71 2HB TYR 71 -1.668 -1.760 10.854 562 HD1 TYR 71 HD1 TYR 71 -0.094 1.161 9.747 563 HD2 TYR 71 HD2 TYR 71 -3.035 -1.680 8.573 564 HE1 TYR 71 HE1 TYR 71 0.245 1.792 7.395 565 HE2 TYR 71 HE2 TYR 71 -2.703 -1.057 6.217 566 HH TYR 71 HH TYR 71 -0.850 -0.031 4.827 567 H ALA 72 H ALA 72 -2.022 1.231 12.969 568 HA ALA 72 HA ALA 72 -3.392 3.640 11.980 569 1HB ALA 72 1HB ALA 72 -3.958 3.679 14.172 570 2HB ALA 72 2HB ALA 72 -2.388 4.468 14.317 571 3HB ALA 72 3HB ALA 72 -2.545 2.746 14.667 572 H MET 73 H MET 73 -2.164 4.725 10.588 573 HA MET 73 HA MET 73 0.741 4.783 10.968 574 1HB MET 73 1HB MET 73 -0.465 4.213 8.728 575 2HB MET 73 2HB MET 73 -0.685 5.952 8.599 576 1HG MET 73 1HG MET 73 1.487 6.333 8.151 577 2HG MET 73 2HG MET 73 2.045 5.049 9.221 578 1HE MET 73 1HE MET 73 2.865 5.565 5.501 579 2HE MET 73 2HE MET 73 3.775 4.158 6.051 580 3HE MET 73 3HE MET 73 3.588 5.555 7.110 581 H ALA 74 H ALA 74 1.756 6.963 10.266 582 HA ALA 74 HA ALA 74 0.243 9.332 10.760 583 1HB ALA 74 1HB ALA 74 0.340 8.725 13.047 584 2HB ALA 74 2HB ALA 74 1.544 9.993 12.815 585 3HB ALA 74 3HB ALA 74 2.049 8.307 12.936 586 H PHE 75 H PHE 75 1.257 11.105 9.984 587 HA PHE 75 HA PHE 75 4.113 10.868 9.315 588 1HB PHE 75 1HB PHE 75 1.850 11.232 7.526 589 2HB PHE 75 2HB PHE 75 3.014 12.543 7.371 590 HD1 PHE 75 HD1 PHE 75 5.567 11.577 7.435 591 HD2 PHE 75 HD2 PHE 75 2.114 9.519 6.042 592 HE1 PHE 75 HE1 PHE 75 6.992 10.147 6.029 593 HE2 PHE 75 HE2 PHE 75 3.532 8.084 4.634 594 HZ PHE 75 HZ PHE 75 5.974 8.396 4.627 595 H LYS 76 H LYS 76 5.070 12.261 10.658 596 HA LYS 76 HA LYS 76 3.975 14.991 10.825 597 1HB LYS 76 1HB LYS 76 5.341 13.436 13.028 598 2HB LYS 76 2HB LYS 76 4.826 15.114 13.136 599 1HG LYS 76 1HG LYS 76 2.482 14.217 12.595 600 2HG LYS 76 2HG LYS 76 3.149 12.637 13.014 601 1HD LYS 76 1HD LYS 76 3.634 13.329 15.228 602 2HD LYS 76 2HD LYS 76 3.351 15.026 14.835 603 1HE LYS 76 1HE LYS 76 1.162 13.006 14.530 604 2HE LYS 76 2HE LYS 76 1.530 13.692 16.113 605 1HZ LYS 76 1HZ LYS 76 1.397 15.902 14.656 606 2HZ LYS 76 2HZ LYS 76 0.053 15.231 15.433 607 3HZ LYS 76 3HZ LYS 76 0.311 14.939 13.787 608 H ASP 77 H ASP 77 5.338 16.572 10.263 609 HA ASP 77 HA ASP 77 8.113 15.855 9.688 610 1HB ASP 77 1HB ASP 77 6.302 17.279 8.227 611 2HB ASP 77 2HB ASP 77 7.190 18.576 9.024 612 HD2 ASP 77 HD2 ASP 77 8.881 16.702 6.059 613 H SER 78 H SER 78 9.387 18.258 9.858 614 HA SER 78 HA SER 78 9.651 18.554 12.732 615 1HB SER 78 1HB SER 78 11.609 20.030 12.069 616 2HB SER 78 2HB SER 78 11.719 18.345 11.564 617 HG SER 78 HG SER 78 12.030 20.341 10.017 618 H TRP 79 H TRP 79 8.436 20.347 10.006 619 HA TRP 79 HA TRP 79 6.992 22.148 11.626 620 1HB TRP 79 1HB TRP 79 9.688 22.896 11.208 621 2HB TRP 79 2HB TRP 79 8.713 23.949 10.186 622 HD1 TRP 79 HD1 TRP 79 10.069 23.838 13.543 623 HE1 TRP 79 HE1 TRP 79 8.813 25.430 15.128 624 HE3 TRP 79 HE3 TRP 79 5.930 24.737 10.680 625 HZ2 TRP 79 HZ2 TRP 79 6.389 26.875 15.160 626 HZ3 TRP 79 HZ3 TRP 79 4.189 26.236 11.562 627 HH2 TRP 79 HH2 TRP 79 4.415 27.282 13.756 628 H ASN 80 H ASN 80 6.544 20.413 9.419 629 HA ASN 80 HA ASN 80 5.904 22.280 7.243 630 1HB ASN 80 1HB ASN 80 7.184 19.886 7.091 631 2HB ASN 80 2HB ASN 80 5.521 19.383 6.802 632 1HD2 ASN 80 1HD2 ASN 80 5.757 18.889 4.675 633 2HD2 ASN 80 2HD2 ASN 80 6.087 20.063 3.451 634 H LYS 81 H LYS 81 3.925 20.621 6.038 635 HA LYS 81 HA LYS 81 1.700 21.133 7.881 636 1HB LYS 81 1HB LYS 81 1.515 20.614 4.915 637 2HB LYS 81 2HB LYS 81 0.282 21.299 5.964 638 1HG LYS 81 1HG LYS 81 2.535 22.961 6.204 639 2HG LYS 81 2HG LYS 81 2.340 22.621 4.484 640 1HD LYS 81 1HD LYS 81 0.877 24.333 4.564 641 2HD LYS 81 2HD LYS 81 -0.226 23.111 5.199 642 1HE LYS 81 1HE LYS 81 1.044 23.874 7.464 643 2HE LYS 81 2HE LYS 81 1.075 25.381 6.549 644 1HZ LYS 81 1HZ LYS 81 -1.192 25.550 6.574 645 2HZ LYS 81 2HZ LYS 81 -0.943 24.789 8.064 646 3HZ LYS 81 3HZ LYS 81 -1.443 23.883 6.727 647 H TRP 82 H TRP 82 3.432 18.745 7.943 648 HA TRP 82 HA TRP 82 2.101 16.519 6.840 649 1HB TRP 82 1HB TRP 82 4.334 17.009 8.636 650 2HB TRP 82 2HB TRP 82 3.405 15.597 9.122 651 HD1 TRP 82 HD1 TRP 82 5.167 13.797 8.381 652 HE1 TRP 82 HE1 TRP 82 6.044 13.015 6.091 653 HE3 TRP 82 HE3 TRP 82 3.302 17.561 5.466 654 HZ2 TRP 82 HZ2 TRP 82 5.957 13.879 3.405 655 HZ3 TRP 82 HZ3 TRP 82 3.744 17.509 3.046 656 HH2 TRP 82 HH2 TRP 82 5.045 15.705 2.039 657 H GLU 83 H GLU 83 0.917 14.847 7.991 658 HA GLU 83 HA GLU 83 -0.322 15.543 10.511 659 1HB GLU 83 1HB GLU 83 -2.641 15.214 9.505 660 2HB GLU 83 2HB GLU 83 -1.841 16.744 9.169 661 1HG GLU 83 1HG GLU 83 -2.703 16.173 7.115 662 2HG GLU 83 2HG GLU 83 -1.046 15.579 7.004 663 HE2 GLU 83 HE2 GLU 83 -2.284 12.501 6.196 664 HA PRO 84 HA PRO 84 -0.512 11.143 10.845 665 1HB PRO 84 1HB PRO 84 -2.401 10.805 12.718 666 2HB PRO 84 2HB PRO 84 -0.854 11.575 13.092 667 1HG PRO 84 1HG PRO 84 -3.517 12.833 12.564 668 2HG PRO 84 2HG PRO 84 -2.312 13.241 13.798 669 1HD PRO 84 1HD PRO 84 -2.608 14.604 11.436 670 2HD PRO 84 2HD PRO 84 -1.089 14.526 12.350 671 H ILE 85 H ILE 85 -1.690 9.287 10.261 672 HA ILE 85 HA ILE 85 -4.446 9.514 9.418 673 HB ILE 85 HB ILE 85 -4.029 8.738 7.114 674 1HG1 ILE 85 1HG1 ILE 85 -1.438 9.508 6.549 675 2HG1 ILE 85 2HG1 ILE 85 -1.271 8.688 8.099 676 1HG2 ILE 85 1HG2 ILE 85 -4.282 11.180 7.807 677 2HG2 ILE 85 2HG2 ILE 85 -3.605 10.859 6.211 678 3HG2 ILE 85 3HG2 ILE 85 -2.543 11.310 7.545 679 1HD1 ILE 85 1HD1 ILE 85 -2.864 6.961 6.727 680 2HD1 ILE 85 2HD1 ILE 85 -1.110 6.841 6.863 681 3HD1 ILE 85 3HD1 ILE 85 -1.834 7.607 5.449 682 H ALA 86 H ALA 86 -5.485 7.612 9.621 683 HA ALA 86 HA ALA 86 -3.902 5.139 9.699 684 1HB ALA 86 1HB ALA 86 -4.105 5.523 11.982 685 2HB ALA 86 2HB ALA 86 -5.458 4.445 11.634 686 3HB ALA 86 3HB ALA 86 -5.736 6.176 11.827 687 H GLY 87 H GLY 87 -5.171 3.182 9.389 688 1HA GLY 87 1HA GLY 87 -7.857 2.980 8.860 689 2HA GLY 87 2HA GLY 87 -7.152 3.541 7.351 690 H TYR 88 H TYR 88 -7.996 1.493 6.516 691 HA TYR 88 HA TYR 88 -6.054 -0.672 6.951 692 1HB TYR 88 1HB TYR 88 -7.946 -2.295 6.592 693 2HB TYR 88 2HB TYR 88 -8.019 -1.400 8.105 694 HD1 TYR 88 HD1 TYR 88 -9.833 0.073 8.578 695 HD2 TYR 88 HD2 TYR 88 -9.476 -1.698 4.726 696 HE1 TYR 88 HE1 TYR 88 -12.112 0.817 8.031 697 HE2 TYR 88 HE2 TYR 88 -11.754 -0.958 4.169 698 HH TYR 88 HH TYR 88 -13.977 -0.277 6.040 699 H GLY 89 H GLY 89 -5.693 -2.050 5.141 700 1HA GLY 89 1HA GLY 89 -6.682 -0.971 2.576 701 2HA GLY 89 2HA GLY 89 -4.978 -1.331 2.814 702 H TRP 90 H TRP 90 -7.454 -2.432 1.198 703 HA TRP 90 HA TRP 90 -6.970 -5.271 1.801 704 1HB TRP 90 1HB TRP 90 -9.087 -5.733 0.660 705 2HB TRP 90 2HB TRP 90 -9.322 -4.572 1.962 706 HD1 TRP 90 HD1 TRP 90 -9.487 -1.906 1.116 707 HE1 TRP 90 HE1 TRP 90 -10.628 -0.972 -0.994 708 HE3 TRP 90 HE3 TRP 90 -9.687 -6.192 -1.663 709 HZ2 TRP 90 HZ2 TRP 90 -11.497 -1.927 -3.504 710 HZ3 TRP 90 HZ3 TRP 90 -10.689 -6.097 -3.908 711 HH2 TRP 90 HH2 TRP 90 -11.575 -4.008 -4.809 712 H GLU 91 H GLU 91 -6.186 -6.626 0.267 713 HA GLU 91 HA GLU 91 -6.045 -5.830 -2.508 714 1HB GLU 91 1HB GLU 91 -3.547 -6.171 -2.579 715 2HB GLU 91 2HB GLU 91 -4.082 -4.698 -1.783 716 1HG GLU 91 1HG GLU 91 -2.698 -5.299 -0.147 717 2HG GLU 91 2HG GLU 91 -3.955 -6.451 0.301 718 HE2 GLU 91 HE2 GLU 91 -1.442 -8.790 -0.022 719 H SER 92 H SER 92 -5.432 -7.548 -3.911 720 HA SER 92 HA SER 92 -5.810 -10.184 -2.686 721 1HB SER 92 1HB SER 92 -7.205 -9.179 -4.699 722 2HB SER 92 2HB SER 92 -5.844 -9.778 -5.647 723 HG SER 92 HG SER 92 -7.218 -11.465 -5.547 724 H THR 93 H THR 93 -4.129 -11.491 -2.447 725 HA THR 93 HA THR 93 -1.635 -10.878 -3.832 726 HB THR 93 HB THR 93 -2.077 -12.967 -1.701 727 HG1 THR 93 HG1 THR 93 -2.716 -10.979 -0.863 728 1HG2 THR 93 1HG2 THR 93 0.240 -12.761 -1.231 729 2HG2 THR 93 2HG2 THR 93 0.407 -11.412 -2.355 730 3HG2 THR 93 3HG2 THR 93 0.066 -13.031 -2.965 731 H TRP 94 H TRP 94 -0.488 -12.387 -5.058 732 HA TRP 94 HA TRP 94 -1.787 -14.921 -5.692 733 1HB TRP 94 1HB TRP 94 -1.166 -12.780 -7.731 734 2HB TRP 94 2HB TRP 94 -1.473 -14.461 -8.154 735 HD1 TRP 94 HD1 TRP 94 -3.959 -15.086 -6.350 736 HE1 TRP 94 HE1 TRP 94 -6.222 -13.950 -6.813 737 HE3 TRP 94 HE3 TRP 94 -2.308 -11.029 -8.987 738 HZ2 TRP 94 HZ2 TRP 94 -7.180 -11.641 -8.124 739 HZ3 TRP 94 HZ3 TRP 94 -3.962 -9.405 -9.810 740 HH2 TRP 94 HH2 TRP 94 -6.348 -9.706 -9.387 741 H ARG 95 H ARG 95 -0.398 -16.492 -6.538 742 HA ARG 95 HA ARG 95 2.458 -15.832 -6.285 743 1HB ARG 95 1HB ARG 95 0.853 -18.246 -5.600 744 2HB ARG 95 2HB ARG 95 2.516 -18.485 -6.120 745 1HG ARG 95 1HG ARG 95 2.899 -18.285 -3.905 746 2HG ARG 95 2HG ARG 95 2.921 -16.568 -4.310 747 1HD ARG 95 1HD ARG 95 1.389 -16.387 -2.679 748 2HD ARG 95 2HD ARG 95 0.268 -16.986 -3.901 749 HE ARG 95 HE ARG 95 0.055 -18.899 -2.683 750 1HH1 ARG 95 1HH1 ARG 95 3.027 -17.330 -1.742 751 2HH1 ARG 95 2HH1 ARG 95 3.365 -18.456 -0.471 752 1HH2 ARG 95 1HH2 ARG 95 0.499 -20.380 -1.010 753 2HH2 ARG 95 2HH2 ARG 95 1.930 -20.187 -0.055 754 HA PRO 96 HA PRO 96 2.193 -16.597 -10.762 755 1HB PRO 96 1HB PRO 96 4.586 -15.459 -11.354 756 2HB PRO 96 2HB PRO 96 3.109 -14.519 -11.109 757 1HG PRO 96 1HG PRO 96 5.355 -15.047 -9.203 758 2HG PRO 96 2HG PRO 96 4.486 -13.533 -9.518 759 1HD PRO 96 1HD PRO 96 3.953 -15.100 -7.376 760 2HD PRO 96 2HD PRO 96 2.703 -14.134 -8.186 761 H LEU 97 H LEU 97 5.187 -17.010 -8.870 762 HA LEU 97 HA LEU 97 5.683 -19.501 -10.363 763 1HB LEU 97 1HB LEU 97 7.656 -17.631 -9.050 764 2HB LEU 97 2HB LEU 97 8.076 -19.177 -9.763 765 HG LEU 97 HG LEU 97 6.845 -18.021 -11.870 766 1HD1 LEU 97 1HD1 LEU 97 8.408 -15.692 -10.987 767 2HD1 LEU 97 2HD1 LEU 97 6.866 -15.927 -10.166 768 3HD1 LEU 97 3HD1 LEU 97 6.914 -15.775 -11.922 769 1HD2 LEU 97 1HD2 LEU 97 9.166 -17.374 -12.607 770 2HD2 LEU 97 2HD2 LEU 97 8.975 -19.041 -12.063 771 3HD2 LEU 97 3HD2 LEU 97 9.720 -17.846 -11.001 772 H ALA 98 H ALA 98 7.304 -20.924 -8.959 773 HA ALA 98 HA ALA 98 6.366 -20.982 -6.176 774 1HB ALA 98 1HB ALA 98 5.489 -23.058 -6.283 775 2HB ALA 98 2HB ALA 98 6.668 -23.613 -7.471 776 3HB ALA 98 3HB ALA 98 5.281 -22.653 -7.987 777 H ASP 99 H ASP 99 8.847 -20.040 -7.182 778 HA ASP 99 HA ASP 99 10.878 -22.012 -7.005 779 1HB ASP 99 1HB ASP 99 10.838 -19.462 -7.880 780 2HB ASP 99 2HB ASP 99 11.550 -19.213 -6.289 781 HD2 ASP 99 HD2 ASP 99 14.134 -21.590 -7.460 782 H GLU 100 H GLU 100 10.205 -19.334 -4.743 783 HA GLU 100 HA GLU 100 10.645 -21.161 -2.504 784 1HB GLU 100 1HB GLU 100 12.143 -19.524 -1.401 785 2HB GLU 100 2HB GLU 100 12.830 -20.189 -2.876 786 1HG GLU 100 1HG GLU 100 12.099 -18.144 -4.074 787 2HG GLU 100 2HG GLU 100 11.575 -17.477 -2.528 788 HE2 GLU 100 HE2 GLU 100 15.093 -17.523 -1.548 789 H ASN 101 H ASN 101 9.833 -17.838 -3.465 790 HA ASN 101 HA ASN 101 7.347 -17.833 -2.163 791 1HB ASN 101 1HB ASN 101 8.775 -17.832 -0.128 792 2HB ASN 101 2HB ASN 101 9.498 -16.320 -0.667 793 1HD2 ASN 101 1HD2 ASN 101 7.237 -17.610 1.308 794 2HD2 ASN 101 2HD2 ASN 101 6.184 -16.251 1.481 795 H PHE 102 H PHE 102 6.795 -16.918 -4.159 796 HA PHE 102 HA PHE 102 7.754 -14.170 -4.603 797 1HB PHE 102 1HB PHE 102 7.808 -16.253 -6.365 798 2HB PHE 102 2HB PHE 102 6.277 -15.490 -6.786 799 HD1 PHE 102 HD1 PHE 102 9.862 -15.297 -6.987 800 HD2 PHE 102 HD2 PHE 102 6.259 -13.081 -7.451 801 HE1 PHE 102 HE1 PHE 102 11.075 -13.610 -8.306 802 HE2 PHE 102 HE2 PHE 102 7.464 -11.390 -8.770 803 HZ PHE 102 HZ PHE 102 9.875 -11.653 -9.200 804 H HIS 103 H HIS 103 6.351 -12.856 -3.589 805 HA HIS 103 HA HIS 103 3.478 -13.373 -3.845 806 1HB HIS 103 1HB HIS 103 5.182 -12.081 -1.837 807 2HB HIS 103 2HB HIS 103 3.719 -11.176 -2.206 808 HD1 HIS 103 HD1 HIS 103 3.467 -14.859 -2.433 809 HD2 HIS 103 HD2 HIS 103 2.775 -11.888 0.388 810 HE1 HIS 103 HE1 HIS 103 2.106 -15.954 -0.623 811 HE2 HIS 103 HE2 HIS 103 1.773 -14.160 1.113 812 H LEU 104 H LEU 104 2.148 -12.092 -4.993 813 HA LEU 104 HA LEU 104 2.970 -9.438 -5.812 814 1HB LEU 104 1HB LEU 104 3.299 -11.700 -7.536 815 2HB LEU 104 2HB LEU 104 2.055 -10.659 -8.202 816 HG LEU 104 HG LEU 104 4.555 -9.331 -7.322 817 1HD1 LEU 104 1HD1 LEU 104 5.042 -11.571 -8.615 818 2HD1 LEU 104 2HD1 LEU 104 5.928 -10.090 -8.982 819 3HD1 LEU 104 3HD1 LEU 104 4.588 -10.596 -10.012 820 1HD2 LEU 104 1HD2 LEU 104 2.395 -8.399 -8.503 821 2HD2 LEU 104 2HD2 LEU 104 3.219 -8.966 -9.955 822 3HD2 LEU 104 3HD2 LEU 104 3.996 -7.779 -8.907 823 H GLY 105 H GLY 105 1.250 -8.226 -5.403 824 1HA GLY 105 1HA GLY 105 -1.340 -8.969 -6.468 825 2HA GLY 105 2HA GLY 105 -1.256 -8.920 -4.714 826 H LEU 106 H LEU 106 -3.039 -7.285 -5.727 827 HA LEU 106 HA LEU 106 -1.851 -4.650 -5.308 828 1HB LEU 106 1HB LEU 106 -3.281 -5.560 -7.754 829 2HB LEU 106 2HB LEU 106 -3.573 -3.925 -7.192 830 HG LEU 106 HG LEU 106 -0.910 -3.861 -7.163 831 1HD1 LEU 106 1HD1 LEU 106 -1.132 -6.348 -8.064 832 2HD1 LEU 106 2HD1 LEU 106 0.166 -5.273 -8.580 833 3HD1 LEU 106 3HD1 LEU 106 -1.248 -5.502 -9.607 834 1HD2 LEU 106 1HD2 LEU 106 -1.818 -2.204 -8.418 835 2HD2 LEU 106 2HD2 LEU 106 -2.929 -3.290 -9.252 836 3HD2 LEU 106 3HD2 LEU 106 -1.232 -3.226 -9.730 837 H GLY 107 H GLY 107 -3.631 -2.956 -5.066 838 1HA GLY 107 1HA GLY 107 -6.281 -3.600 -4.497 839 2HA GLY 107 2HA GLY 107 -5.378 -3.786 -3.000 840 H PHE 108 H PHE 108 -6.785 -2.065 -2.217 841 HA PHE 108 HA PHE 108 -5.670 0.569 -2.887 842 1HB PHE 108 1HB PHE 108 -8.468 -0.313 -3.086 843 2HB PHE 108 2HB PHE 108 -8.248 1.190 -2.196 844 HD1 PHE 108 HD1 PHE 108 -7.808 -0.472 -5.441 845 HD2 PHE 108 HD2 PHE 108 -7.575 3.196 -3.296 846 HE1 PHE 108 HE1 PHE 108 -7.631 0.755 -7.567 847 HE2 PHE 108 HE2 PHE 108 -7.399 4.430 -5.417 848 HZ PHE 108 HZ PHE 108 -7.428 3.210 -7.556 849 H THR 109 H THR 109 -5.126 1.783 -1.173 850 HA THR 109 HA THR 109 -5.650 0.675 1.482 851 HB THR 109 HB THR 109 -3.778 2.917 0.705 852 HG1 THR 109 HG1 THR 109 -3.298 0.821 -0.243 853 1HG2 THR 109 1HG2 THR 109 -3.112 1.279 3.014 854 2HG2 THR 109 2HG2 THR 109 -4.596 2.211 3.215 855 3HG2 THR 109 3HG2 THR 109 -3.087 3.031 2.814 856 H ALA 110 H ALA 110 -7.209 1.485 2.704 857 HA ALA 110 HA ALA 110 -8.281 4.138 2.068 858 1HB ALA 110 1HB ALA 110 -10.069 2.690 2.068 859 2HB ALA 110 2HB ALA 110 -10.112 3.287 3.727 860 3HB ALA 110 3HB ALA 110 -9.411 1.707 3.376 861 H GLY 111 H GLY 111 -7.879 5.824 3.340 862 1HA GLY 111 1HA GLY 111 -7.117 5.311 6.145 863 2HA GLY 111 2HA GLY 111 -6.192 6.420 5.143 864 H VAL 112 H VAL 112 -7.330 7.196 7.560 865 HA VAL 112 HA VAL 112 -9.124 9.291 6.615 866 HB VAL 112 HB VAL 112 -10.654 8.981 8.543 867 1HG1 VAL 112 1HG1 VAL 112 -11.103 8.077 6.241 868 2HG1 VAL 112 2HG1 VAL 112 -11.969 7.270 7.547 869 3HG1 VAL 112 3HG1 VAL 112 -10.551 6.508 6.829 870 1HG2 VAL 112 1HG2 VAL 112 -10.644 6.950 9.823 871 2HG2 VAL 112 2HG2 VAL 112 -9.045 7.685 9.931 872 3HG2 VAL 112 3HG2 VAL 112 -9.310 6.302 8.870 873 H THR 113 H THR 113 -8.989 11.192 7.762 874 HA THR 113 HA THR 113 -6.927 11.259 9.866 875 HB THR 113 HB THR 113 -7.776 13.508 8.031 876 HG1 THR 113 HG1 THR 113 -6.469 12.662 6.652 877 1HG2 THR 113 1HG2 THR 113 -5.681 13.279 10.142 878 2HG2 THR 113 2HG2 THR 113 -6.825 14.585 9.831 879 3HG2 THR 113 3HG2 THR 113 -5.446 14.345 8.757 880 H ALA 114 H ALA 114 -7.546 11.820 11.844 881 HA ALA 114 HA ALA 114 -10.217 12.992 12.190 882 1HB ALA 114 1HB ALA 114 -8.724 11.937 14.520 883 2HB ALA 114 2HB ALA 114 -9.284 10.769 13.323 884 3HB ALA 114 3HB ALA 114 -10.440 11.831 14.128 885 H ARG 115 H ARG 115 -10.547 14.827 13.404 886 HA ARG 115 HA ARG 115 -8.213 16.534 13.737 887 1HB ARG 115 1HB ARG 115 -11.155 16.961 13.559 888 2HB ARG 115 2HB ARG 115 -10.210 18.150 14.446 889 1HG ARG 115 1HG ARG 115 -9.223 18.958 12.583 890 2HG ARG 115 2HG ARG 115 -9.180 17.383 11.790 891 1HD ARG 115 1HD ARG 115 -10.798 18.294 10.506 892 2HD ARG 115 2HD ARG 115 -11.835 17.800 11.844 893 HE ARG 115 HE ARG 115 -11.050 20.289 12.556 894 1HH1 ARG 115 1HH1 ARG 115 -12.488 18.975 9.660 895 2HH1 ARG 115 2HH1 ARG 115 -13.315 20.441 9.257 896 1HH2 ARG 115 1HH2 ARG 115 -12.139 22.217 12.027 897 2HH2 ARG 115 2HH2 ARG 115 -13.118 22.281 10.601 898 H ASP 116 H ASP 116 -8.606 18.149 15.736 899 HA ASP 116 HA ASP 116 -8.395 16.440 18.071 900 1HB ASP 116 1HB ASP 116 -6.999 18.632 17.324 901 2HB ASP 116 2HB ASP 116 -8.193 19.379 18.380 902 HD2 ASP 116 HD2 ASP 116 -5.201 17.622 20.037 903 H ASN 117 H ASN 117 -10.516 18.926 16.787 904 HA ASN 117 HA ASN 117 -12.088 19.159 19.173 905 1HB ASN 117 1HB ASN 117 -11.773 20.852 17.191 906 2HB ASN 117 2HB ASN 117 -13.109 19.956 16.472 907 1HD2 ASN 117 1HD2 ASN 117 -12.153 21.606 19.450 908 2HD2 ASN 117 2HD2 ASN 117 -13.729 22.207 19.829 909 H TRP 118 H TRP 118 -12.134 17.153 16.336 910 HA TRP 118 HA TRP 118 -13.391 15.350 15.751 911 1HB TRP 118 1HB TRP 118 -12.973 14.684 18.117 912 2HB TRP 118 2HB TRP 118 -14.469 15.492 18.575 913 HD1 TRP 118 HD1 TRP 118 -16.714 14.467 17.074 914 HE1 TRP 118 HE1 TRP 118 -17.282 11.983 16.708 915 HE3 TRP 118 HE3 TRP 118 -12.111 12.439 17.988 916 HZ2 TRP 118 HZ2 TRP 118 -15.954 9.494 16.796 917 HZ3 TRP 118 HZ3 TRP 118 -11.844 9.998 17.826 918 HH2 TRP 118 HH2 TRP 118 -13.728 8.557 17.242 919 H ASN 119 H ASN 119 -14.641 16.423 14.234 920 HA ASN 119 HA ASN 119 -17.442 16.651 14.902 921 1HB ASN 119 1HB ASN 119 -17.572 18.973 13.876 922 2HB ASN 119 2HB ASN 119 -16.858 18.879 15.483 923 1HD2 ASN 119 1HD2 ASN 119 -16.269 19.430 12.108 924 2HD2 ASN 119 2HD2 ASN 119 -14.681 20.086 12.283 925 H TYR 120 H TYR 120 -18.753 16.278 13.170 926 HA TYR 120 HA TYR 120 -19.372 15.585 11.095 927 1HB TYR 120 1HB TYR 120 -17.159 17.509 10.414 928 2HB TYR 120 2HB TYR 120 -18.030 16.634 9.159 929 HD1 TYR 120 HD1 TYR 120 -20.322 17.179 8.627 930 HD2 TYR 120 HD2 TYR 120 -18.286 19.211 11.760 931 HE1 TYR 120 HE1 TYR 120 -22.095 18.883 8.666 932 HE2 TYR 120 HE2 TYR 120 -20.053 20.920 11.809 933 HH TYR 120 HH TYR 120 -21.870 21.746 9.802 934 H ILE 121 H ILE 121 -18.255 14.685 8.897 935 HA ILE 121 HA ILE 121 -16.932 12.298 9.721 936 HB ILE 121 HB ILE 121 -16.829 11.753 7.320 937 1HG1 ILE 121 1HG1 ILE 121 -18.328 13.616 6.009 938 2HG1 ILE 121 2HG1 ILE 121 -17.397 14.640 7.098 939 1HG2 ILE 121 1HG2 ILE 121 -19.445 12.242 6.980 940 2HG2 ILE 121 2HG2 ILE 121 -19.307 12.547 8.711 941 3HG2 ILE 121 3HG2 ILE 121 -18.823 10.984 8.050 942 1HD1 ILE 121 1HD1 ILE 121 -15.913 12.578 5.587 943 2HD1 ILE 121 2HD1 ILE 121 -15.441 14.215 6.045 944 3HD1 ILE 121 3HD1 ILE 121 -16.537 13.960 4.686 945 HA PRO 122 HA PRO 122 -12.710 13.556 9.393 946 1HB PRO 122 1HB PRO 122 -11.529 11.189 8.795 947 2HB PRO 122 2HB PRO 122 -12.169 11.561 10.399 948 1HG PRO 122 1HG PRO 122 -13.408 9.965 8.189 949 2HG PRO 122 2HG PRO 122 -13.354 9.616 9.928 950 1HD PRO 122 1HD PRO 122 -15.539 10.667 8.717 951 2HD PRO 122 2HD PRO 122 -15.103 11.043 10.396 952 H LEU 123 H LEU 123 -10.719 12.729 7.814 953 HA LEU 123 HA LEU 123 -11.646 13.468 5.127 954 1HB LEU 123 1HB LEU 123 -9.178 13.979 6.685 955 2HB LEU 123 2HB LEU 123 -8.975 13.736 4.960 956 HG LEU 123 HG LEU 123 -11.065 15.667 5.806 957 1HD1 LEU 123 1HD1 LEU 123 -9.592 16.651 7.219 958 2HD1 LEU 123 2HD1 LEU 123 -9.004 17.352 5.711 959 3HD1 LEU 123 3HD1 LEU 123 -8.184 15.958 6.413 960 1HD2 LEU 123 1HD2 LEU 123 -10.089 14.907 3.420 961 2HD2 LEU 123 2HD2 LEU 123 -9.031 16.277 3.760 962 3HD2 LEU 123 3HD2 LEU 123 -10.780 16.500 3.728 963 HA PRO 124 HA PRO 124 -10.618 9.032 4.539 964 1HB PRO 124 1HB PRO 124 -12.291 8.688 2.425 965 2HB PRO 124 2HB PRO 124 -12.828 8.584 4.106 966 1HG PRO 124 1HG PRO 124 -13.051 10.869 2.185 967 2HG PRO 124 2HG PRO 124 -14.258 10.244 3.325 968 1HD PRO 124 1HD PRO 124 -12.777 12.446 3.844 969 2HD PRO 124 2HD PRO 124 -13.309 11.334 5.123 970 H VAL 125 H VAL 125 -9.322 8.044 3.009 971 HA VAL 125 HA VAL 125 -8.709 9.449 0.533 972 HB VAL 125 HB VAL 125 -6.492 8.694 2.437 973 1HG1 VAL 125 1HG1 VAL 125 -5.443 8.680 0.426 974 2HG1 VAL 125 2HG1 VAL 125 -5.382 10.417 0.728 975 3HG1 VAL 125 3HG1 VAL 125 -6.628 9.748 -0.326 976 1HG2 VAL 125 1HG2 VAL 125 -7.800 11.355 1.924 977 2HG2 VAL 125 2HG2 VAL 125 -6.184 11.200 2.614 978 3HG2 VAL 125 3HG2 VAL 125 -7.575 10.527 3.465 979 H LEU 126 H LEU 126 -7.913 8.130 -1.083 980 HA LEU 126 HA LEU 126 -7.423 5.315 -0.421 981 1HB LEU 126 1HB LEU 126 -9.163 6.170 -2.729 982 2HB LEU 126 2HB LEU 126 -8.848 4.534 -2.184 983 HG LEU 126 HG LEU 126 -9.952 5.453 0.054 984 1HD1 LEU 126 1HD1 LEU 126 -10.206 7.737 -0.818 985 2HD1 LEU 126 2HD1 LEU 126 -11.756 7.002 -0.409 986 3HD1 LEU 126 3HD1 LEU 126 -11.254 7.120 -2.095 987 1HD2 LEU 126 1HD2 LEU 126 -11.755 4.175 -0.490 988 2HD2 LEU 126 2HD2 LEU 126 -10.658 3.662 -1.772 989 3HD2 LEU 126 3HD2 LEU 126 -11.901 4.867 -2.106 990 H LEU 127 H LEU 127 -5.631 4.575 -1.350 991 HA LEU 127 HA LEU 127 -4.725 5.800 -3.859 992 1HB LEU 127 1HB LEU 127 -2.370 5.610 -2.961 993 2HB LEU 127 2HB LEU 127 -3.365 6.876 -2.267 994 HG LEU 127 HG LEU 127 -3.145 4.222 -0.895 995 1HD1 LEU 127 1HD1 LEU 127 -0.857 5.280 -1.476 996 2HD1 LEU 127 2HD1 LEU 127 -1.170 4.768 0.182 997 3HD1 LEU 127 3HD1 LEU 127 -1.285 6.473 -0.251 998 1HD2 LEU 127 1HD2 LEU 127 -4.716 5.421 0.232 999 2HD2 LEU 127 2HD2 LEU 127 -4.029 6.976 -0.238 1000 3HD2 LEU 127 3HD2 LEU 127 -3.272 6.030 1.044 1001 HA PRO 128 HA PRO 128 -4.348 1.498 -4.949 1002 1HB PRO 128 1HB PRO 128 -3.222 1.794 -7.377 1003 2HB PRO 128 2HB PRO 128 -4.915 2.204 -7.072 1004 1HG PRO 128 1HG PRO 128 -2.529 4.005 -7.235 1005 2HG PRO 128 2HG PRO 128 -4.151 4.231 -7.918 1006 1HD PRO 128 1HD PRO 128 -3.320 5.409 -5.602 1007 2HD PRO 128 2HD PRO 128 -5.013 4.996 -5.934 1008 H LEU 129 H LEU 129 -2.871 0.108 -4.224 1009 HA LEU 129 HA LEU 129 -0.023 0.723 -4.635 1010 1HB LEU 129 1HB LEU 129 -1.444 -0.062 -2.128 1011 2HB LEU 129 2HB LEU 129 0.203 -0.614 -2.376 1012 HG LEU 129 HG LEU 129 0.573 1.984 -2.890 1013 1HD1 LEU 129 1HD1 LEU 129 -1.426 3.005 -2.547 1014 2HD1 LEU 129 2HD1 LEU 129 -0.816 3.041 -0.892 1015 3HD1 LEU 129 3HD1 LEU 129 -1.970 1.799 -1.379 1016 1HD2 LEU 129 1HD2 LEU 129 0.385 1.024 -0.050 1017 2HD2 LEU 129 2HD2 LEU 129 1.532 2.165 -0.752 1018 3HD2 LEU 129 3HD2 LEU 129 1.631 0.452 -1.159 1019 H ALA 130 H ALA 130 1.344 -1.308 -4.219 1020 HA ALA 130 HA ALA 130 -0.041 -3.764 -4.997 1021 1HB ALA 130 1HB ALA 130 1.322 -4.196 -6.872 1022 2HB ALA 130 2HB ALA 130 2.419 -2.873 -6.478 1023 3HB ALA 130 3HB ALA 130 0.786 -2.525 -7.049 1024 H SER 131 H SER 131 0.614 -5.385 -3.755 1025 HA SER 131 HA SER 131 3.051 -5.092 -2.188 1026 1HB SER 131 1HB SER 131 0.594 -6.771 -2.002 1027 2HB SER 131 2HB SER 131 2.075 -7.404 -1.285 1028 HG SER 131 HG SER 131 1.098 -4.801 -0.750 1029 H VAL 132 H VAL 132 4.894 -5.823 -3.001 1030 HA VAL 132 HA VAL 132 4.951 -8.461 -4.257 1031 HB VAL 132 HB VAL 132 6.325 -6.098 -5.537 1032 1HG1 VAL 132 1HG1 VAL 132 6.339 -7.866 -7.457 1033 2HG1 VAL 132 2HG1 VAL 132 6.142 -9.017 -6.136 1034 3HG1 VAL 132 3HG1 VAL 132 7.544 -7.947 -6.172 1035 1HG2 VAL 132 1HG2 VAL 132 4.100 -5.642 -6.000 1036 2HG2 VAL 132 2HG2 VAL 132 3.659 -7.348 -6.071 1037 3HG2 VAL 132 3HG2 VAL 132 4.583 -6.620 -7.385 1038 H GLY 133 H GLY 133 6.502 -9.635 -3.346 1039 1HA GLY 133 1HA GLY 133 9.160 -8.856 -3.014 1040 2HA GLY 133 2HA GLY 133 8.341 -8.561 -1.487 1041 H TYR 134 H TYR 134 10.021 -10.178 -0.814 1042 HA TYR 134 HA TYR 134 8.790 -12.821 -0.806 1043 1HB TYR 134 1HB TYR 134 10.881 -13.962 -1.345 1044 2HB TYR 134 2HB TYR 134 10.410 -12.891 -2.661 1045 HD1 TYR 134 HD1 TYR 134 13.114 -13.982 -0.796 1046 HD2 TYR 134 HD2 TYR 134 11.430 -10.401 -2.359 1047 HE1 TYR 134 HE1 TYR 134 15.325 -12.909 -0.705 1048 HE2 TYR 134 HE2 TYR 134 13.636 -9.319 -2.274 1049 HH TYR 134 HH TYR 134 16.310 -10.722 -0.638 1050 H GLY 135 H GLY 135 9.288 -14.067 1.007 1051 1HA GLY 135 1HA GLY 135 9.854 -14.440 3.199 1052 2HA GLY 135 2HA GLY 135 11.310 -13.514 2.868 1053 HA PRO 136 HA PRO 136 9.049 -11.070 6.022 1054 1HB PRO 136 1HB PRO 136 11.273 -10.007 7.155 1055 2HB PRO 136 2HB PRO 136 10.655 -11.609 7.575 1056 1HG PRO 136 1HG PRO 136 12.882 -10.865 5.717 1057 2HG PRO 136 2HG PRO 136 12.818 -12.163 6.924 1058 1HD PRO 136 1HD PRO 136 12.426 -12.608 4.282 1059 2HD PRO 136 2HD PRO 136 11.616 -13.561 5.541 1060 H VAL 137 H VAL 137 11.112 -10.284 3.412 1061 HA VAL 137 HA VAL 137 10.713 -7.404 3.777 1062 HB VAL 137 HB VAL 137 12.256 -7.176 1.824 1063 1HG1 VAL 137 1HG1 VAL 137 14.241 -8.318 3.200 1064 2HG1 VAL 137 2HG1 VAL 137 12.982 -8.360 4.435 1065 3HG1 VAL 137 3HG1 VAL 137 13.457 -6.823 3.712 1066 1HG2 VAL 137 1HG2 VAL 137 12.646 -10.146 2.179 1067 2HG2 VAL 137 2HG2 VAL 137 13.533 -9.094 1.076 1068 3HG2 VAL 137 3HG2 VAL 137 11.812 -9.383 0.825 1069 H THR 138 H THR 138 9.260 -6.294 2.638 1070 HA THR 138 HA THR 138 8.229 -7.424 0.137 1071 HB THR 138 HB THR 138 6.232 -6.126 1.903 1072 HG1 THR 138 HG1 THR 138 7.060 -8.799 2.346 1073 1HG2 THR 138 1HG2 THR 138 6.070 -7.486 -0.444 1074 2HG2 THR 138 2HG2 THR 138 4.734 -7.231 0.679 1075 3HG2 THR 138 3HG2 THR 138 5.655 -8.734 0.729 1076 H PHE 139 H PHE 139 8.023 -5.960 -1.442 1077 HA PHE 139 HA PHE 139 8.452 -3.142 -0.747 1078 1HB PHE 139 1HB PHE 139 9.148 -4.838 -3.079 1079 2HB PHE 139 2HB PHE 139 8.716 -3.167 -3.428 1080 HD1 PHE 139 HD1 PHE 139 10.658 -2.033 -3.920 1081 HD2 PHE 139 HD2 PHE 139 10.594 -4.684 -0.591 1082 HE1 PHE 139 HE1 PHE 139 12.932 -1.318 -3.313 1083 HE2 PHE 139 HE2 PHE 139 12.869 -3.974 0.023 1084 HZ PHE 139 HZ PHE 139 14.041 -2.289 -1.339 1085 H GLN 140 H GLN 140 7.028 -1.563 -1.299 1086 HA GLN 140 HA GLN 140 4.502 -2.448 -2.530 1087 1HB GLN 140 1HB GLN 140 5.100 -0.654 -0.240 1088 2HB GLN 140 2HB GLN 140 3.751 -0.202 -1.273 1089 1HG GLN 140 1HG GLN 140 2.458 -1.891 -0.553 1090 2HG GLN 140 2HG GLN 140 3.809 -3.018 -0.433 1091 1HE2 GLN 140 1HE2 GLN 140 3.390 -3.790 1.576 1092 2HE2 GLN 140 2HE2 GLN 140 3.456 -2.832 3.011 1093 H MET 141 H MET 141 3.645 -1.297 -4.199 1094 HA MET 141 HA MET 141 5.201 1.021 -5.147 1095 1HB MET 141 1HB MET 141 5.192 -1.297 -6.445 1096 2HB MET 141 2HB MET 141 3.676 -0.666 -7.075 1097 1HG MET 141 1HG MET 141 5.162 0.062 -8.654 1098 2HG MET 141 2HG MET 141 5.087 1.459 -7.581 1099 1HE MET 141 1HE MET 141 8.703 -0.981 -8.697 1100 2HE MET 141 2HE MET 141 7.273 -0.549 -9.634 1101 3HE MET 141 3HE MET 141 7.179 -1.824 -8.419 1102 H THR 142 H THR 142 4.077 2.841 -5.105 1103 HA THR 142 HA THR 142 1.144 2.701 -5.240 1104 HB THR 142 HB THR 142 2.574 5.193 -4.432 1105 HG1 THR 142 HG1 THR 142 2.394 2.836 -2.886 1106 1HG2 THR 142 1HG2 THR 142 0.713 5.153 -2.703 1107 2HG2 THR 142 2HG2 THR 142 0.011 3.851 -3.662 1108 3HG2 THR 142 3HG2 THR 142 0.256 5.442 -4.381 1109 H TYR 143 H TYR 143 0.281 3.173 -7.142 1110 HA TYR 143 HA TYR 143 1.218 5.485 -8.626 1111 1HB TYR 143 1HB TYR 143 2.580 3.625 -9.515 1112 2HB TYR 143 2HB TYR 143 1.106 2.746 -9.908 1113 HD1 TYR 143 HD1 TYR 143 3.529 5.078 -11.072 1114 HD2 TYR 143 HD2 TYR 143 -0.527 3.885 -11.550 1115 HE1 TYR 143 HE1 TYR 143 3.470 6.178 -13.271 1116 HE2 TYR 143 HE2 TYR 143 -0.597 4.981 -13.750 1117 HH TYR 143 HH TYR 143 2.211 6.077 -15.347 1118 H ILE 144 H ILE 144 -0.491 6.601 -9.279 1119 HA ILE 144 HA ILE 144 -3.122 5.392 -9.182 1120 HB ILE 144 HB ILE 144 -2.436 8.232 -9.929 1121 1HG1 ILE 144 1HG1 ILE 144 -3.305 8.422 -7.381 1122 2HG1 ILE 144 2HG1 ILE 144 -2.503 6.856 -7.303 1123 1HG2 ILE 144 1HG2 ILE 144 -4.629 8.118 -10.462 1124 2HG2 ILE 144 2HG2 ILE 144 -4.830 8.353 -8.726 1125 3HG2 ILE 144 3HG2 ILE 144 -4.924 6.732 -9.413 1126 1HD1 ILE 144 1HD1 ILE 144 -1.318 9.318 -7.000 1127 2HD1 ILE 144 2HD1 ILE 144 -0.892 8.854 -8.648 1128 3HD1 ILE 144 3HD1 ILE 144 -0.491 7.790 -7.300 1129 HA PRO 145 HA PRO 145 -3.101 4.313 -13.530 1130 1HB PRO 145 1HB PRO 145 -6.046 4.482 -13.113 1131 2HB PRO 145 2HB PRO 145 -5.082 3.182 -13.822 1132 1HG PRO 145 1HG PRO 145 -6.076 2.948 -11.365 1133 2HG PRO 145 2HG PRO 145 -4.456 2.340 -11.753 1134 1HD PRO 145 1HD PRO 145 -5.251 4.807 -10.273 1135 2HD PRO 145 2HD PRO 145 -3.875 3.718 -9.998 1136 H GLY 146 H GLY 146 -4.154 5.146 -15.546 1137 1HA GLY 146 1HA GLY 146 -5.561 7.024 -16.418 1138 2HA GLY 146 2HA GLY 146 -4.686 8.041 -15.284 1139 H THR 147 H THR 147 -4.957 7.761 -18.364 1140 HA THR 147 HA THR 147 -2.132 7.526 -19.068 1141 HB THR 147 HB THR 147 -3.573 6.343 -20.554 1142 HG1 THR 147 HG1 THR 147 -2.302 7.119 -22.021 1143 1HG2 THR 147 1HG2 THR 147 -5.712 7.025 -20.538 1144 2HG2 THR 147 2HG2 THR 147 -5.191 7.961 -21.939 1145 3HG2 THR 147 3HG2 THR 147 -5.286 8.727 -20.354 1146 H TYR 148 H TYR 148 -1.550 9.489 -17.925 1147 HA TYR 148 HA TYR 148 -1.961 11.851 -19.613 1148 1HB TYR 148 1HB TYR 148 -3.345 11.654 -17.315 1149 2HB TYR 148 2HB TYR 148 -1.849 12.334 -16.687 1150 HD1 TYR 148 HD1 TYR 148 -4.843 12.964 -18.648 1151 HD2 TYR 148 HD2 TYR 148 -1.089 14.562 -17.440 1152 HE1 TYR 148 HE1 TYR 148 -5.579 15.205 -19.345 1153 HE2 TYR 148 HE2 TYR 148 -1.815 16.806 -18.134 1154 HH TYR 148 HH TYR 148 -4.232 17.424 -20.127 1155 H ASN 149 H ASN 149 -0.205 13.184 -19.802 1156 HA ASN 149 HA ASN 149 2.291 12.151 -18.675 1157 1HB ASN 149 1HB ASN 149 1.588 13.778 -21.078 1158 2HB ASN 149 2HB ASN 149 3.193 13.970 -20.380 1159 1HD2 ASN 149 1HD2 ASN 149 4.114 13.103 -22.258 1160 2HD2 ASN 149 2HD2 ASN 149 4.081 11.405 -22.579 1161 H ASN 150 H ASN 150 0.564 13.563 -16.938 1162 HA ASN 150 HA ASN 150 2.390 15.526 -15.941 1163 1HB ASN 150 1HB ASN 150 0.731 16.575 -17.788 1164 2HB ASN 150 2HB ASN 150 -0.284 16.739 -16.358 1165 1HD2 ASN 150 1HD2 ASN 150 0.222 19.032 -17.298 1166 2HD2 ASN 150 2HD2 ASN 150 1.510 19.859 -16.500 1167 H GLY 151 H GLY 151 2.400 15.057 -13.849 1168 1HA GLY 151 1HA GLY 151 1.393 15.150 -11.697 1169 2HA GLY 151 2HA GLY 151 -0.165 14.826 -12.443 1170 H ASN 152 H ASN 152 2.697 12.980 -13.221 1171 HA ASN 152 HA ASN 152 1.388 10.592 -12.171 1172 1HB ASN 152 1HB ASN 152 3.839 10.891 -13.920 1173 2HB ASN 152 2HB ASN 152 3.107 9.359 -13.454 1174 1HD2 ASN 152 1HD2 ASN 152 3.368 9.721 -16.039 1175 2HD2 ASN 152 2HD2 ASN 152 1.866 10.109 -16.797 1176 H VAL 153 H VAL 153 1.744 10.788 -9.960 1177 HA VAL 153 HA VAL 153 4.520 10.914 -9.035 1178 HB VAL 153 HB VAL 153 3.561 11.185 -6.778 1179 1HG1 VAL 153 1HG1 VAL 153 4.070 13.154 -8.116 1180 2HG1 VAL 153 2HG1 VAL 153 2.648 13.434 -7.111 1181 3HG1 VAL 153 3HG1 VAL 153 2.459 13.099 -8.833 1182 1HG2 VAL 153 1HG2 VAL 153 1.493 10.456 -6.396 1183 2HG2 VAL 153 2HG2 VAL 153 1.161 10.319 -8.122 1184 3HG2 VAL 153 3HG2 VAL 153 0.896 11.852 -7.292 1185 H TYR 154 H TYR 154 5.572 9.107 -8.571 1186 HA TYR 154 HA TYR 154 4.032 6.769 -7.656 1187 1HB TYR 154 1HB TYR 154 5.524 5.306 -8.920 1188 2HB TYR 154 2HB TYR 154 4.731 6.450 -9.997 1189 HD1 TYR 154 HD1 TYR 154 5.996 8.193 -11.114 1190 HD2 TYR 154 HD2 TYR 154 7.913 5.459 -8.477 1191 HE1 TYR 154 HE1 TYR 154 8.184 8.896 -11.986 1192 HE2 TYR 154 HE2 TYR 154 10.108 6.155 -9.341 1193 HH TYR 154 HH TYR 154 10.718 8.834 -10.869 1194 H PHE 155 H PHE 155 4.660 6.043 -5.741 1195 HA PHE 155 HA PHE 155 7.455 6.417 -4.919 1196 1HB PHE 155 1HB PHE 155 5.188 7.742 -3.801 1197 2HB PHE 155 2HB PHE 155 5.802 6.607 -2.603 1198 HD1 PHE 155 HD1 PHE 155 7.587 7.206 -1.266 1199 HD2 PHE 155 HD2 PHE 155 6.930 9.295 -4.915 1200 HE1 PHE 155 HE1 PHE 155 9.368 8.796 -0.671 1201 HE2 PHE 155 HE2 PHE 155 8.711 10.887 -4.328 1202 HZ PHE 155 HZ PHE 155 9.933 10.639 -2.204 1203 H ALA 156 H ALA 156 8.238 4.891 -3.399 1204 HA ALA 156 HA ALA 156 6.540 2.506 -3.064 1205 1HB ALA 156 1HB ALA 156 9.461 2.108 -3.309 1206 2HB ALA 156 2HB ALA 156 8.584 2.529 -4.781 1207 3HB ALA 156 3HB ALA 156 8.126 1.096 -3.860 1208 H TRP 157 H TRP 157 6.601 1.501 -1.106 1209 HA TRP 157 HA TRP 157 8.381 2.670 0.931 1210 1HB TRP 157 1HB TRP 157 5.562 1.649 1.344 1211 2HB TRP 157 2HB TRP 157 6.607 2.341 2.581 1212 HD1 TRP 157 HD1 TRP 157 7.621 4.931 1.151 1213 HE1 TRP 157 HE1 TRP 157 5.995 6.853 0.617 1214 HE3 TRP 157 HE3 TRP 157 3.225 2.323 1.239 1215 HZ2 TRP 157 HZ2 TRP 157 3.215 7.215 0.278 1216 HZ3 TRP 157 HZ3 TRP 157 1.128 3.531 0.800 1217 HH2 TRP 157 HH2 TRP 157 1.125 5.927 0.331 1218 H MET 158 H MET 158 8.707 1.210 2.841 1219 HA MET 158 HA MET 158 9.102 -1.540 1.884 1220 1HB MET 158 1HB MET 158 10.546 0.170 3.880 1221 2HB MET 158 2HB MET 158 10.664 -1.581 3.972 1222 1HG MET 158 1HG MET 158 11.686 -1.724 1.854 1223 2HG MET 158 2HG MET 158 11.282 -0.052 1.466 1224 1HE MET 158 1HE MET 158 15.264 -1.209 2.427 1225 2HE MET 158 2HE MET 158 14.358 -0.848 0.958 1226 3HE MET 158 3HE MET 158 13.914 -2.237 1.950 1227 H ARG 159 H ARG 159 8.475 -3.302 3.121 1228 HA ARG 159 HA ARG 159 6.810 -2.721 5.476 1229 1HB ARG 159 1HB ARG 159 5.352 -3.136 3.547 1230 2HB ARG 159 2HB ARG 159 6.157 -4.673 3.261 1231 1HG ARG 159 1HG ARG 159 5.417 -5.302 5.620 1232 2HG ARG 159 2HG ARG 159 4.345 -3.903 5.520 1233 1HD ARG 159 1HD ARG 159 3.289 -4.829 3.535 1234 2HD ARG 159 2HD ARG 159 4.395 -6.202 3.568 1235 HE ARG 159 HE ARG 159 3.129 -6.168 6.023 1236 1HH1 ARG 159 1HH1 ARG 159 2.191 -6.485 2.676 1237 2HH1 ARG 159 2HH1 ARG 159 0.808 -7.467 3.027 1238 1HH2 ARG 159 1HH2 ARG 159 1.312 -7.461 6.486 1239 2HH2 ARG 159 2HH2 ARG 159 0.310 -8.021 5.190 1240 H PHE 160 H PHE 160 7.108 -4.027 7.193 1241 HA PHE 160 HA PHE 160 8.746 -6.444 6.821 1242 1HB PHE 160 1HB PHE 160 9.378 -4.074 8.339 1243 2HB PHE 160 2HB PHE 160 9.273 -5.467 9.410 1244 HD1 PHE 160 HD1 PHE 160 11.308 -6.395 9.874 1245 HD2 PHE 160 HD2 PHE 160 10.600 -4.849 5.973 1246 HE1 PHE 160 HE1 PHE 160 13.568 -7.088 9.194 1247 HE2 PHE 160 HE2 PHE 160 12.859 -5.540 5.284 1248 HZ PHE 160 HZ PHE 160 14.346 -6.662 6.896 1249 H GLN 161 H GLN 161 7.806 -8.221 7.569 1250 HA GLN 161 HA GLN 161 5.506 -7.948 9.362 1251 1HB GLN 161 1HB GLN 161 5.325 -9.210 7.181 1252 2HB GLN 161 2HB GLN 161 6.400 -10.417 7.873 1253 1HG GLN 161 1HG GLN 161 4.804 -10.929 9.593 1254 2HG GLN 161 2HG GLN 161 3.754 -9.617 9.061 1255 1HE2 GLN 161 1HE2 GLN 161 4.385 -12.878 8.844 1256 2HE2 GLN 161 2HE2 GLN 161 3.427 -13.247 7.454 1257 H PHE 162 H PHE 162 5.919 -8.148 11.458 1258 HA PHE 162 HA PHE 162 8.182 -9.765 12.345 1259 1HB PHE 162 1HB PHE 162 7.843 -7.436 13.213 1260 2HB PHE 162 2HB PHE 162 6.372 -7.998 14.002 1261 HD1 PHE 162 HD1 PHE 162 6.688 -8.105 16.269 1262 HD2 PHE 162 HD2 PHE 162 9.807 -9.423 13.693 1263 HE1 PHE 162 HE1 PHE 162 8.006 -8.801 18.227 1264 HE2 PHE 162 HE2 PHE 162 11.131 -10.122 15.646 1265 HZ PHE 162 HZ PHE 162 10.230 -9.812 17.917 1266 H LEU 163 H LEU 163 8.004 -11.602 13.521 1267 HA LEU 163 HA LEU 163 5.388 -12.427 14.519 1268 1HB LEU 163 1HB LEU 163 5.846 -13.274 12.118 1269 2HB LEU 163 2HB LEU 163 7.003 -14.352 12.877 1270 HG LEU 163 HG LEU 163 5.243 -15.389 14.188 1271 1HD1 LEU 163 1HD1 LEU 163 3.753 -13.620 14.638 1272 2HD1 LEU 163 2HD1 LEU 163 2.854 -14.763 13.641 1273 3HD1 LEU 163 3HD1 LEU 163 3.505 -13.290 12.923 1274 1HD2 LEU 163 1HD2 LEU 163 4.897 -15.188 11.227 1275 2HD2 LEU 163 2HD2 LEU 163 3.771 -16.149 12.185 1276 3HD2 LEU 163 3HD2 LEU 163 5.492 -16.534 12.198 1277 H GLU 164 H GLU 164 5.541 -14.388 15.896 1278 HA GLU 164 HA GLU 164 8.214 -14.735 17.069 1279 1HB GLU 164 1HB GLU 164 7.157 -14.794 19.319 1280 2HB GLU 164 2HB GLU 164 7.046 -13.223 18.537 1281 1HG GLU 164 1HG GLU 164 4.872 -13.247 18.920 1282 2HG GLU 164 2HG GLU 164 4.729 -14.595 17.792 1283 HE2 GLU 164 HE2 GLU 164 4.343 -15.283 21.648 1284 H HIS 165 H HIS 165 8.736 -16.779 17.706 1285 HA HIS 165 HA HIS 165 6.727 -18.861 17.147 1286 1HB HIS 165 1HB HIS 165 9.644 -18.664 16.632 1287 2HB HIS 165 2HB HIS 165 9.035 -20.244 17.112 1288 HD1 HIS 165 HD1 HIS 165 8.170 -17.574 14.535 1289 HD2 HIS 165 HD2 HIS 165 8.160 -21.703 15.012 1290 HE1 HIS 165 HE1 HIS 165 7.443 -18.506 12.316 1291 HE2 HIS 165 HE2 HIS 165 7.526 -21.008 12.603 1292 H HIS 166 H HIS 166 9.552 -18.210 19.223 1293 HA HIS 166 HA HIS 166 8.210 -18.941 21.600 1294 1HB HIS 166 1HB HIS 166 9.612 -21.073 20.128 1295 2HB HIS 166 2HB HIS 166 10.052 -20.947 21.828 1296 HD1 HIS 166 HD1 HIS 166 7.464 -22.236 19.597 1297 HD2 HIS 166 HD2 HIS 166 7.770 -21.227 23.617 1298 HE1 HIS 166 HE1 HIS 166 5.493 -23.324 20.715 1299 HE2 HIS 166 HE2 HIS 166 5.749 -22.774 23.161 1300 H HIS 167 H HIS 167 11.337 -18.742 19.955 1301 HA HIS 167 HA HIS 167 12.933 -18.249 22.199 1302 1HB HIS 167 1HB HIS 167 13.311 -17.244 19.371 1303 2HB HIS 167 2HB HIS 167 14.556 -17.297 20.615 1304 HD1 HIS 167 HD1 HIS 167 12.455 -19.590 18.477 1305 HD2 HIS 167 HD2 HIS 167 15.838 -19.715 20.887 1306 HE1 HIS 167 HE1 HIS 167 13.463 -21.863 18.103 1307 HE2 HIS 167 HE2 HIS 167 15.555 -21.885 19.507 1308 H HIS 168 H HIS 168 14.206 -16.023 22.277 1309 HA HIS 168 HA HIS 168 12.575 -13.691 21.872 1310 1HB HIS 168 1HB HIS 168 11.999 -15.009 24.166 1311 2HB HIS 168 2HB HIS 168 13.304 -13.969 24.726 1312 HD1 HIS 168 HD1 HIS 168 10.663 -13.406 25.944 1313 HD2 HIS 168 HD2 HIS 168 11.817 -11.707 22.332 1314 HE1 HIS 168 HE1 HIS 168 9.247 -11.344 25.688 1315 HE2 HIS 168 HE2 HIS 168 10.024 -10.286 23.537 1316 H HIS 169 H HIS 169 15.213 -14.652 21.130 1317 HA HIS 169 HA HIS 169 17.335 -13.869 20.891 1318 1HB HIS 169 1HB HIS 169 15.956 -11.397 21.925 1319 2HB HIS 169 2HB HIS 169 17.667 -11.402 21.514 1320 HD1 HIS 169 HD1 HIS 169 14.339 -12.186 19.849 1321 HD2 HIS 169 HD2 HIS 169 18.162 -10.858 18.903 1322 HE1 HIS 169 HE1 HIS 169 14.263 -11.607 17.403 1323 HE2 HIS 169 HE2 HIS 169 16.611 -10.890 16.834 1324 H HIS 170 H HIS 170 18.708 -14.933 22.174 1325 HA HIS 170 HA HIS 170 18.623 -14.761 25.029 1326 1HB HIS 170 1HB HIS 170 19.333 -16.807 23.815 1327 2HB HIS 170 2HB HIS 170 20.766 -15.951 23.255 1328 HD1 HIS 170 HD1 HIS 170 19.203 -16.416 26.705 1329 HD2 HIS 170 HD2 HIS 170 22.856 -16.753 24.753 1330 HE1 HIS 170 HE1 HIS 170 20.847 -17.124 28.471 1331 HE2 HIS 170 HE2 HIS 170 23.066 -17.238 27.285 Start of MODEL 19 1 1H MET 1 1H MET 1 -25.902 -2.873 16.566 2 2H MET 1 2H MET 1 -26.433 -3.965 15.352 3 H MET 1 H MET 1 -26.591 -3.865 17.163 4 3H MET 1 3H MET 1 -26.970 -4.151 16.971 5 HA MET 1 HA MET 1 -27.676 -2.098 15.007 6 1HB MET 1 1HB MET 1 -28.968 -4.343 16.457 7 2HB MET 1 2HB MET 1 -29.946 -2.902 16.214 8 1HG MET 1 1HG MET 1 -29.564 -3.040 13.811 9 2HG MET 1 2HG MET 1 -28.569 -4.475 14.049 10 1HE MET 1 1HE MET 1 -30.635 -5.964 12.195 11 2HE MET 1 2HE MET 1 -30.661 -4.204 12.085 12 3HE MET 1 3HE MET 1 -32.162 -5.095 12.332 13 H ASN 2 H ASN 2 -27.254 -2.789 18.407 14 HA ASN 2 HA ASN 2 -28.217 -0.077 19.044 15 1HB ASN 2 1HB ASN 2 -28.499 -2.677 20.470 16 2HB ASN 2 2HB ASN 2 -28.296 -1.228 21.451 17 1HD2 ASN 2 1HD2 ASN 2 -30.591 -2.818 21.466 18 2HD2 ASN 2 2HD2 ASN 2 -31.905 -1.889 20.839 19 H ALA 3 H ALA 3 -26.955 1.246 20.296 20 HA ALA 3 HA ALA 3 -24.181 0.960 20.170 21 1HB ALA 3 1HB ALA 3 -25.664 3.059 20.565 22 2HB ALA 3 2HB ALA 3 -24.043 2.992 21.258 23 3HB ALA 3 3HB ALA 3 -25.450 2.665 22.270 24 H ASP 4 H ASP 4 -26.441 -0.315 22.433 25 HA ASP 4 HA ASP 4 -24.583 -0.660 24.593 26 1HB ASP 4 1HB ASP 4 -27.227 -0.582 24.595 27 2HB ASP 4 2HB ASP 4 -27.059 -2.317 24.349 28 HD2 ASP 4 HD2 ASP 4 -25.183 -2.223 27.542 29 H GLU 5 H GLU 5 -26.204 -2.941 22.382 30 HA GLU 5 HA GLU 5 -24.553 -5.134 23.128 31 1HB GLU 5 1HB GLU 5 -26.425 -4.679 20.808 32 2HB GLU 5 2HB GLU 5 -25.541 -6.182 21.032 33 1HG GLU 5 1HG GLU 5 -27.182 -6.900 22.322 34 2HG GLU 5 2HG GLU 5 -26.769 -5.646 23.489 35 HE2 GLU 5 HE2 GLU 5 -30.163 -5.375 21.663 36 H TRP 6 H TRP 6 -24.281 -2.570 20.813 37 HA TRP 6 HA TRP 6 -22.374 -3.807 19.102 38 1HB TRP 6 1HB TRP 6 -23.811 -1.789 18.554 39 2HB TRP 6 2HB TRP 6 -22.715 -0.841 19.552 40 HD1 TRP 6 HD1 TRP 6 -22.490 -3.156 16.441 41 HE1 TRP 6 HE1 TRP 6 -20.656 -2.223 14.895 42 HE3 TRP 6 HE3 TRP 6 -20.877 0.727 19.348 43 HZ2 TRP 6 HZ2 TRP 6 -18.774 -0.118 14.906 44 HZ3 TRP 6 HZ3 TRP 6 -19.056 2.153 18.507 45 HH2 TRP 6 HH2 TRP 6 -18.027 1.737 16.332 46 H MET 7 H MET 7 -22.116 -1.636 21.890 47 HA MET 7 HA MET 7 -19.291 -1.389 21.787 48 1HB MET 7 1HB MET 7 -21.449 -0.464 23.469 49 2HB MET 7 2HB MET 7 -20.098 -1.009 24.454 50 1HG MET 7 1HG MET 7 -19.453 0.731 22.157 51 2HG MET 7 2HG MET 7 -20.311 1.472 23.506 52 1HE MET 7 1HE MET 7 -18.805 3.052 23.847 53 2HE MET 7 2HE MET 7 -17.089 2.936 24.233 54 3HE MET 7 3HE MET 7 -18.295 2.723 25.503 55 H THR 8 H THR 8 -21.483 -3.608 23.416 56 HA THR 8 HA THR 8 -19.655 -4.837 25.140 57 HB THR 8 HB THR 8 -22.009 -6.152 23.772 58 HG1 THR 8 HG1 THR 8 -22.908 -4.457 24.747 59 1HG2 THR 8 1HG2 THR 8 -21.119 -7.897 24.916 60 2HG2 THR 8 2HG2 THR 8 -22.084 -7.170 26.200 61 3HG2 THR 8 3HG2 THR 8 -20.349 -6.863 26.120 62 H THR 9 H THR 9 -20.444 -5.481 21.761 63 HA THR 9 HA THR 9 -18.873 -7.838 21.541 64 HB THR 9 HB THR 9 -19.175 -7.580 19.129 65 HG1 THR 9 HG1 THR 9 -20.071 -5.739 18.279 66 1HG2 THR 9 1HG2 THR 9 -21.275 -7.793 20.954 67 2HG2 THR 9 2HG2 THR 9 -21.265 -8.278 19.258 68 3HG2 THR 9 3HG2 THR 9 -21.825 -6.667 19.711 69 H PHE 10 H PHE 10 -18.203 -4.427 21.214 70 HA PHE 10 HA PHE 10 -15.765 -4.594 19.825 71 1HB PHE 10 1HB PHE 10 -17.256 -2.530 20.458 72 2HB PHE 10 2HB PHE 10 -16.238 -2.479 21.894 73 HD1 PHE 10 HD1 PHE 10 -14.798 -0.697 21.679 74 HD2 PHE 10 HD2 PHE 10 -15.454 -3.242 18.332 75 HE1 PHE 10 HE1 PHE 10 -13.078 0.528 20.416 76 HE2 PHE 10 HE2 PHE 10 -13.736 -2.022 17.062 77 HZ PHE 10 HZ PHE 10 -12.545 -0.135 18.104 78 H ARG 11 H ARG 11 -16.545 -4.805 23.255 79 HA ARG 11 HA ARG 11 -13.942 -4.671 24.282 80 1HB ARG 11 1HB ARG 11 -16.555 -5.700 25.246 81 2HB ARG 11 2HB ARG 11 -15.119 -6.271 26.085 82 1HG ARG 11 1HG ARG 11 -14.625 -3.612 25.987 83 2HG ARG 11 2HG ARG 11 -16.386 -3.625 26.089 84 1HD ARG 11 1HD ARG 11 -15.199 -5.520 27.927 85 2HD ARG 11 2HD ARG 11 -14.582 -3.890 28.191 86 HE ARG 11 HE ARG 11 -16.651 -3.255 28.951 87 1HH1 ARG 11 1HH1 ARG 11 -16.913 -6.362 27.380 88 2HH1 ARG 11 2HH1 ARG 11 -18.539 -6.631 27.909 89 1HH2 ARG 11 1HH2 ARG 11 -18.790 -3.609 29.646 90 2HH2 ARG 11 2HH2 ARG 11 -19.605 -5.068 29.195 91 H GLU 12 H GLU 12 -15.867 -7.455 23.223 92 HA GLU 12 HA GLU 12 -13.874 -9.385 23.863 93 1HB GLU 12 1HB GLU 12 -16.499 -9.564 23.308 94 2HB GLU 12 2HB GLU 12 -15.848 -9.986 21.731 95 1HG GLU 12 1HG GLU 12 -14.482 -11.743 22.823 96 2HG GLU 12 2HG GLU 12 -15.288 -11.365 24.345 97 HE2 GLU 12 HE2 GLU 12 -17.232 -13.470 21.629 98 H ASN 13 H ASN 13 -14.583 -7.431 21.057 99 HA ASN 13 HA ASN 13 -13.102 -8.847 19.139 100 1HB ASN 13 1HB ASN 13 -14.720 -6.969 18.690 101 2HB ASN 13 2HB ASN 13 -13.476 -5.849 19.238 102 1HD2 ASN 13 1HD2 ASN 13 -14.089 -8.428 16.903 103 2HD2 ASN 13 2HD2 ASN 13 -13.070 -7.788 15.662 104 H ILE 14 H ILE 14 -12.150 -5.963 21.014 105 HA ILE 14 HA ILE 14 -9.430 -6.088 20.190 106 HB ILE 14 HB ILE 14 -9.018 -4.413 21.954 107 1HG1 ILE 14 1HG1 ILE 14 -11.960 -4.740 22.587 108 2HG1 ILE 14 2HG1 ILE 14 -10.646 -5.334 23.596 109 1HG2 ILE 14 1HG2 ILE 14 -10.307 -2.647 20.972 110 2HG2 ILE 14 2HG2 ILE 14 -11.516 -3.790 20.388 111 3HG2 ILE 14 3HG2 ILE 14 -9.891 -3.800 19.705 112 1HD1 ILE 14 1HD1 ILE 14 -10.156 -2.600 23.107 113 2HD1 ILE 14 2HD1 ILE 14 -10.587 -3.385 24.627 114 3HD1 ILE 14 3HD1 ILE 14 -11.851 -2.766 23.563 115 H ALA 15 H ALA 15 -11.221 -7.338 22.937 116 HA ALA 15 HA ALA 15 -9.063 -7.995 24.603 117 1HB ALA 15 1HB ALA 15 -11.784 -9.263 24.338 118 2HB ALA 15 2HB ALA 15 -11.294 -8.005 25.473 119 3HB ALA 15 3HB ALA 15 -10.636 -9.634 25.625 120 H GLN 16 H GLN 16 -10.621 -9.790 21.987 121 HA GLN 16 HA GLN 16 -9.045 -12.151 22.386 122 1HB GLN 16 1HB GLN 16 -11.336 -11.456 20.902 123 2HB GLN 16 2HB GLN 16 -10.133 -11.959 19.723 124 1HG GLN 16 1HG GLN 16 -9.860 -13.928 21.528 125 2HG GLN 16 2HG GLN 16 -11.560 -13.525 21.765 126 1HE2 GLN 16 1HE2 GLN 16 -9.982 -15.807 20.468 127 2HE2 GLN 16 2HE2 GLN 16 -10.783 -16.038 18.955 128 H THR 17 H THR 17 -8.823 -9.277 20.395 129 HA THR 17 HA THR 17 -6.866 -10.156 18.585 130 HB THR 17 HB THR 17 -7.155 -7.337 19.626 131 HG1 THR 17 HG1 THR 17 -8.633 -8.600 17.562 132 1HG2 THR 17 1HG2 THR 17 -6.582 -8.120 16.803 133 2HG2 THR 17 2HG2 THR 17 -5.282 -7.997 17.988 134 3HG2 THR 17 3HG2 THR 17 -6.280 -6.589 17.625 135 H TRP 18 H TRP 18 -6.562 -8.500 21.711 136 HA TRP 18 HA TRP 18 -3.704 -8.475 21.649 137 1HB TRP 18 1HB TRP 18 -5.527 -8.144 24.040 138 2HB TRP 18 2HB TRP 18 -3.843 -7.642 23.921 139 HD1 TRP 18 HD1 TRP 18 -6.977 -6.044 24.043 140 HE1 TRP 18 HE1 TRP 18 -7.054 -3.849 22.701 141 HE3 TRP 18 HE3 TRP 18 -2.825 -6.722 21.139 142 HZ2 TRP 18 HZ2 TRP 18 -5.553 -2.573 20.678 143 HZ3 TRP 18 HZ3 TRP 18 -2.214 -4.967 19.525 144 HH2 TRP 18 HH2 TRP 18 -3.551 -2.937 19.301 145 H GLN 19 H GLN 19 -6.138 -10.687 22.795 146 HA GLN 19 HA GLN 19 -4.596 -12.203 24.579 147 1HB GLN 19 1HB GLN 19 -7.191 -12.261 23.746 148 2HB GLN 19 2HB GLN 19 -6.553 -13.700 22.961 149 1HG GLN 19 1HG GLN 19 -6.534 -13.074 25.903 150 2HG GLN 19 2HG GLN 19 -7.481 -14.312 25.077 151 1HE2 GLN 19 1HE2 GLN 19 -5.605 -14.614 27.260 152 2HE2 GLN 19 2HE2 GLN 19 -4.378 -15.698 26.707 153 H GLN 20 H GLN 20 -5.403 -12.961 21.185 154 HA GLN 20 HA GLN 20 -2.864 -14.448 21.022 155 1HB GLN 20 1HB GLN 20 -5.611 -15.176 20.150 156 2HB GLN 20 2HB GLN 20 -4.283 -15.657 19.103 157 1HG GLN 20 1HG GLN 20 -3.684 -16.289 21.842 158 2HG GLN 20 2HG GLN 20 -5.235 -16.979 21.367 159 1HE2 GLN 20 1HE2 GLN 20 -2.159 -17.755 21.679 160 2HE2 GLN 20 2HE2 GLN 20 -1.963 -18.886 20.389 161 HA PRO 21 HA PRO 21 -2.566 -10.863 18.091 162 1HB PRO 21 1HB PRO 21 0.252 -11.798 18.342 163 2HB PRO 21 2HB PRO 21 -0.395 -10.153 18.366 164 1HG PRO 21 1HG PRO 21 0.391 -11.332 20.619 165 2HG PRO 21 2HG PRO 21 -1.053 -10.302 20.586 166 1HD PRO 21 1HD PRO 21 -0.846 -13.279 20.676 167 2HD PRO 21 2HD PRO 21 -2.035 -12.205 21.440 168 H GLU 22 H GLU 22 -2.135 -10.846 15.879 169 HA GLU 22 HA GLU 22 -1.995 -13.492 14.653 170 1HB GLU 22 1HB GLU 22 -2.669 -10.787 13.484 171 2HB GLU 22 2HB GLU 22 -2.671 -12.294 12.580 172 1HG GLU 22 1HG GLU 22 -4.517 -13.128 13.755 173 2HG GLU 22 2HG GLU 22 -4.357 -11.919 15.029 174 HE2 GLU 22 HE2 GLU 22 -5.517 -9.565 12.398 175 H HIS 23 H HIS 23 -0.699 -10.306 13.717 176 HA HIS 23 HA HIS 23 1.995 -11.310 13.603 177 1HB HIS 23 1HB HIS 23 0.444 -10.760 11.079 178 2HB HIS 23 2HB HIS 23 2.201 -10.681 11.129 179 HD1 HIS 23 HD1 HIS 23 -0.333 -12.921 10.198 180 HD2 HIS 23 HD2 HIS 23 3.187 -13.327 12.368 181 HE1 HIS 23 HE1 HIS 23 0.229 -15.371 10.115 182 HE2 HIS 23 HE2 HIS 23 2.316 -15.605 11.507 183 H TYR 24 H TYR 24 3.484 -9.581 12.638 184 HA TYR 24 HA TYR 24 2.469 -6.930 13.430 185 1HB TYR 24 1HB TYR 24 5.116 -8.267 13.856 186 2HB TYR 24 2HB TYR 24 5.037 -6.510 13.765 187 HD1 TYR 24 HD1 TYR 24 2.981 -5.530 15.259 188 HD2 TYR 24 HD2 TYR 24 5.087 -9.157 15.975 189 HE1 TYR 24 HE1 TYR 24 2.330 -5.434 17.628 190 HE2 TYR 24 HE2 TYR 24 4.441 -9.072 18.346 191 HH TYR 24 HH TYR 24 2.771 -8.081 19.766 192 H ASP 25 H ASP 25 2.853 -5.187 12.125 193 HA ASP 25 HA ASP 25 4.456 -5.573 9.709 194 1HB ASP 25 1HB ASP 25 1.823 -5.963 9.483 195 2HB ASP 25 2HB ASP 25 1.834 -4.207 9.352 196 HD2 ASP 25 HD2 ASP 25 3.704 -4.419 6.338 197 H LEU 26 H LEU 26 5.767 -3.901 9.412 198 HA LEU 26 HA LEU 26 5.173 -1.389 10.806 199 1HB LEU 26 1HB LEU 26 7.767 -2.405 9.645 200 2HB LEU 26 2HB LEU 26 7.567 -0.884 10.493 201 HG LEU 26 HG LEU 26 6.686 -2.444 12.429 202 1HD1 LEU 26 1HD1 LEU 26 8.049 -4.285 10.550 203 2HD1 LEU 26 2HD1 LEU 26 6.715 -4.582 11.665 204 3HD1 LEU 26 3HD1 LEU 26 8.369 -4.491 12.272 205 1HD2 LEU 26 1HD2 LEU 26 9.640 -2.431 11.921 206 2HD2 LEU 26 2HD2 LEU 26 8.773 -2.249 13.447 207 3HD2 LEU 26 3HD2 LEU 26 8.763 -0.940 12.265 208 H TYR 27 H TYR 27 5.267 0.599 9.756 209 HA TYR 27 HA TYR 27 5.310 0.476 6.813 210 1HB TYR 27 1HB TYR 27 3.102 1.061 8.371 211 2HB TYR 27 2HB TYR 27 3.709 2.654 7.931 212 HD1 TYR 27 HD1 TYR 27 4.437 2.761 5.315 213 HD2 TYR 27 HD2 TYR 27 1.499 0.176 6.984 214 HE1 TYR 27 HE1 TYR 27 3.369 2.560 3.109 215 HE2 TYR 27 HE2 TYR 27 0.424 -0.033 4.782 216 HH TYR 27 HH TYR 27 0.278 1.136 2.685 217 H ILE 28 H ILE 28 6.779 1.737 5.888 218 HA ILE 28 HA ILE 28 7.564 4.244 7.164 219 HB ILE 28 HB ILE 28 9.966 3.769 6.821 220 1HG1 ILE 28 1HG1 ILE 28 9.504 0.848 6.708 221 2HG1 ILE 28 2HG1 ILE 28 9.160 1.731 5.223 222 1HG2 ILE 28 1HG2 ILE 28 8.424 1.964 8.670 223 2HG2 ILE 28 2HG2 ILE 28 9.148 3.532 9.033 224 3HG2 ILE 28 3HG2 ILE 28 10.179 2.135 8.725 225 1HD1 ILE 28 1HD1 ILE 28 11.756 1.462 6.685 226 2HD1 ILE 28 2HD1 ILE 28 11.483 2.752 5.514 227 3HD1 ILE 28 3HD1 ILE 28 11.377 1.066 5.009 228 HA PRO 29 HA PRO 29 7.537 5.687 2.992 229 1HB PRO 29 1HB PRO 29 9.216 7.808 3.174 230 2HB PRO 29 2HB PRO 29 7.588 7.815 3.861 231 1HG PRO 29 1HG PRO 29 10.215 7.335 5.216 232 2HG PRO 29 2HG PRO 29 8.837 8.308 5.761 233 1HD PRO 29 1HD PRO 29 9.314 5.806 6.685 234 2HD PRO 29 2HD PRO 29 7.675 6.469 6.521 235 H ALA 30 H ALA 30 9.149 6.454 1.236 236 HA ALA 30 HA ALA 30 11.540 4.731 1.334 237 1HB ALA 30 1HB ALA 30 9.452 5.056 -0.732 238 2HB ALA 30 2HB ALA 30 10.412 3.642 -0.299 239 3HB ALA 30 3HB ALA 30 11.114 4.910 -1.303 240 H ILE 31 H ILE 31 10.149 7.725 0.060 241 HA ILE 31 HA ILE 31 12.888 8.748 -0.325 242 HB ILE 31 HB ILE 31 10.418 9.754 -1.732 243 1HG1 ILE 31 1HG1 ILE 31 11.783 8.593 -3.712 244 2HG1 ILE 31 2HG1 ILE 31 12.307 7.548 -2.395 245 1HG2 ILE 31 1HG2 ILE 31 12.494 10.467 -3.279 246 2HG2 ILE 31 2HG2 ILE 31 13.271 10.496 -1.697 247 3HG2 ILE 31 3HG2 ILE 31 11.842 11.486 -1.995 248 1HD1 ILE 31 1HD1 ILE 31 10.202 6.962 -3.822 249 2HD1 ILE 31 2HD1 ILE 31 9.403 8.096 -2.732 250 3HD1 ILE 31 3HD1 ILE 31 10.218 6.673 -2.082 251 H THR 32 H THR 32 13.413 10.742 0.496 252 HA THR 32 HA THR 32 11.727 11.712 2.630 253 HB THR 32 HB THR 32 13.702 13.429 2.772 254 HG1 THR 32 HG1 THR 32 15.582 12.672 1.819 255 1HG2 THR 32 1HG2 THR 32 14.989 10.941 3.366 256 2HG2 THR 32 2HG2 THR 32 13.306 10.903 3.892 257 3HG2 THR 32 3HG2 THR 32 14.380 12.181 4.462 258 H TRP 33 H TRP 33 13.399 13.401 -0.034 259 HA TRP 33 HA TRP 33 10.971 14.903 -0.604 260 1HB TRP 33 1HB TRP 33 12.991 15.988 1.028 261 2HB TRP 33 2HB TRP 33 13.185 16.755 -0.544 262 HD1 TRP 33 HD1 TRP 33 10.341 17.316 -1.492 263 HE1 TRP 33 HE1 TRP 33 8.749 18.875 -0.202 264 HE3 TRP 33 HE3 TRP 33 12.555 17.113 3.113 265 HZ2 TRP 33 HZ2 TRP 33 8.468 19.885 2.418 266 HZ3 TRP 33 HZ3 TRP 33 11.563 18.405 4.957 267 HH2 TRP 33 HH2 TRP 33 9.562 19.761 4.615 268 H HIS 34 H HIS 34 10.709 15.081 -2.729 269 HA HIS 34 HA HIS 34 12.598 14.074 -4.565 270 1HB HIS 34 1HB HIS 34 11.039 15.121 -6.287 271 2HB HIS 34 2HB HIS 34 10.319 13.943 -5.194 272 HD1 HIS 34 HD1 HIS 34 10.872 17.243 -3.681 273 HD2 HIS 34 HD2 HIS 34 7.848 15.315 -5.781 274 HE1 HIS 34 HE1 HIS 34 8.806 18.627 -3.306 275 HE2 HIS 34 HE2 HIS 34 7.009 17.490 -4.658 276 H ALA 35 H ALA 35 13.253 15.410 -6.555 277 HA ALA 35 HA ALA 35 14.845 17.617 -5.603 278 1HB ALA 35 1HB ALA 35 16.142 17.276 -7.418 279 2HB ALA 35 2HB ALA 35 14.764 17.048 -8.495 280 3HB ALA 35 3HB ALA 35 15.303 15.726 -7.459 281 H ARG 36 H ARG 36 14.486 19.736 -5.883 282 HA ARG 36 HA ARG 36 13.003 20.885 -7.975 283 1HB ARG 36 1HB ARG 36 11.432 19.890 -5.772 284 2HB ARG 36 2HB ARG 36 11.290 21.640 -5.869 285 1HG ARG 36 1HG ARG 36 10.990 20.035 -8.357 286 2HG ARG 36 2HG ARG 36 9.664 20.076 -7.193 287 1HD ARG 36 1HD ARG 36 9.110 22.175 -7.736 288 2HD ARG 36 2HD ARG 36 10.791 22.708 -7.741 289 HE ARG 36 HE ARG 36 10.778 22.515 -10.010 290 1HH1 ARG 36 1HH1 ARG 36 8.200 20.536 -8.736 291 2HH1 ARG 36 2HH1 ARG 36 7.586 20.112 -10.298 292 1HH2 ARG 36 1HH2 ARG 36 9.970 21.958 -12.065 293 2HH2 ARG 36 2HH2 ARG 36 8.591 20.919 -12.188 294 H PHE 37 H PHE 37 12.834 23.199 -7.795 295 HA PHE 37 HA PHE 37 14.973 24.306 -6.207 296 1HB PHE 37 1HB PHE 37 13.444 25.088 -8.559 297 2HB PHE 37 2HB PHE 37 13.664 26.430 -7.441 298 HD1 PHE 37 HD1 PHE 37 15.326 27.803 -8.225 299 HD2 PHE 37 HD2 PHE 37 15.865 23.586 -8.431 300 HE1 PHE 37 HE1 PHE 37 17.609 28.141 -9.080 301 HE2 PHE 37 HE2 PHE 37 18.149 23.917 -9.287 302 HZ PHE 37 HZ PHE 37 19.023 26.196 -9.612 303 H ALA 38 H ALA 38 14.467 24.453 -4.084 304 HA ALA 38 HA ALA 38 11.907 25.654 -3.319 305 1HB ALA 38 1HB ALA 38 12.588 24.932 -1.006 306 2HB ALA 38 2HB ALA 38 13.972 24.129 -1.748 307 3HB ALA 38 3HB ALA 38 12.333 23.626 -2.163 308 H TYR 39 H TYR 39 11.808 27.399 -1.838 309 HA TYR 39 HA TYR 39 14.071 29.225 -2.094 310 1HB TYR 39 1HB TYR 39 11.158 29.513 -1.648 311 2HB TYR 39 2HB TYR 39 12.178 30.696 -0.837 312 HD1 TYR 39 HD1 TYR 39 10.503 29.900 -3.836 313 HD2 TYR 39 HD2 TYR 39 13.979 31.853 -2.353 314 HE1 TYR 39 HE1 TYR 39 10.670 31.179 -5.930 315 HE2 TYR 39 HE2 TYR 39 14.155 33.138 -4.441 316 HH TYR 39 HH TYR 39 12.828 32.378 -7.187 317 H ASP 40 H ASP 40 15.572 28.851 -0.568 318 HA ASP 40 HA ASP 40 14.667 28.615 2.224 319 1HB ASP 40 1HB ASP 40 16.198 26.825 0.895 320 2HB ASP 40 2HB ASP 40 17.454 27.873 1.550 321 HD2 ASP 40 HD2 ASP 40 16.381 25.241 3.943 322 H LYS 41 H LYS 41 15.517 29.948 3.771 323 HA LYS 41 HA LYS 41 16.889 32.320 2.782 324 1HB LYS 41 1HB LYS 41 15.693 31.717 5.494 325 2HB LYS 41 2HB LYS 41 16.379 33.262 5.010 326 1HG LYS 41 1HG LYS 41 14.583 32.906 3.037 327 2HG LYS 41 2HG LYS 41 13.778 32.055 4.356 328 1HD LYS 41 1HD LYS 41 13.000 34.240 4.569 329 2HD LYS 41 2HD LYS 41 14.310 34.157 5.749 330 1HE LYS 41 1HE LYS 41 14.296 36.227 4.344 331 2HE LYS 41 2HE LYS 41 15.800 35.307 4.290 332 1HZ LYS 41 1HZ LYS 41 14.843 36.153 2.103 333 2HZ LYS 41 2HZ LYS 41 13.695 34.920 2.255 334 3HZ LYS 41 3HZ LYS 41 15.339 34.536 2.159 335 H GLU 42 H GLU 42 17.327 29.784 5.219 336 HA GLU 42 HA GLU 42 19.169 29.014 6.307 337 1HB GLU 42 1HB GLU 42 20.776 30.407 4.165 338 2HB GLU 42 2HB GLU 42 21.271 29.038 5.150 339 1HG GLU 42 1HG GLU 42 18.838 28.612 3.565 340 2HG GLU 42 2HG GLU 42 20.314 28.857 2.630 341 HE2 GLU 42 HE2 GLU 42 19.777 25.437 4.435 342 H LYS 43 H LYS 43 18.992 30.194 8.184 343 HA LYS 43 HA LYS 43 20.539 32.698 8.308 344 1HB LYS 43 1HB LYS 43 18.396 31.814 10.242 345 2HB LYS 43 2HB LYS 43 19.150 33.399 10.132 346 1HG LYS 43 1HG LYS 43 17.736 32.389 7.732 347 2HG LYS 43 2HG LYS 43 16.759 32.889 9.114 348 1HD LYS 43 1HD LYS 43 18.148 35.033 9.097 349 2HD LYS 43 2HD LYS 43 18.691 34.525 7.496 350 1HE LYS 43 1HE LYS 43 16.171 34.274 6.982 351 2HE LYS 43 2HE LYS 43 15.941 35.286 8.407 352 1HZ LYS 43 1HZ LYS 43 16.216 36.302 6.005 353 2HZ LYS 43 2HZ LYS 43 17.857 36.199 6.399 354 3HZ LYS 43 3HZ LYS 43 16.808 37.095 7.378 355 H THR 44 H THR 44 20.946 32.985 10.951 356 HA THR 44 HA THR 44 23.131 31.297 11.465 357 HB THR 44 HB THR 44 21.837 32.644 13.769 358 HG1 THR 44 HG1 THR 44 22.074 34.637 12.998 359 1HG2 THR 44 1HG2 THR 44 23.901 32.629 14.542 360 2HG2 THR 44 2HG2 THR 44 24.446 33.593 13.170 361 3HG2 THR 44 3HG2 THR 44 24.441 31.833 13.064 362 H ASP 45 H ASP 45 23.180 30.352 13.915 363 HA ASP 45 HA ASP 45 22.600 28.602 15.244 364 1HB ASP 45 1HB ASP 45 19.980 29.802 14.514 365 2HB ASP 45 2HB ASP 45 19.952 28.192 15.229 366 HD2 ASP 45 HD2 ASP 45 20.053 29.793 18.258 367 H ARG 46 H ARG 46 23.172 26.626 14.654 368 HA ARG 46 HA ARG 46 22.063 25.481 12.197 369 1HB ARG 46 1HB ARG 46 23.899 23.777 12.511 370 2HB ARG 46 2HB ARG 46 24.441 25.423 12.216 371 1HG ARG 46 1HG ARG 46 25.356 25.637 14.270 372 2HG ARG 46 2HG ARG 46 24.129 24.632 15.043 373 1HD ARG 46 1HD ARG 46 25.258 22.705 13.705 374 2HD ARG 46 2HD ARG 46 26.623 23.818 13.609 375 HE ARG 46 HE ARG 46 25.807 23.685 16.274 376 1HH1 ARG 46 1HH1 ARG 46 27.223 21.609 13.852 377 2HH1 ARG 46 2HH1 ARG 46 28.071 20.634 15.005 378 1HH2 ARG 46 1HH2 ARG 46 26.921 22.403 17.791 379 2HH2 ARG 46 2HH2 ARG 46 27.899 21.084 17.242 380 H TYR 47 H TYR 47 20.488 25.628 14.621 381 HA TYR 47 HA TYR 47 20.432 22.976 15.754 382 1HB TYR 47 1HB TYR 47 19.677 25.393 16.714 383 2HB TYR 47 2HB TYR 47 18.120 24.775 16.172 384 HD1 TYR 47 HD1 TYR 47 21.108 23.471 18.014 385 HD2 TYR 47 HD2 TYR 47 16.867 23.712 17.781 386 HE1 TYR 47 HE1 TYR 47 20.926 22.146 20.078 387 HE2 TYR 47 HE2 TYR 47 16.672 22.389 19.844 388 HH TYR 47 HH TYR 47 19.276 21.801 21.905 389 H ASN 48 H ASN 48 19.905 21.489 14.214 390 HA ASN 48 HA ASN 48 17.589 21.927 12.509 391 1HB ASN 48 1HB ASN 48 19.850 19.996 12.574 392 2HB ASN 48 2HB ASN 48 18.341 19.441 11.857 393 1HD2 ASN 48 1HD2 ASN 48 19.504 19.298 9.872 394 2HD2 ASN 48 2HD2 ASN 48 19.773 20.713 8.916 395 H GLU 49 H GLU 49 15.649 20.954 12.730 396 HA GLU 49 HA GLU 49 15.138 19.550 15.217 397 1HB GLU 49 1HB GLU 49 13.677 21.398 14.083 398 2HB GLU 49 2HB GLU 49 13.056 20.063 13.121 399 1HG GLU 49 1HG GLU 49 12.784 18.988 15.546 400 2HG GLU 49 2HG GLU 49 12.661 20.693 15.979 401 HE2 GLU 49 HE2 GLU 49 9.897 19.562 13.372 402 H ARG 50 H ARG 50 14.117 17.505 15.352 403 HA ARG 50 HA ARG 50 14.129 15.872 12.922 404 1HB ARG 50 1HB ARG 50 15.583 15.206 15.483 405 2HB ARG 50 2HB ARG 50 15.229 14.021 14.232 406 1HG ARG 50 1HG ARG 50 16.803 16.530 13.726 407 2HG ARG 50 2HG ARG 50 17.538 14.993 14.184 408 1HD ARG 50 1HD ARG 50 15.634 14.882 11.938 409 2HD ARG 50 2HD ARG 50 17.124 15.774 11.631 410 HE ARG 50 HE ARG 50 16.837 12.940 11.914 411 1HH1 ARG 50 1HH1 ARG 50 19.043 15.613 12.324 412 2HH1 ARG 50 2HH1 ARG 50 20.459 14.631 12.163 413 1HH2 ARG 50 1HH2 ARG 50 18.700 11.647 11.702 414 2HH2 ARG 50 2HH2 ARG 50 20.266 12.379 11.809 415 HA PRO 51 HA PRO 51 10.185 15.449 15.376 416 1HB PRO 51 1HB PRO 51 9.390 14.638 12.621 417 2HB PRO 51 2HB PRO 51 8.545 15.673 13.777 418 1HG PRO 51 1HG PRO 51 9.812 16.729 11.690 419 2HG PRO 51 2HG PRO 51 9.847 17.525 13.274 420 1HD PRO 51 1HD PRO 51 11.968 15.934 11.902 421 2HD PRO 51 2HD PRO 51 12.123 17.363 12.945 422 H TRP 52 H TRP 52 8.552 13.469 14.999 423 HA TRP 52 HA TRP 52 10.130 11.021 14.618 424 1HB TRP 52 1HB TRP 52 8.305 11.631 16.949 425 2HB TRP 52 2HB TRP 52 8.965 10.036 16.599 426 HD1 TRP 52 HD1 TRP 52 9.780 13.245 18.334 427 HE1 TRP 52 HE1 TRP 52 12.164 13.138 19.298 428 HE3 TRP 52 HE3 TRP 52 11.413 9.001 15.998 429 HZ2 TRP 52 HZ2 TRP 52 14.436 11.476 19.095 430 HZ3 TRP 52 HZ3 TRP 52 13.704 8.220 16.436 431 HH2 TRP 52 HH2 TRP 52 15.184 9.433 17.953 432 H GLY 53 H GLY 53 9.186 9.649 13.262 433 1HA GLY 53 1HA GLY 53 6.251 9.593 13.109 434 2HA GLY 53 2HA GLY 53 7.179 9.831 11.635 435 H GLY 54 H GLY 54 5.530 7.753 11.603 436 1HA GLY 54 1HA GLY 54 6.935 5.586 10.819 437 2HA GLY 54 2HA GLY 54 6.831 5.351 12.558 438 H GLY 55 H GLY 55 5.755 3.483 10.885 439 1HA GLY 55 1HA GLY 55 2.871 3.868 11.371 440 2HA GLY 55 2HA GLY 55 3.441 3.225 9.837 441 H PHE 56 H PHE 56 1.746 2.122 12.094 442 HA PHE 56 HA PHE 56 3.014 -0.498 12.125 443 1HB PHE 56 1HB PHE 56 2.628 1.208 14.521 444 2HB PHE 56 2HB PHE 56 2.183 -0.487 14.689 445 HD1 PHE 56 HD1 PHE 56 3.865 -2.238 14.502 446 HD2 PHE 56 HD2 PHE 56 4.915 1.877 14.245 447 HE1 PHE 56 HE1 PHE 56 6.227 -2.823 14.859 448 HE2 PHE 56 HE2 PHE 56 7.280 1.301 14.602 449 HZ PHE 56 HZ PHE 56 7.939 -1.053 14.910 450 H GLY 57 H GLY 57 1.552 -2.223 12.597 451 1HA GLY 57 1HA GLY 57 -1.118 -1.986 13.318 452 2HA GLY 57 2HA GLY 57 -1.061 -1.791 11.573 453 H LEU 58 H LEU 58 -2.445 -3.756 11.723 454 HA LEU 58 HA LEU 58 -0.738 -6.142 11.613 455 1HB LEU 58 1HB LEU 58 -3.361 -5.856 13.066 456 2HB LEU 58 2HB LEU 58 -2.714 -7.415 12.594 457 HG LEU 58 HG LEU 58 -0.605 -6.686 13.919 458 1HD1 LEU 58 1HD1 LEU 58 -0.782 -4.548 14.602 459 2HD1 LEU 58 2HD1 LEU 58 -1.683 -5.267 15.936 460 3HD1 LEU 58 3HD1 LEU 58 -2.544 -4.567 14.566 461 1HD2 LEU 58 1HD2 LEU 58 -1.943 -8.521 14.640 462 2HD2 LEU 58 2HD2 LEU 58 -3.223 -7.444 15.199 463 3HD2 LEU 58 3HD2 LEU 58 -1.673 -7.482 16.039 464 H SER 59 H SER 59 -2.155 -8.034 10.662 465 HA SER 59 HA SER 59 -3.881 -7.012 8.522 466 1HB SER 59 1HB SER 59 -2.040 -9.208 7.760 467 2HB SER 59 2HB SER 59 -2.625 -7.842 6.810 468 HG SER 59 HG SER 59 -1.090 -6.551 7.712 469 H ARG 60 H ARG 60 -5.521 -8.372 7.893 470 HA ARG 60 HA ARG 60 -5.857 -10.784 9.542 471 1HB ARG 60 1HB ARG 60 -7.542 -8.835 9.623 472 2HB ARG 60 2HB ARG 60 -8.062 -9.395 8.040 473 1HG ARG 60 1HG ARG 60 -8.868 -11.411 8.883 474 2HG ARG 60 2HG ARG 60 -7.946 -11.260 10.379 475 1HD ARG 60 1HD ARG 60 -10.232 -9.468 9.569 476 2HD ARG 60 2HD ARG 60 -10.368 -10.836 10.672 477 HE ARG 60 HE ARG 60 -8.356 -9.015 11.522 478 1HH1 ARG 60 1HH1 ARG 60 -11.813 -9.485 11.430 479 2HH1 ARG 60 2HH1 ARG 60 -12.109 -8.502 12.825 480 1HH2 ARG 60 1HH2 ARG 60 -8.744 -7.723 13.355 481 2HH2 ARG 60 2HH2 ARG 60 -10.366 -7.501 13.918 482 H TRP 61 H TRP 61 -6.361 -12.740 8.623 483 HA TRP 61 HA TRP 61 -6.065 -12.878 5.700 484 1HB TRP 61 1HB TRP 61 -5.300 -15.181 6.029 485 2HB TRP 61 2HB TRP 61 -4.320 -14.058 6.966 486 HD1 TRP 61 HD1 TRP 61 -4.980 -13.935 9.682 487 HE1 TRP 61 HE1 TRP 61 -5.697 -15.854 11.240 488 HE3 TRP 61 HE3 TRP 61 -6.459 -17.331 6.158 489 HZ2 TRP 61 HZ2 TRP 61 -6.750 -18.464 11.006 490 HZ3 TRP 61 HZ3 TRP 61 -7.307 -19.515 6.908 491 HH2 TRP 61 HH2 TRP 61 -7.449 -20.068 9.283 492 H ASP 62 H ASP 62 -7.602 -13.811 4.463 493 HA ASP 62 HA ASP 62 -10.002 -14.800 5.852 494 1HB ASP 62 1HB ASP 62 -9.896 -12.722 4.142 495 2HB ASP 62 2HB ASP 62 -10.171 -14.028 2.994 496 HD2 ASP 62 HD2 ASP 62 -13.038 -13.859 5.708 497 H GLU 63 H GLU 63 -10.662 -16.827 5.526 498 HA GLU 63 HA GLU 63 -9.033 -18.698 4.194 499 1HB GLU 63 1HB GLU 63 -10.938 -18.890 6.085 500 2HB GLU 63 2HB GLU 63 -11.866 -19.411 4.685 501 1HG GLU 63 1HG GLU 63 -9.551 -20.841 4.416 502 2HG GLU 63 2HG GLU 63 -9.767 -20.787 6.164 503 HE2 GLU 63 HE2 GLU 63 -13.108 -22.250 5.257 504 H LYS 64 H LYS 64 -11.409 -16.582 2.981 505 HA LYS 64 HA LYS 64 -12.030 -18.271 0.689 506 1HB LYS 64 1HB LYS 64 -13.761 -16.851 1.891 507 2HB LYS 64 2HB LYS 64 -12.973 -15.450 1.179 508 1HG LYS 64 1HG LYS 64 -14.474 -15.740 -0.457 509 2HG LYS 64 2HG LYS 64 -13.350 -16.979 -1.018 510 1HD LYS 64 1HD LYS 64 -14.736 -18.665 -0.462 511 2HD LYS 64 2HD LYS 64 -15.261 -17.875 1.026 512 1HE LYS 64 1HE LYS 64 -16.151 -16.669 -1.527 513 2HE LYS 64 2HE LYS 64 -16.866 -18.219 -1.084 514 1HZ LYS 64 1HZ LYS 64 -17.751 -17.326 0.870 515 2HZ LYS 64 2HZ LYS 64 -18.043 -16.136 -0.295 516 3HZ LYS 64 3HZ LYS 64 -16.775 -15.946 0.807 517 H GLY 65 H GLY 65 -9.309 -17.137 1.163 518 1HA GLY 65 1HA GLY 65 -7.615 -16.416 -0.217 519 2HA GLY 65 2HA GLY 65 -8.783 -16.359 -1.528 520 H ASN 66 H ASN 66 -8.601 -14.600 1.563 521 HA ASN 66 HA ASN 66 -8.373 -12.101 0.031 522 1HB ASN 66 1HB ASN 66 -10.676 -12.929 1.406 523 2HB ASN 66 2HB ASN 66 -9.928 -11.719 2.442 524 1HD2 ASN 66 1HD2 ASN 66 -10.641 -9.758 2.102 525 2HD2 ASN 66 2HD2 ASN 66 -11.175 -9.107 0.593 526 H TRP 67 H TRP 67 -7.425 -10.333 1.180 527 HA TRP 67 HA TRP 67 -6.092 -11.003 3.699 528 1HB TRP 67 1HB TRP 67 -4.791 -10.644 1.106 529 2HB TRP 67 2HB TRP 67 -4.146 -9.573 2.347 530 HD1 TRP 67 HD1 TRP 67 -2.660 -10.643 4.227 531 HE1 TRP 67 HE1 TRP 67 -1.685 -12.997 4.589 532 HE3 TRP 67 HE3 TRP 67 -5.363 -13.192 0.716 533 HZ2 TRP 67 HZ2 TRP 67 -2.016 -15.591 3.526 534 HZ3 TRP 67 HZ3 TRP 67 -4.973 -15.607 0.451 535 HH2 TRP 67 HH2 TRP 67 -3.333 -16.780 1.828 536 H HIS 68 H HIS 68 -7.061 -9.532 4.973 537 HA HIS 68 HA HIS 68 -7.615 -6.856 4.049 538 1HB HIS 68 1HB HIS 68 -8.857 -8.418 5.848 539 2HB HIS 68 2HB HIS 68 -7.812 -7.514 6.938 540 HD1 HIS 68 HD1 HIS 68 -8.019 -4.801 5.274 541 HD2 HIS 68 HD2 HIS 68 -11.188 -7.133 6.609 542 HE1 HIS 68 HE1 HIS 68 -9.990 -3.244 5.406 543 HE2 HIS 68 HE2 HIS 68 -11.915 -4.697 6.134 544 H GLY 69 H GLY 69 -6.313 -5.150 4.220 545 1HA GLY 69 1HA GLY 69 -3.956 -5.393 5.981 546 2HA GLY 69 2HA GLY 69 -3.981 -4.481 4.480 547 H LEU 70 H LEU 70 -4.263 -4.309 7.816 548 HA LEU 70 HA LEU 70 -5.375 -1.586 7.629 549 1HB LEU 70 1HB LEU 70 -5.892 -3.764 9.614 550 2HB LEU 70 2HB LEU 70 -5.991 -2.090 10.129 551 HG LEU 70 HG LEU 70 -7.573 -1.913 7.996 552 1HD1 LEU 70 1HD1 LEU 70 -7.441 -4.115 7.182 553 2HD1 LEU 70 2HD1 LEU 70 -9.001 -4.010 7.999 554 3HD1 LEU 70 3HD1 LEU 70 -7.642 -4.808 8.790 555 1HD2 LEU 70 1HD2 LEU 70 -9.486 -2.374 9.534 556 2HD2 LEU 70 2HD2 LEU 70 -8.273 -1.271 10.186 557 3HD2 LEU 70 3HD2 LEU 70 -8.318 -2.949 10.724 558 H TYR 71 H TYR 71 -4.136 0.003 8.413 559 HA TYR 71 HA TYR 71 -2.126 -0.556 10.438 560 1HB TYR 71 1HB TYR 71 -1.284 0.788 7.872 561 2HB TYR 71 2HB TYR 71 -0.259 0.225 9.188 562 HD1 TYR 71 HD1 TYR 71 -1.620 -0.564 6.010 563 HD2 TYR 71 HD2 TYR 71 -0.256 -2.333 9.630 564 HE1 TYR 71 HE1 TYR 71 -1.307 -2.702 4.839 565 HE2 TYR 71 HE2 TYR 71 0.063 -4.477 8.469 566 HH TYR 71 HH TYR 71 -1.263 -5.213 5.569 567 H ALA 72 H ALA 72 -1.212 1.374 11.379 568 HA ALA 72 HA ALA 72 -2.603 3.872 10.743 569 1HB ALA 72 1HB ALA 72 -3.351 4.263 12.932 570 2HB ALA 72 2HB ALA 72 -2.366 2.959 13.594 571 3HB ALA 72 3HB ALA 72 -3.777 2.583 12.606 572 H MET 73 H MET 73 -1.043 5.287 10.338 573 HA MET 73 HA MET 73 1.427 5.162 11.937 574 1HB MET 73 1HB MET 73 2.551 6.267 10.072 575 2HB MET 73 2HB MET 73 1.772 4.784 9.537 576 1HG MET 73 1HG MET 73 -0.193 6.536 9.028 577 2HG MET 73 2HG MET 73 1.208 7.588 8.833 578 1HE MET 73 1HE MET 73 0.408 6.995 5.193 579 2HE MET 73 2HE MET 73 -0.063 7.873 6.648 580 3HE MET 73 3HE MET 73 -0.948 6.426 6.166 581 H ALA 74 H ALA 74 2.409 7.150 12.586 582 HA ALA 74 HA ALA 74 0.609 9.475 12.590 583 1HB ALA 74 1HB ALA 74 0.582 9.689 14.840 584 2HB ALA 74 2HB ALA 74 2.213 9.046 15.031 585 3HB ALA 74 3HB ALA 74 0.855 7.948 14.782 586 H PHE 75 H PHE 75 1.639 11.515 12.804 587 HA PHE 75 HA PHE 75 4.559 11.526 12.537 588 1HB PHE 75 1HB PHE 75 2.583 12.746 10.616 589 2HB PHE 75 2HB PHE 75 4.239 13.330 10.738 590 HD1 PHE 75 HD1 PHE 75 2.163 10.387 9.929 591 HD2 PHE 75 HD2 PHE 75 6.022 12.170 9.727 592 HE1 PHE 75 HE1 PHE 75 2.894 8.620 8.381 593 HE2 PHE 75 HE2 PHE 75 6.760 10.406 8.178 594 HZ PHE 75 HZ PHE 75 5.195 8.628 7.502 595 H LYS 76 H LYS 76 5.546 13.578 13.014 596 HA LYS 76 HA LYS 76 4.126 14.991 15.097 597 1HB LYS 76 1HB LYS 76 6.904 14.650 14.260 598 2HB LYS 76 2HB LYS 76 6.535 16.302 14.734 599 1HG LYS 76 1HG LYS 76 5.557 14.194 16.546 600 2HG LYS 76 2HG LYS 76 7.308 14.393 16.451 601 1HD LYS 76 1HD LYS 76 7.018 16.807 16.916 602 2HD LYS 76 2HD LYS 76 5.285 16.534 17.107 603 1HE LYS 76 1HE LYS 76 5.527 15.556 19.133 604 2HE LYS 76 2HE LYS 76 7.058 14.796 18.701 605 1HZ LYS 76 1HZ LYS 76 6.716 17.678 19.334 606 2HZ LYS 76 2HZ LYS 76 8.177 16.889 19.015 607 3HZ LYS 76 3HZ LYS 76 7.302 16.514 20.413 608 H ASP 77 H ASP 77 2.564 16.268 14.212 609 HA ASP 77 HA ASP 77 2.937 17.850 11.882 610 1HB ASP 77 1HB ASP 77 0.755 17.034 13.258 611 2HB ASP 77 2HB ASP 77 0.876 18.694 13.831 612 HD2 ASP 77 HD2 ASP 77 -0.485 19.854 10.927 613 H SER 78 H SER 78 2.080 20.340 12.351 614 HA SER 78 HA SER 78 4.377 21.558 13.600 615 1HB SER 78 1HB SER 78 1.989 22.715 12.154 616 2HB SER 78 2HB SER 78 3.296 23.697 12.815 617 HG SER 78 HG SER 78 3.869 23.315 10.740 618 H TRP 79 H TRP 79 1.516 20.437 14.815 619 HA TRP 79 HA TRP 79 1.154 22.606 16.736 620 1HB TRP 79 1HB TRP 79 -0.619 20.851 15.485 621 2HB TRP 79 2HB TRP 79 -0.543 20.284 17.150 622 HD1 TRP 79 HD1 TRP 79 -3.018 21.895 15.608 623 HE1 TRP 79 HE1 TRP 79 -4.006 23.931 16.835 624 HE3 TRP 79 HE3 TRP 79 0.856 22.882 18.796 625 HZ2 TRP 79 HZ2 TRP 79 -3.244 25.718 18.882 626 HZ3 TRP 79 HZ3 TRP 79 0.647 24.773 20.357 627 HH2 TRP 79 HH2 TRP 79 -1.362 26.160 20.398 628 H ASN 80 H ASN 80 3.465 20.619 16.668 629 HA ASN 80 HA ASN 80 4.739 19.430 18.129 630 1HB ASN 80 1HB ASN 80 3.172 20.867 20.274 631 2HB ASN 80 2HB ASN 80 4.807 20.225 20.393 632 1HD2 ASN 80 1HD2 ASN 80 6.229 21.118 18.486 633 2HD2 ASN 80 2HD2 ASN 80 6.186 22.837 18.323 634 H LYS 81 H LYS 81 2.207 18.257 17.270 635 HA LYS 81 HA LYS 81 1.938 16.291 19.429 636 1HB LYS 81 1HB LYS 81 -0.324 17.673 17.989 637 2HB LYS 81 2HB LYS 81 -0.536 16.175 18.885 638 1HG LYS 81 1HG LYS 81 0.825 18.176 20.467 639 2HG LYS 81 2HG LYS 81 -0.734 18.754 19.877 640 1HD LYS 81 1HD LYS 81 -0.741 16.008 20.928 641 2HD LYS 81 2HD LYS 81 -0.394 17.262 22.120 642 1HE LYS 81 1HE LYS 81 -2.644 17.786 20.280 643 2HE LYS 81 2HE LYS 81 -2.881 16.492 21.454 644 1HZ LYS 81 1HZ LYS 81 -2.925 17.932 23.165 645 2HZ LYS 81 2HZ LYS 81 -3.369 19.049 21.975 646 3HZ LYS 81 3HZ LYS 81 -1.763 18.962 22.495 647 H TRP 82 H TRP 82 1.103 14.215 18.711 648 HA TRP 82 HA TRP 82 2.088 13.567 16.059 649 1HB TRP 82 1HB TRP 82 1.195 11.920 18.416 650 2HB TRP 82 2HB TRP 82 1.495 11.188 16.843 651 HD1 TRP 82 HD1 TRP 82 4.118 11.923 15.847 652 HE1 TRP 82 HE1 TRP 82 6.321 11.778 17.171 653 HE3 TRP 82 HE3 TRP 82 2.218 11.924 20.594 654 HZ2 TRP 82 HZ2 TRP 82 7.144 11.677 19.869 655 HZ3 TRP 82 HZ3 TRP 82 3.780 11.801 22.490 656 HH2 TRP 82 HH2 TRP 82 6.192 11.679 22.133 657 H GLU 83 H GLU 83 0.771 13.747 14.377 658 HA GLU 83 HA GLU 83 -2.085 13.725 14.669 659 1HB GLU 83 1HB GLU 83 -0.448 14.949 12.924 660 2HB GLU 83 2HB GLU 83 -0.870 13.535 11.970 661 1HG GLU 83 1HG GLU 83 -3.087 14.997 13.274 662 2HG GLU 83 2HG GLU 83 -2.281 15.783 11.916 663 HE2 GLU 83 HE2 GLU 83 -3.683 13.600 9.640 664 HA PRO 84 HA PRO 84 -2.366 9.304 14.025 665 1HB PRO 84 1HB PRO 84 -5.024 9.062 14.297 666 2HB PRO 84 2HB PRO 84 -3.978 9.402 15.681 667 1HG PRO 84 1HG PRO 84 -5.672 11.280 14.078 668 2HG PRO 84 2HG PRO 84 -5.449 11.197 15.835 669 1HD PRO 84 1HD PRO 84 -4.146 12.983 14.214 670 2HD PRO 84 2HD PRO 84 -3.507 12.409 15.766 671 H ILE 85 H ILE 85 -2.753 7.984 12.306 672 HA ILE 85 HA ILE 85 -4.373 9.023 10.087 673 HB ILE 85 HB ILE 85 -1.706 7.677 9.671 674 1HG1 ILE 85 1HG1 ILE 85 -2.289 10.605 9.248 675 2HG1 ILE 85 2HG1 ILE 85 -1.628 9.994 10.760 676 1HG2 ILE 85 1HG2 ILE 85 -2.075 7.835 7.445 677 2HG2 ILE 85 2HG2 ILE 85 -2.990 9.336 7.592 678 3HG2 ILE 85 3HG2 ILE 85 -3.761 7.792 7.959 679 1HD1 ILE 85 1HD1 ILE 85 0.074 10.891 9.215 680 2HD1 ILE 85 2HD1 ILE 85 -0.343 9.618 8.067 681 3HD1 ILE 85 3HD1 ILE 85 0.337 9.200 9.641 682 H ALA 86 H ALA 86 -5.928 7.605 9.681 683 HA ALA 86 HA ALA 86 -5.528 4.789 10.364 684 1HB ALA 86 1HB ALA 86 -8.102 4.875 9.634 685 2HB ALA 86 2HB ALA 86 -7.874 6.565 10.088 686 3HB ALA 86 3HB ALA 86 -7.547 5.285 11.257 687 H GLY 87 H GLY 87 -5.617 3.140 8.901 688 1HA GLY 87 1HA GLY 87 -6.294 3.728 6.121 689 2HA GLY 87 2HA GLY 87 -4.647 3.204 6.441 690 H TYR 88 H TYR 88 -7.172 2.042 5.076 691 HA TYR 88 HA TYR 88 -6.633 -0.677 5.871 692 1HB TYR 88 1HB TYR 88 -8.958 -1.245 6.401 693 2HB TYR 88 2HB TYR 88 -8.334 -0.038 7.519 694 HD1 TYR 88 HD1 TYR 88 -9.056 2.338 7.292 695 HD2 TYR 88 HD2 TYR 88 -10.819 -0.780 4.995 696 HE1 TYR 88 HE1 TYR 88 -10.965 3.802 6.780 697 HE2 TYR 88 HE2 TYR 88 -12.731 0.675 4.476 698 HH TYR 88 HH TYR 88 -13.289 3.024 4.390 699 H GLY 89 H GLY 89 -7.356 -2.215 4.353 700 1HA GLY 89 1HA GLY 89 -9.008 -1.535 2.136 701 2HA GLY 89 2HA GLY 89 -7.309 -1.461 1.692 702 H TRP 90 H TRP 90 -8.505 -3.187 0.235 703 HA TRP 90 HA TRP 90 -8.008 -5.811 1.482 704 1HB TRP 90 1HB TRP 90 -9.988 -5.308 -0.742 705 2HB TRP 90 2HB TRP 90 -9.786 -6.777 0.207 706 HD1 TRP 90 HD1 TRP 90 -10.216 -6.208 3.039 707 HE1 TRP 90 HE1 TRP 90 -12.259 -4.981 4.012 708 HE3 TRP 90 HE3 TRP 90 -11.770 -3.753 -1.169 709 HZ2 TRP 90 HZ2 TRP 90 -14.263 -3.207 3.115 710 HZ3 TRP 90 HZ3 TRP 90 -13.759 -2.311 -1.026 711 HH2 TRP 90 HH2 TRP 90 -14.979 -2.045 1.072 712 H GLU 91 H GLU 91 -6.938 -7.355 0.259 713 HA GLU 91 HA GLU 91 -6.174 -6.786 -2.470 714 1HB GLU 91 1HB GLU 91 -3.738 -6.961 -1.987 715 2HB GLU 91 2HB GLU 91 -4.479 -5.508 -1.333 716 1HG GLU 91 1HG GLU 91 -3.966 -6.055 0.762 717 2HG GLU 91 2HG GLU 91 -4.485 -7.726 0.547 718 HE2 GLU 91 HE2 GLU 91 -1.115 -8.274 -0.848 719 H SER 92 H SER 92 -5.212 -8.585 -3.535 720 HA SER 92 HA SER 92 -5.612 -11.127 -2.100 721 1HB SER 92 1HB SER 92 -7.117 -10.574 -4.099 722 2HB SER 92 2HB SER 92 -5.683 -10.801 -5.099 723 HG SER 92 HG SER 92 -7.313 -12.653 -4.213 724 H THR 93 H THR 93 -3.916 -12.428 -1.841 725 HA THR 93 HA THR 93 -1.448 -11.783 -3.308 726 HB THR 93 HB THR 93 -0.527 -13.322 -1.333 727 HG1 THR 93 HG1 THR 93 -2.788 -12.079 -0.166 728 1HG2 THR 93 1HG2 THR 93 -0.200 -11.307 0.064 729 2HG2 THR 93 2HG2 THR 93 -1.259 -10.423 -1.036 730 3HG2 THR 93 3HG2 THR 93 0.265 -11.087 -1.624 731 H TRP 94 H TRP 94 -0.423 -13.297 -4.506 732 HA TRP 94 HA TRP 94 -1.199 -16.094 -4.307 733 1HB TRP 94 1HB TRP 94 -1.617 -16.242 -6.763 734 2HB TRP 94 2HB TRP 94 -2.821 -15.288 -5.903 735 HD1 TRP 94 HD1 TRP 94 0.563 -14.390 -7.610 736 HE1 TRP 94 HE1 TRP 94 0.177 -12.299 -9.059 737 HE3 TRP 94 HE3 TRP 94 -4.412 -13.668 -6.682 738 HZ2 TRP 94 HZ2 TRP 94 -1.956 -10.571 -9.721 739 HZ3 TRP 94 HZ3 TRP 94 -5.550 -11.774 -7.763 740 HH2 TRP 94 HH2 TRP 94 -4.346 -10.258 -9.250 741 H ARG 95 H ARG 95 0.216 -17.517 -5.545 742 HA ARG 95 HA ARG 95 2.784 -16.275 -6.266 743 1HB ARG 95 1HB ARG 95 3.951 -18.190 -5.211 744 2HB ARG 95 2HB ARG 95 3.061 -17.211 -4.051 745 1HG ARG 95 1HG ARG 95 1.198 -19.069 -4.670 746 2HG ARG 95 2HG ARG 95 2.680 -20.008 -4.853 747 1HD ARG 95 1HD ARG 95 3.358 -19.490 -2.614 748 2HD ARG 95 2HD ARG 95 2.025 -18.352 -2.423 749 HE ARG 95 HE ARG 95 1.930 -21.164 -2.037 750 1HH1 ARG 95 1HH1 ARG 95 0.036 -18.459 -3.164 751 2HH1 ARG 95 2HH1 ARG 95 -1.481 -19.203 -2.786 752 1HH2 ARG 95 1HH2 ARG 95 -0.064 -22.145 -1.539 753 2HH2 ARG 95 2HH2 ARG 95 -1.538 -21.295 -1.864 754 HA PRO 96 HA PRO 96 2.620 -18.489 -10.070 755 1HB PRO 96 1HB PRO 96 5.457 -19.220 -9.536 756 2HB PRO 96 2HB PRO 96 4.742 -18.444 -10.953 757 1HG PRO 96 1HG PRO 96 6.158 -17.027 -9.200 758 2HG PRO 96 2HG PRO 96 4.700 -16.352 -9.951 759 1HD PRO 96 1HD PRO 96 5.088 -17.432 -7.195 760 2HD PRO 96 2HD PRO 96 4.093 -16.069 -7.744 761 H LEU 97 H LEU 97 3.697 -20.707 -10.957 762 HA LEU 97 HA LEU 97 2.818 -22.752 -9.043 763 1HB LEU 97 1HB LEU 97 1.989 -22.356 -11.573 764 2HB LEU 97 2HB LEU 97 3.317 -23.462 -11.873 765 HG LEU 97 HG LEU 97 2.147 -24.893 -10.000 766 1HD1 LEU 97 1HD1 LEU 97 -0.365 -24.650 -10.320 767 2HD1 LEU 97 2HD1 LEU 97 -0.016 -23.043 -10.956 768 3HD1 LEU 97 3HD1 LEU 97 0.432 -23.453 -9.300 769 1HD2 LEU 97 1HD2 LEU 97 0.539 -25.658 -12.000 770 2HD2 LEU 97 2HD2 LEU 97 2.264 -26.022 -11.957 771 3HD2 LEU 97 3HD2 LEU 97 1.674 -24.658 -12.907 772 H ALA 98 H ALA 98 5.456 -21.541 -8.935 773 HA ALA 98 HA ALA 98 7.143 -23.841 -9.671 774 1HB ALA 98 1HB ALA 98 7.564 -21.369 -10.498 775 2HB ALA 98 2HB ALA 98 8.901 -22.440 -10.078 776 3HB ALA 98 3HB ALA 98 8.347 -21.228 -8.924 777 H ASP 99 H ASP 99 7.184 -21.250 -7.215 778 HA ASP 99 HA ASP 99 7.369 -23.248 -5.106 779 1HB ASP 99 1HB ASP 99 9.578 -21.392 -5.878 780 2HB ASP 99 2HB ASP 99 9.332 -21.737 -4.170 781 HD2 ASP 99 HD2 ASP 99 10.160 -25.149 -4.716 782 H GLU 100 H GLU 100 7.454 -22.104 -2.903 783 HA GLU 100 HA GLU 100 5.622 -19.803 -3.014 784 1HB GLU 100 1HB GLU 100 5.992 -21.747 -0.731 785 2HB GLU 100 2HB GLU 100 4.753 -20.507 -0.873 786 1HG GLU 100 1HG GLU 100 3.734 -21.675 -2.718 787 2HG GLU 100 2HG GLU 100 5.029 -22.872 -2.714 788 HE2 GLU 100 HE2 GLU 100 3.742 -24.219 0.341 789 H ASN 101 H ASN 101 8.077 -18.969 -3.351 790 HA ASN 101 HA ASN 101 9.180 -18.275 -0.721 791 1HB ASN 101 1HB ASN 101 10.364 -18.138 -3.498 792 2HB ASN 101 2HB ASN 101 11.158 -17.477 -2.072 793 1HD2 ASN 101 1HD2 ASN 101 12.718 -18.758 -1.429 794 2HD2 ASN 101 2HD2 ASN 101 12.672 -20.484 -1.380 795 H PHE 102 H PHE 102 8.330 -16.777 -3.835 796 HA PHE 102 HA PHE 102 8.100 -14.196 -2.437 797 1HB PHE 102 1HB PHE 102 8.391 -13.147 -4.654 798 2HB PHE 102 2HB PHE 102 9.765 -14.155 -4.215 799 HD1 PHE 102 HD1 PHE 102 10.337 -16.087 -5.478 800 HD2 PHE 102 HD2 PHE 102 6.791 -13.905 -6.362 801 HE1 PHE 102 HE1 PHE 102 10.110 -17.321 -7.595 802 HE2 PHE 102 HE2 PHE 102 6.557 -15.136 -8.479 803 HZ PHE 102 HZ PHE 102 8.218 -16.846 -9.098 804 H HIS 103 H HIS 103 6.209 -13.103 -2.463 805 HA HIS 103 HA HIS 103 3.971 -14.338 -3.933 806 1HB HIS 103 1HB HIS 103 4.005 -12.955 -1.248 807 2HB HIS 103 2HB HIS 103 2.524 -13.336 -2.118 808 HD1 HIS 103 HD1 HIS 103 2.350 -14.690 0.345 809 HD2 HIS 103 HD2 HIS 103 4.758 -16.272 -2.648 810 HE1 HIS 103 HE1 HIS 103 2.656 -17.114 0.940 811 HE2 HIS 103 HE2 HIS 103 4.187 -18.029 -0.838 812 H LEU 104 H LEU 104 2.207 -12.838 -4.513 813 HA LEU 104 HA LEU 104 3.135 -10.082 -4.943 814 1HB LEU 104 1HB LEU 104 1.668 -11.696 -7.024 815 2HB LEU 104 2HB LEU 104 2.341 -10.088 -7.207 816 HG LEU 104 HG LEU 104 4.599 -11.372 -6.619 817 1HD1 LEU 104 1HD1 LEU 104 4.660 -13.587 -7.027 818 2HD1 LEU 104 2HD1 LEU 104 3.426 -13.502 -8.283 819 3HD1 LEU 104 3HD1 LEU 104 2.956 -13.498 -6.583 820 1HD2 LEU 104 1HD2 LEU 104 4.260 -10.049 -8.608 821 2HD2 LEU 104 2HD2 LEU 104 3.251 -11.311 -9.316 822 3HD2 LEU 104 3HD2 LEU 104 4.971 -11.601 -9.052 823 H GLY 105 H GLY 105 1.714 -8.628 -4.247 824 1HA GLY 105 1HA GLY 105 -1.099 -9.481 -3.941 825 2HA GLY 105 2HA GLY 105 -0.290 -8.368 -2.849 826 H LEU 106 H LEU 106 -2.750 -8.062 -4.464 827 HA LEU 106 HA LEU 106 -2.125 -5.443 -5.527 828 1HB LEU 106 1HB LEU 106 -1.794 -7.141 -7.394 829 2HB LEU 106 2HB LEU 106 -3.524 -7.419 -7.316 830 HG LEU 106 HG LEU 106 -2.472 -4.645 -7.728 831 1HD1 LEU 106 1HD1 LEU 106 -2.425 -6.899 -9.647 832 2HD1 LEU 106 2HD1 LEU 106 -1.389 -5.475 -9.539 833 3HD1 LEU 106 3HD1 LEU 106 -3.001 -5.341 -10.241 834 1HD2 LEU 106 1HD2 LEU 106 -4.773 -4.653 -7.331 835 2HD2 LEU 106 2HD2 LEU 106 -5.025 -6.121 -8.274 836 3HD2 LEU 106 3HD2 LEU 106 -4.646 -4.603 -9.088 837 H GLY 107 H GLY 107 -3.692 -4.076 -4.974 838 1HA GLY 107 1HA GLY 107 -6.455 -4.632 -5.177 839 2HA GLY 107 2HA GLY 107 -5.943 -4.842 -3.509 840 H PHE 108 H PHE 108 -7.425 -3.089 -3.041 841 HA PHE 108 HA PHE 108 -6.287 -0.450 -3.695 842 1HB PHE 108 1HB PHE 108 -9.146 -1.303 -3.257 843 2HB PHE 108 2HB PHE 108 -8.650 0.384 -3.163 844 HD1 PHE 108 HD1 PHE 108 -9.135 1.597 -5.035 845 HD2 PHE 108 HD2 PHE 108 -8.010 -2.484 -5.471 846 HE1 PHE 108 HE1 PHE 108 -9.361 1.799 -7.478 847 HE2 PHE 108 HE2 PHE 108 -8.232 -2.289 -7.914 848 HZ PHE 108 HZ PHE 108 -8.909 -0.145 -8.921 849 H THR 109 H THR 109 -6.183 1.111 -2.053 850 HA THR 109 HA THR 109 -6.675 0.148 0.680 851 HB THR 109 HB THR 109 -4.256 1.811 0.078 852 HG1 THR 109 HG1 THR 109 -4.485 -0.996 -0.198 853 1HG2 THR 109 1HG2 THR 109 -3.758 -0.184 1.990 854 2HG2 THR 109 2HG2 THR 109 -5.324 0.526 2.384 855 3HG2 THR 109 3HG2 THR 109 -3.900 1.556 2.239 856 H ALA 110 H ALA 110 -8.048 1.476 1.643 857 HA ALA 110 HA ALA 110 -8.082 4.307 0.840 858 1HB ALA 110 1HB ALA 110 -10.357 4.401 1.378 859 2HB ALA 110 2HB ALA 110 -10.283 2.925 2.341 860 3HB ALA 110 3HB ALA 110 -10.160 2.838 0.584 861 H GLY 111 H GLY 111 -7.855 5.914 2.329 862 1HA GLY 111 1HA GLY 111 -7.661 5.164 5.163 863 2HA GLY 111 2HA GLY 111 -6.304 5.987 4.409 864 H VAL 112 H VAL 112 -7.215 7.255 6.500 865 HA VAL 112 HA VAL 112 -8.509 9.604 5.363 866 HB VAL 112 HB VAL 112 -9.564 8.381 7.913 867 1HG1 VAL 112 1HG1 VAL 112 -11.031 10.413 6.321 868 2HG1 VAL 112 2HG1 VAL 112 -9.644 10.950 7.270 869 3HG1 VAL 112 3HG1 VAL 112 -10.999 10.147 8.063 870 1HG2 VAL 112 1HG2 VAL 112 -10.554 8.181 5.085 871 2HG2 VAL 112 2HG2 VAL 112 -11.643 8.016 6.463 872 3HG2 VAL 112 3HG2 VAL 112 -10.299 6.893 6.261 873 H THR 113 H THR 113 -7.792 11.484 6.225 874 HA THR 113 HA THR 113 -6.037 11.302 8.587 875 HB THR 113 HB THR 113 -4.998 13.438 7.359 876 HG1 THR 113 HG1 THR 113 -5.104 13.296 5.195 877 1HG2 THR 113 1HG2 THR 113 -3.169 12.197 6.869 878 2HG2 THR 113 2HG2 THR 113 -4.108 10.883 6.162 879 3HG2 THR 113 3HG2 THR 113 -4.009 11.052 7.915 880 H ALA 114 H ALA 114 -6.305 12.798 10.167 881 HA ALA 114 HA ALA 114 -8.243 14.960 9.680 882 1HB ALA 114 1HB ALA 114 -9.490 13.415 10.923 883 2HB ALA 114 2HB ALA 114 -8.937 14.595 12.110 884 3HB ALA 114 3HB ALA 114 -8.129 13.033 11.978 885 H ARG 115 H ARG 115 -7.440 16.904 10.088 886 HA ARG 115 HA ARG 115 -5.894 17.516 12.386 887 1HB ARG 115 1HB ARG 115 -3.852 18.287 11.067 888 2HB ARG 115 2HB ARG 115 -4.023 16.556 11.318 889 1HG ARG 115 1HG ARG 115 -4.636 16.173 9.097 890 2HG ARG 115 2HG ARG 115 -5.007 17.876 8.815 891 1HD ARG 115 1HD ARG 115 -2.965 17.629 7.755 892 2HD ARG 115 2HD ARG 115 -2.500 18.256 9.335 893 HE ARG 115 HE ARG 115 -2.378 15.580 9.681 894 1HH1 ARG 115 1HH1 ARG 115 -1.023 17.734 7.292 895 2HH1 ARG 115 2HH1 ARG 115 0.371 16.745 7.009 896 1HH2 ARG 115 1HH2 ARG 115 -0.545 14.278 9.309 897 2HH2 ARG 115 2HH2 ARG 115 0.641 14.783 8.153 898 H ASP 116 H ASP 116 -6.645 19.456 12.891 899 HA ASP 116 HA ASP 116 -6.466 21.671 11.114 900 1HB ASP 116 1HB ASP 116 -8.621 20.329 10.455 901 2HB ASP 116 2HB ASP 116 -9.301 21.086 11.893 902 HD2 ASP 116 HD2 ASP 116 -9.919 23.914 10.092 903 H ASN 117 H ASN 117 -7.573 23.653 12.126 904 HA ASN 117 HA ASN 117 -7.098 23.535 15.023 905 1HB ASN 117 1HB ASN 117 -6.696 25.616 12.940 906 2HB ASN 117 2HB ASN 117 -7.168 26.174 14.542 907 1HD2 ASN 117 1HD2 ASN 117 -5.677 26.281 16.098 908 2HD2 ASN 117 2HD2 ASN 117 -4.049 25.724 15.948 909 H TRP 118 H TRP 118 -9.094 25.586 12.893 910 HA TRP 118 HA TRP 118 -11.099 25.885 14.925 911 1HB TRP 118 1HB TRP 118 -11.173 26.690 12.008 912 2HB TRP 118 2HB TRP 118 -12.289 27.230 13.257 913 HD1 TRP 118 HD1 TRP 118 -8.542 27.524 12.339 914 HE1 TRP 118 HE1 TRP 118 -7.662 29.748 13.288 915 HE3 TRP 118 HE3 TRP 118 -12.722 29.042 14.863 916 HZ2 TRP 118 HZ2 TRP 118 -8.613 31.865 14.894 917 HZ3 TRP 118 HZ3 TRP 118 -12.654 31.178 16.080 918 HH2 TRP 118 HH2 TRP 118 -10.640 32.560 16.095 919 H ASN 119 H ASN 119 -11.416 24.737 11.564 920 HA ASN 119 HA ASN 119 -12.633 22.283 12.234 921 1HB ASN 119 1HB ASN 119 -14.465 23.813 12.955 922 2HB ASN 119 2HB ASN 119 -14.566 24.417 11.304 923 1HD2 ASN 119 1HD2 ASN 119 -15.178 21.740 13.424 924 2HD2 ASN 119 2HD2 ASN 119 -16.181 20.846 12.339 925 H TYR 120 H TYR 120 -12.865 20.976 10.453 926 HA TYR 120 HA TYR 120 -13.092 21.924 7.794 927 1HB TYR 120 1HB TYR 120 -10.624 22.428 8.578 928 2HB TYR 120 2HB TYR 120 -10.394 20.713 8.248 929 HD1 TYR 120 HD1 TYR 120 -10.112 19.938 6.042 930 HD2 TYR 120 HD2 TYR 120 -11.452 23.919 6.711 931 HE1 TYR 120 HE1 TYR 120 -9.806 20.436 3.654 932 HE2 TYR 120 HE2 TYR 120 -11.151 24.429 4.324 933 HH TYR 120 HH TYR 120 -11.010 23.301 2.204 934 H ILE 121 H ILE 121 -12.640 20.107 6.189 935 HA ILE 121 HA ILE 121 -13.730 17.649 7.320 936 HB ILE 121 HB ILE 121 -14.834 18.626 5.349 937 1HG1 ILE 121 1HG1 ILE 121 -14.414 16.450 3.839 938 2HG1 ILE 121 2HG1 ILE 121 -13.642 15.901 5.323 939 1HG2 ILE 121 1HG2 ILE 121 -12.229 18.048 3.948 940 2HG2 ILE 121 2HG2 ILE 121 -12.918 19.638 4.272 941 3HG2 ILE 121 3HG2 ILE 121 -13.726 18.538 3.156 942 1HD1 ILE 121 1HD1 ILE 121 -15.651 16.097 6.545 943 2HD1 ILE 121 2HD1 ILE 121 -16.062 15.288 5.033 944 3HD1 ILE 121 3HD1 ILE 121 -16.436 16.997 5.248 945 HA PRO 122 HA PRO 122 -9.831 15.527 7.414 946 1HB PRO 122 1HB PRO 122 -10.851 13.008 6.749 947 2HB PRO 122 2HB PRO 122 -10.702 13.667 8.380 948 1HG PRO 122 1HG PRO 122 -13.078 13.576 6.580 949 2HG PRO 122 2HG PRO 122 -12.992 13.377 8.341 950 1HD PRO 122 1HD PRO 122 -13.874 15.652 7.253 951 2HD PRO 122 2HD PRO 122 -12.865 15.670 8.716 952 H LEU 123 H LEU 123 -8.477 14.141 6.004 953 HA LEU 123 HA LEU 123 -9.061 14.693 3.173 954 1HB LEU 123 1HB LEU 123 -6.543 14.611 4.767 955 2HB LEU 123 2HB LEU 123 -6.469 14.177 3.069 956 HG LEU 123 HG LEU 123 -7.742 16.464 2.752 957 1HD1 LEU 123 1HD1 LEU 123 -8.125 17.162 4.937 958 2HD1 LEU 123 2HD1 LEU 123 -6.705 18.089 4.453 959 3HD1 LEU 123 3HD1 LEU 123 -6.522 16.668 5.479 960 1HD2 LEU 123 1HD2 LEU 123 -5.409 15.730 2.013 961 2HD2 LEU 123 2HD2 LEU 123 -4.824 16.575 3.446 962 3HD2 LEU 123 3HD2 LEU 123 -5.697 17.461 2.195 963 HA PRO 124 HA PRO 124 -9.283 10.118 3.369 964 1HB PRO 124 1HB PRO 124 -11.311 9.827 1.635 965 2HB PRO 124 2HB PRO 124 -11.590 10.291 3.319 966 1HG PRO 124 1HG PRO 124 -11.526 12.005 0.866 967 2HG PRO 124 2HG PRO 124 -12.648 12.055 2.237 968 1HD PRO 124 1HD PRO 124 -10.514 13.751 1.946 969 2HD PRO 124 2HD PRO 124 -11.222 13.313 3.512 970 H VAL 125 H VAL 125 -7.993 8.884 2.146 971 HA VAL 125 HA VAL 125 -7.711 9.512 -0.710 972 HB VAL 125 HB VAL 125 -5.369 8.801 1.056 973 1HG1 VAL 125 1HG1 VAL 125 -4.061 9.533 -0.921 974 2HG1 VAL 125 2HG1 VAL 125 -5.571 9.693 -1.816 975 3HG1 VAL 125 3HG1 VAL 125 -5.059 8.112 -1.228 976 1HG2 VAL 125 1HG2 VAL 125 -5.773 10.937 1.790 977 2HG2 VAL 125 2HG2 VAL 125 -6.506 11.440 0.267 978 3HG2 VAL 125 3HG2 VAL 125 -4.755 11.266 0.388 979 H LEU 126 H LEU 126 -8.132 7.786 -1.906 980 HA LEU 126 HA LEU 126 -7.321 5.139 -0.953 981 1HB LEU 126 1HB LEU 126 -9.508 4.212 -1.736 982 2HB LEU 126 2HB LEU 126 -9.601 5.206 -0.295 983 HG LEU 126 HG LEU 126 -10.095 6.546 -2.900 984 1HD1 LEU 126 1HD1 LEU 126 -11.349 4.193 -2.574 985 2HD1 LEU 126 2HD1 LEU 126 -12.075 5.582 -3.381 986 3HD1 LEU 126 3HD1 LEU 126 -12.449 5.250 -1.690 987 1HD2 LEU 126 1HD2 LEU 126 -11.939 7.526 -1.373 988 2HD2 LEU 126 2HD2 LEU 126 -10.260 7.992 -1.095 989 3HD2 LEU 126 3HD2 LEU 126 -11.022 6.779 -0.065 990 H LEU 127 H LEU 127 -6.102 4.245 -2.470 991 HA LEU 127 HA LEU 127 -6.915 4.392 -5.261 992 1HB LEU 127 1HB LEU 127 -4.404 5.579 -4.156 993 2HB LEU 127 2HB LEU 127 -4.378 4.864 -5.758 994 HG LEU 127 HG LEU 127 -6.373 6.985 -5.003 995 1HD1 LEU 127 1HD1 LEU 127 -3.870 7.617 -6.497 996 2HD1 LEU 127 2HD1 LEU 127 -3.852 7.596 -4.735 997 3HD1 LEU 127 3HD1 LEU 127 -4.941 8.686 -5.592 998 1HD2 LEU 127 1HD2 LEU 127 -6.997 5.848 -6.976 999 2HD2 LEU 127 2HD2 LEU 127 -5.342 5.840 -7.585 1000 3HD2 LEU 127 3HD2 LEU 127 -6.243 7.353 -7.503 1001 HA PRO 128 HA PRO 128 -5.466 0.237 -5.380 1002 1HB PRO 128 1HB PRO 128 -4.506 0.039 -7.923 1003 2HB PRO 128 2HB PRO 128 -6.229 0.075 -7.537 1004 1HG PRO 128 1HG PRO 128 -4.452 2.290 -8.480 1005 2HG PRO 128 2HG PRO 128 -6.104 1.888 -8.985 1006 1HD PRO 128 1HD PRO 128 -5.574 3.883 -7.245 1007 2HD PRO 128 2HD PRO 128 -7.049 2.899 -7.137 1008 H LEU 129 H LEU 129 -3.703 -0.717 -4.594 1009 HA LEU 129 HA LEU 129 -1.068 0.424 -5.259 1010 1HB LEU 129 1HB LEU 129 -2.216 -0.449 -2.642 1011 2HB LEU 129 2HB LEU 129 -0.493 -0.616 -2.912 1012 HG LEU 129 HG LEU 129 -0.598 1.899 -3.570 1013 1HD1 LEU 129 1HD1 LEU 129 -3.253 1.415 -2.320 1014 2HD1 LEU 129 2HD1 LEU 129 -2.802 2.500 -3.635 1015 3HD1 LEU 129 3HD1 LEU 129 -2.415 2.927 -1.968 1016 1HD2 LEU 129 1HD2 LEU 129 -0.591 0.623 -0.892 1017 2HD2 LEU 129 2HD2 LEU 129 -0.684 2.383 -0.962 1018 3HD2 LEU 129 3HD2 LEU 129 0.671 1.541 -1.715 1019 H ALA 130 H ALA 130 0.735 -1.195 -4.744 1020 HA ALA 130 HA ALA 130 -0.002 -3.980 -5.094 1021 1HB ALA 130 1HB ALA 130 0.820 -4.328 -7.192 1022 2HB ALA 130 2HB ALA 130 1.956 -2.982 -7.091 1023 3HB ALA 130 3HB ALA 130 0.244 -2.672 -7.382 1024 H SER 131 H SER 131 1.294 -5.172 -3.864 1025 HA SER 131 HA SER 131 4.013 -4.178 -3.312 1026 1HB SER 131 1HB SER 131 1.931 -5.264 -1.452 1027 2HB SER 131 2HB SER 131 3.636 -5.529 -1.085 1028 HG SER 131 HG SER 131 2.147 -3.264 -0.866 1029 H VAL 132 H VAL 132 5.554 -5.882 -2.667 1030 HA VAL 132 HA VAL 132 4.893 -8.512 -3.806 1031 HB VAL 132 HB VAL 132 7.174 -8.643 -4.760 1032 1HG1 VAL 132 1HG1 VAL 132 6.522 -7.744 -6.734 1033 2HG1 VAL 132 2HG1 VAL 132 6.062 -6.204 -6.009 1034 3HG1 VAL 132 3HG1 VAL 132 4.986 -7.595 -5.881 1035 1HG2 VAL 132 1HG2 VAL 132 7.375 -5.992 -3.485 1036 2HG2 VAL 132 2HG2 VAL 132 8.084 -6.130 -5.094 1037 3HG2 VAL 132 3HG2 VAL 132 8.621 -7.200 -3.799 1038 H GLY 133 H GLY 133 5.599 -10.238 -2.665 1039 1HA GLY 133 1HA GLY 133 6.918 -9.673 -0.117 1040 2HA GLY 133 2HA GLY 133 6.088 -11.161 -0.548 1041 H TYR 134 H TYR 134 9.060 -9.752 -0.062 1042 HA TYR 134 HA TYR 134 10.400 -12.069 -1.237 1043 1HB TYR 134 1HB TYR 134 10.621 -9.351 -2.226 1044 2HB TYR 134 2HB TYR 134 12.185 -9.964 -1.697 1045 HD1 TYR 134 HD1 TYR 134 12.482 -12.591 -2.472 1046 HD2 TYR 134 HD2 TYR 134 10.219 -9.596 -4.473 1047 HE1 TYR 134 HE1 TYR 134 12.712 -13.835 -4.581 1048 HE2 TYR 134 HE2 TYR 134 10.443 -10.831 -6.588 1049 HH TYR 134 HH TYR 134 12.640 -13.333 -7.032 1050 H GLY 135 H GLY 135 11.433 -13.006 0.393 1051 1HA GLY 135 1HA GLY 135 12.707 -13.303 2.279 1052 2HA GLY 135 2HA GLY 135 13.448 -11.757 1.890 1053 HA PRO 136 HA PRO 136 11.271 -11.075 5.868 1054 1HB PRO 136 1HB PRO 136 13.131 -9.462 6.958 1055 2HB PRO 136 2HB PRO 136 13.299 -11.222 6.956 1056 1HG PRO 136 1HG PRO 136 14.553 -9.198 5.140 1057 2HG PRO 136 2HG PRO 136 15.284 -10.621 5.903 1058 1HD PRO 136 1HD PRO 136 14.433 -10.579 3.311 1059 2HD PRO 136 2HD PRO 136 14.469 -12.050 4.302 1060 H VAL 137 H VAL 137 12.057 -9.150 3.219 1061 HA VAL 137 HA VAL 137 10.678 -6.819 4.381 1062 HB VAL 137 HB VAL 137 11.741 -5.479 2.584 1063 1HG1 VAL 137 1HG1 VAL 137 12.730 -6.051 4.961 1064 2HG1 VAL 137 2HG1 VAL 137 13.647 -5.102 3.790 1065 3HG1 VAL 137 3HG1 VAL 137 13.990 -6.820 3.995 1066 1HG2 VAL 137 1HG2 VAL 137 12.129 -7.196 0.937 1067 2HG2 VAL 137 2HG2 VAL 137 13.225 -8.045 2.026 1068 3HG2 VAL 137 3HG2 VAL 137 13.671 -6.465 1.381 1069 H THR 138 H THR 138 9.195 -5.666 3.024 1070 HA THR 138 HA THR 138 8.175 -7.180 0.724 1071 HB THR 138 HB THR 138 6.473 -6.007 2.931 1072 HG1 THR 138 HG1 THR 138 7.286 -7.919 3.644 1073 1HG2 THR 138 1HG2 THR 138 5.137 -5.821 1.042 1074 2HG2 THR 138 2HG2 THR 138 4.678 -7.377 1.734 1075 3HG2 THR 138 3HG2 THR 138 5.757 -7.315 0.340 1076 H PHE 139 H PHE 139 8.530 -5.853 -0.937 1077 HA PHE 139 HA PHE 139 8.605 -3.017 -0.700 1078 1HB PHE 139 1HB PHE 139 9.603 -4.777 -2.504 1079 2HB PHE 139 2HB PHE 139 8.203 -4.178 -3.389 1080 HD1 PHE 139 HD1 PHE 139 7.948 -1.593 -3.488 1081 HD2 PHE 139 HD2 PHE 139 11.585 -3.605 -2.582 1082 HE1 PHE 139 HE1 PHE 139 9.214 0.415 -4.136 1083 HE2 PHE 139 HE2 PHE 139 12.860 -1.601 -3.228 1084 HZ PHE 139 HZ PHE 139 11.673 0.412 -4.006 1085 H GLN 140 H GLN 140 7.162 -1.471 -1.448 1086 HA GLN 140 HA GLN 140 4.512 -2.407 -2.291 1087 1HB GLN 140 1HB GLN 140 4.541 -1.945 0.180 1088 2HB GLN 140 2HB GLN 140 4.924 -0.271 -0.195 1089 1HG GLN 140 1HG GLN 140 2.827 0.201 -0.895 1090 2HG GLN 140 2HG GLN 140 2.552 -1.422 -1.526 1091 1HE2 GLN 140 1HE2 GLN 140 3.598 -0.464 1.701 1092 2HE2 GLN 140 2HE2 GLN 140 2.228 -1.108 2.534 1093 H MET 141 H MET 141 3.196 -0.703 -3.283 1094 HA MET 141 HA MET 141 4.400 1.785 -4.018 1095 1HB MET 141 1HB MET 141 4.956 -0.481 -5.657 1096 2HB MET 141 2HB MET 141 3.887 0.589 -6.555 1097 1HG MET 141 1HG MET 141 6.110 1.930 -5.193 1098 2HG MET 141 2HG MET 141 6.584 0.806 -6.465 1099 1HE MET 141 1HE MET 141 7.702 2.384 -7.766 1100 2HE MET 141 2HE MET 141 7.346 3.989 -7.126 1101 3HE MET 141 3HE MET 141 6.987 3.612 -8.812 1102 H THR 142 H THR 142 2.991 3.099 -5.366 1103 HA THR 142 HA THR 142 0.219 2.128 -5.495 1104 HB THR 142 HB THR 142 0.880 4.948 -4.678 1105 HG1 THR 142 HG1 THR 142 1.038 4.363 -2.643 1106 1HG2 THR 142 1HG2 THR 142 -1.327 5.110 -4.947 1107 2HG2 THR 142 2HG2 THR 142 -1.418 4.238 -3.417 1108 3HG2 THR 142 3HG2 THR 142 -1.557 3.363 -4.942 1109 H TYR 143 H TYR 143 -0.675 2.410 -7.431 1110 HA TYR 143 HA TYR 143 0.082 4.681 -9.083 1111 1HB TYR 143 1HB TYR 143 0.601 3.314 -11.036 1112 2HB TYR 143 2HB TYR 143 1.686 2.915 -9.708 1113 HD1 TYR 143 HD1 TYR 143 -1.167 1.744 -11.714 1114 HD2 TYR 143 HD2 TYR 143 1.650 0.739 -8.688 1115 HE1 TYR 143 HE1 TYR 143 -1.787 -0.626 -11.931 1116 HE2 TYR 143 HE2 TYR 143 1.038 -1.634 -8.897 1117 HH TYR 143 HH TYR 143 -1.706 -2.674 -10.670 1118 H ILE 144 H ILE 144 -1.515 5.346 -10.458 1119 HA ILE 144 HA ILE 144 -4.111 4.072 -10.100 1120 HB ILE 144 HB ILE 144 -3.518 6.645 -11.553 1121 1HG1 ILE 144 1HG1 ILE 144 -4.582 7.436 -9.191 1122 2HG1 ILE 144 2HG1 ILE 144 -3.670 6.026 -8.663 1123 1HG2 ILE 144 1HG2 ILE 144 -5.987 6.939 -10.576 1124 2HG2 ILE 144 2HG2 ILE 144 -5.961 5.184 -10.756 1125 3HG2 ILE 144 3HG2 ILE 144 -5.659 6.218 -12.152 1126 1HD1 ILE 144 1HD1 ILE 144 -2.703 8.586 -9.010 1127 2HD1 ILE 144 2HD1 ILE 144 -2.115 7.710 -10.423 1128 3HD1 ILE 144 3HD1 ILE 144 -1.748 7.119 -8.802 1129 HA PRO 145 HA PRO 145 -3.448 1.857 -13.992 1130 1HB PRO 145 1HB PRO 145 -6.381 1.482 -13.594 1131 2HB PRO 145 2HB PRO 145 -5.139 0.291 -13.996 1132 1HG PRO 145 1HG PRO 145 -6.131 0.428 -11.533 1133 2HG PRO 145 2HG PRO 145 -4.406 0.118 -11.802 1134 1HD PRO 145 1HD PRO 145 -5.766 2.617 -10.907 1135 2HD PRO 145 2HD PRO 145 -4.181 1.965 -10.446 1136 H GLY 146 H GLY 146 -4.193 2.085 -16.169 1137 1HA GLY 146 1HA GLY 146 -5.586 3.109 -17.826 1138 2HA GLY 146 2HA GLY 146 -5.956 4.385 -16.675 1139 H THR 147 H THR 147 -5.423 5.920 -18.312 1140 HA THR 147 HA THR 147 -2.815 6.934 -18.119 1141 HB THR 147 HB THR 147 -2.242 5.032 -19.567 1142 HG1 THR 147 HG1 THR 147 -1.212 7.126 -19.824 1143 1HG2 THR 147 1HG2 THR 147 -4.614 5.275 -20.768 1144 2HG2 THR 147 2HG2 THR 147 -3.220 4.500 -21.521 1145 3HG2 THR 147 3HG2 THR 147 -3.613 6.174 -21.910 1146 H TYR 148 H TYR 148 -2.618 8.982 -19.032 1147 HA TYR 148 HA TYR 148 -4.857 9.979 -20.632 1148 1HB TYR 148 1HB TYR 148 -4.880 10.399 -17.951 1149 2HB TYR 148 2HB TYR 148 -3.970 11.808 -18.486 1150 HD1 TYR 148 HD1 TYR 148 -7.070 9.931 -19.420 1151 HD2 TYR 148 HD2 TYR 148 -5.170 13.713 -18.980 1152 HE1 TYR 148 HE1 TYR 148 -9.174 11.052 -20.020 1153 HE2 TYR 148 HE2 TYR 148 -7.269 14.844 -19.579 1154 HH TYR 148 HH TYR 148 -9.628 13.646 -21.127 1155 H ASN 149 H ASN 149 -1.732 10.768 -19.136 1156 HA ASN 149 HA ASN 149 -0.666 11.661 -21.638 1157 1HB ASN 149 1HB ASN 149 -2.086 13.601 -20.443 1158 2HB ASN 149 2HB ASN 149 -0.551 13.829 -19.610 1159 1HD2 ASN 149 1HD2 ASN 149 0.967 14.980 -20.586 1160 2HD2 ASN 149 2HD2 ASN 149 0.952 15.462 -22.244 1161 H ASN 150 H ASN 150 -0.097 12.408 -18.195 1162 HA ASN 150 HA ASN 150 2.676 11.517 -18.532 1163 1HB ASN 150 1HB ASN 150 1.302 13.433 -16.719 1164 2HB ASN 150 2HB ASN 150 2.696 12.574 -16.072 1165 1HD2 ASN 150 1HD2 ASN 150 2.019 15.417 -17.094 1166 2HD2 ASN 150 2HD2 ASN 150 3.402 15.818 -18.048 1167 H GLY 151 H GLY 151 -0.244 10.914 -16.673 1168 1HA GLY 151 1HA GLY 151 -0.849 8.850 -15.741 1169 2HA GLY 151 2HA GLY 151 0.814 8.309 -15.914 1170 H ASN 152 H ASN 152 0.124 11.378 -14.441 1171 HA ASN 152 HA ASN 152 0.475 12.182 -12.342 1172 1HB ASN 152 1HB ASN 152 -1.358 10.200 -12.078 1173 2HB ASN 152 2HB ASN 152 -0.097 9.613 -10.998 1174 1HD2 ASN 152 1HD2 ASN 152 -1.343 12.842 -11.778 1175 2HD2 ASN 152 2HD2 ASN 152 -1.688 13.288 -10.146 1176 H VAL 153 H VAL 153 1.475 11.180 -10.027 1177 HA VAL 153 HA VAL 153 4.179 10.346 -10.832 1178 HB VAL 153 HB VAL 153 4.876 11.235 -8.591 1179 1HG1 VAL 153 1HG1 VAL 153 3.610 13.548 -9.904 1180 2HG1 VAL 153 2HG1 VAL 153 4.595 12.520 -10.945 1181 3HG1 VAL 153 3HG1 VAL 153 5.302 13.252 -9.505 1182 1HG2 VAL 153 1HG2 VAL 153 3.371 12.698 -7.381 1183 2HG2 VAL 153 2HG2 VAL 153 2.659 11.091 -7.521 1184 3HG2 VAL 153 3HG2 VAL 153 2.093 12.400 -8.558 1185 H TYR 154 H TYR 154 4.986 8.456 -10.162 1186 HA TYR 154 HA TYR 154 3.314 6.605 -8.771 1187 1HB TYR 154 1HB TYR 154 6.144 6.488 -9.798 1188 2HB TYR 154 2HB TYR 154 5.441 5.163 -8.876 1189 HD1 TYR 154 HD1 TYR 154 4.933 7.219 -11.934 1190 HD2 TYR 154 HD2 TYR 154 4.129 3.546 -9.942 1191 HE1 TYR 154 HE1 TYR 154 3.925 6.329 -13.993 1192 HE2 TYR 154 HE2 TYR 154 3.121 2.646 -11.996 1193 HH TYR 154 HH TYR 154 3.308 3.093 -14.490 1194 H PHE 155 H PHE 155 3.367 5.942 -6.689 1195 HA PHE 155 HA PHE 155 5.172 7.407 -4.890 1196 1HB PHE 155 1HB PHE 155 2.470 6.138 -4.456 1197 2HB PHE 155 2HB PHE 155 3.490 6.657 -3.119 1198 HD1 PHE 155 HD1 PHE 155 4.019 9.046 -2.823 1199 HD2 PHE 155 HD2 PHE 155 1.263 7.702 -5.773 1200 HE1 PHE 155 HE1 PHE 155 3.129 11.331 -3.027 1201 HE2 PHE 155 HE2 PHE 155 0.369 9.984 -5.984 1202 HZ PHE 155 HZ PHE 155 1.301 11.802 -4.609 1203 H ALA 156 H ALA 156 6.520 6.363 -3.510 1204 HA ALA 156 HA ALA 156 6.657 3.435 -3.777 1205 1HB ALA 156 1HB ALA 156 9.017 3.618 -3.215 1206 2HB ALA 156 2HB ALA 156 8.846 5.360 -3.000 1207 3HB ALA 156 3HB ALA 156 8.628 4.643 -4.597 1208 H TRP 157 H TRP 157 6.475 2.165 -2.023 1209 HA TRP 157 HA TRP 157 6.661 3.376 0.639 1210 1HB TRP 157 1HB TRP 157 4.315 1.820 -0.444 1211 2HB TRP 157 2HB TRP 157 4.606 2.007 1.282 1212 HD1 TRP 157 HD1 TRP 157 3.224 3.825 -1.717 1213 HE1 TRP 157 HE1 TRP 157 2.301 6.112 -0.983 1214 HE3 TRP 157 HE3 TRP 157 5.056 3.947 3.055 1215 HZ2 TRP 157 HZ2 TRP 157 2.343 7.752 1.315 1216 HZ3 TRP 157 HZ3 TRP 157 4.570 5.911 4.455 1217 HH2 TRP 157 HH2 TRP 157 3.242 7.773 3.601 1218 H MET 158 H MET 158 6.960 1.821 2.361 1219 HA MET 158 HA MET 158 7.857 -0.828 1.464 1220 1HB MET 158 1HB MET 158 9.645 1.130 2.039 1221 2HB MET 158 2HB MET 158 9.442 0.407 3.629 1222 1HG MET 158 1HG MET 158 9.949 -1.808 2.599 1223 2HG MET 158 2HG MET 158 10.339 -0.957 1.105 1224 1HE MET 158 1HE MET 158 13.503 0.583 1.375 1225 2HE MET 158 2HE MET 158 12.472 1.685 2.289 1226 3HE MET 158 3HE MET 158 11.827 0.833 0.886 1227 H ARG 159 H ARG 159 7.746 -2.479 3.026 1228 HA ARG 159 HA ARG 159 6.655 -1.879 5.644 1229 1HB ARG 159 1HB ARG 159 4.793 -3.602 5.231 1230 2HB ARG 159 2HB ARG 159 4.576 -1.986 4.575 1231 1HG ARG 159 1HG ARG 159 4.906 -2.682 2.397 1232 2HG ARG 159 2HG ARG 159 5.777 -4.137 2.886 1233 1HD ARG 159 1HD ARG 159 2.854 -3.685 3.451 1234 2HD ARG 159 2HD ARG 159 3.444 -4.502 2.005 1235 HE ARG 159 HE ARG 159 4.446 -5.614 4.461 1236 1HH1 ARG 159 1HH1 ARG 159 1.833 -5.667 2.147 1237 2HH1 ARG 159 2HH1 ARG 159 1.339 -7.276 2.555 1238 1HH2 ARG 159 1HH2 ARG 159 3.796 -7.730 4.999 1239 2HH2 ARG 159 2HH2 ARG 159 2.452 -8.447 4.174 1240 H PHE 160 H PHE 160 7.487 -3.227 7.103 1241 HA PHE 160 HA PHE 160 8.864 -5.629 6.136 1242 1HB PHE 160 1HB PHE 160 9.127 -4.118 8.744 1243 2HB PHE 160 2HB PHE 160 10.034 -5.569 8.329 1244 HD1 PHE 160 HD1 PHE 160 9.616 -1.996 7.694 1245 HD2 PHE 160 HD2 PHE 160 11.821 -5.499 6.707 1246 HE1 PHE 160 HE1 PHE 160 11.335 -0.604 6.616 1247 HE2 PHE 160 HE2 PHE 160 13.545 -4.115 5.628 1248 HZ PHE 160 HZ PHE 160 13.304 -1.664 5.582 1249 H GLN 161 H GLN 161 8.557 -7.645 7.088 1250 HA GLN 161 HA GLN 161 6.059 -7.901 8.627 1251 1HB GLN 161 1HB GLN 161 7.302 -9.542 6.479 1252 2HB GLN 161 2HB GLN 161 6.408 -10.392 7.731 1253 1HG GLN 161 1HG GLN 161 4.679 -8.394 7.092 1254 2HG GLN 161 2HG GLN 161 5.449 -8.714 5.537 1255 1HE2 GLN 161 1HE2 GLN 161 5.196 -10.731 4.574 1256 2HE2 GLN 161 2HE2 GLN 161 3.961 -11.836 5.065 1257 H PHE 162 H PHE 162 6.124 -8.754 10.610 1258 HA PHE 162 HA PHE 162 8.590 -10.134 11.449 1259 1HB PHE 162 1HB PHE 162 7.893 -7.687 12.356 1260 2HB PHE 162 2HB PHE 162 7.037 -8.693 13.518 1261 HD1 PHE 162 HD1 PHE 162 8.158 -9.573 15.345 1262 HD2 PHE 162 HD2 PHE 162 10.389 -8.171 12.003 1263 HE1 PHE 162 HE1 PHE 162 10.245 -9.886 16.611 1264 HE2 PHE 162 HE2 PHE 162 12.479 -8.481 13.263 1265 HZ PHE 162 HZ PHE 162 12.409 -9.340 15.570 1266 H LEU 163 H LEU 163 8.365 -11.979 12.618 1267 HA LEU 163 HA LEU 163 5.787 -12.710 13.732 1268 1HB LEU 163 1HB LEU 163 5.644 -14.818 12.526 1269 2HB LEU 163 2HB LEU 163 5.603 -13.460 11.418 1270 HG LEU 163 HG LEU 163 8.222 -14.790 11.943 1271 1HD1 LEU 163 1HD1 LEU 163 5.908 -15.974 10.490 1272 2HD1 LEU 163 2HD1 LEU 163 7.146 -16.757 11.472 1273 3HD1 LEU 163 3HD1 LEU 163 7.533 -16.202 9.842 1274 1HD2 LEU 163 1HD2 LEU 163 8.866 -13.789 10.017 1275 2HD2 LEU 163 2HD2 LEU 163 7.553 -12.686 10.435 1276 3HD2 LEU 163 3HD2 LEU 163 7.284 -13.974 9.260 1277 H GLU 164 H GLU 164 5.932 -14.889 14.845 1278 HA GLU 164 HA GLU 164 8.657 -15.340 15.872 1279 1HB GLU 164 1HB GLU 164 7.659 -15.785 18.094 1280 2HB GLU 164 2HB GLU 164 7.411 -14.128 17.558 1281 1HG GLU 164 1HG GLU 164 5.137 -15.044 16.685 1282 2HG GLU 164 2HG GLU 164 5.437 -16.343 17.839 1283 HE2 GLU 164 HE2 GLU 164 5.335 -12.845 19.663 1284 H HIS 165 H HIS 165 8.962 -17.130 14.533 1285 HA HIS 165 HA HIS 165 8.155 -19.610 15.568 1286 1HB HIS 165 1HB HIS 165 6.101 -18.564 14.145 1287 2HB HIS 165 2HB HIS 165 6.961 -19.419 12.869 1288 HD1 HIS 165 HD1 HIS 165 4.848 -19.958 15.867 1289 HD2 HIS 165 HD2 HIS 165 7.033 -22.241 13.170 1290 HE1 HIS 165 HE1 HIS 165 4.097 -22.330 16.231 1291 HE2 HIS 165 HE2 HIS 165 5.369 -23.682 14.528 1292 H HIS 166 H HIS 166 9.345 -21.287 14.716 1293 HA HIS 166 HA HIS 166 11.199 -20.561 12.543 1294 1HB HIS 166 1HB HIS 166 12.038 -20.990 14.999 1295 2HB HIS 166 2HB HIS 166 11.860 -22.682 14.550 1296 HD1 HIS 166 HD1 HIS 166 12.806 -21.206 11.521 1297 HD2 HIS 166 HD2 HIS 166 14.851 -22.059 15.036 1298 HE1 HIS 166 HE1 HIS 166 15.239 -21.254 10.888 1299 HE2 HIS 166 HE2 HIS 166 16.462 -21.686 13.049 1300 H HIS 167 H HIS 167 9.780 -23.420 14.137 1301 HA HIS 167 HA HIS 167 9.003 -25.392 13.312 1302 1HB HIS 167 1HB HIS 167 7.871 -23.471 11.756 1303 2HB HIS 167 2HB HIS 167 8.700 -24.434 10.537 1304 HD1 HIS 167 HD1 HIS 167 5.508 -24.160 11.828 1305 HD2 HIS 167 HD2 HIS 167 8.043 -27.412 11.305 1306 HE1 HIS 167 HE1 HIS 167 4.012 -26.182 11.801 1307 HE2 HIS 167 HE2 HIS 167 5.576 -28.143 11.569 1308 H HIS 168 H HIS 168 11.814 -24.923 13.276 1309 HA HIS 168 HA HIS 168 12.564 -26.895 11.261 1310 1HB HIS 168 1HB HIS 168 13.009 -24.323 10.634 1311 2HB HIS 168 2HB HIS 168 14.464 -24.634 11.576 1312 HD1 HIS 168 HD1 HIS 168 12.710 -25.702 8.427 1313 HD2 HIS 168 HD2 HIS 168 16.368 -26.215 10.329 1314 HE1 HIS 168 HE1 HIS 168 14.201 -26.809 6.731 1315 HE2 HIS 168 HE2 HIS 168 16.383 -27.186 7.932 1316 H HIS 169 H HIS 169 13.382 -28.491 12.440 1317 HA HIS 169 HA HIS 169 14.618 -29.646 13.959 1318 1HB HIS 169 1HB HIS 169 16.245 -27.229 13.401 1319 2HB HIS 169 2HB HIS 169 16.680 -28.151 14.836 1320 HD1 HIS 169 HD1 HIS 169 18.275 -27.870 12.021 1321 HD2 HIS 169 HD2 HIS 169 16.147 -31.150 13.425 1322 HE1 HIS 169 HE1 HIS 169 19.233 -29.858 10.816 1323 HE2 HIS 169 HE2 HIS 169 17.989 -31.842 11.747 1324 H HIS 170 H HIS 170 13.174 -29.853 15.621 1325 HA HIS 170 HA HIS 170 13.794 -28.596 18.074 1326 1HB HIS 170 1HB HIS 170 12.372 -26.866 16.662 1327 2HB HIS 170 2HB HIS 170 11.027 -27.851 17.228 1328 HD1 HIS 170 HD1 HIS 170 13.142 -28.132 19.949 1329 HD2 HIS 170 HD2 HIS 170 10.951 -24.948 18.425 1330 HE1 HIS 170 HE1 HIS 170 12.871 -26.525 21.864 1331 HE2 HIS 170 HE2 HIS 170 11.469 -24.647 20.941 Start of MODEL 20 1 1H MET 1 1H MET 1 -8.713 9.612 33.999 2 2H MET 1 2H MET 1 -7.915 8.500 35.035 3 H MET 1 H MET 1 -8.687 8.609 35.595 4 3H MET 1 3H MET 1 -9.546 8.940 35.338 5 HA MET 1 HA MET 1 -8.451 7.298 33.170 6 1HB MET 1 1HB MET 1 -10.148 6.950 35.584 7 2HB MET 1 2HB MET 1 -10.580 5.999 34.169 8 1HG MET 1 1HG MET 1 -8.736 4.699 34.304 9 2HG MET 1 2HG MET 1 -7.733 5.996 34.951 10 1HE MET 1 1HE MET 1 -7.970 2.790 35.870 11 2HE MET 1 2HE MET 1 -7.681 3.004 37.597 12 3HE MET 1 3HE MET 1 -6.716 3.899 36.423 13 H ASN 2 H ASN 2 -10.226 6.404 31.762 14 HA ASN 2 HA ASN 2 -12.497 8.175 31.366 15 1HB ASN 2 1HB ASN 2 -10.147 8.052 29.557 16 2HB ASN 2 2HB ASN 2 -11.732 8.063 28.791 17 1HD2 ASN 2 1HD2 ASN 2 -9.305 9.913 30.208 18 2HD2 ASN 2 2HD2 ASN 2 -10.145 11.421 30.273 19 H ALA 3 H ALA 3 -14.240 7.029 30.843 20 HA ALA 3 HA ALA 3 -14.218 4.242 30.628 21 1HB ALA 3 1HB ALA 3 -16.269 4.942 31.297 22 2HB ALA 3 2HB ALA 3 -16.605 4.791 29.572 23 3HB ALA 3 3HB ALA 3 -16.241 6.372 30.264 24 H ASP 4 H ASP 4 -13.722 6.676 28.235 25 HA ASP 4 HA ASP 4 -14.416 5.050 25.975 26 1HB ASP 4 1HB ASP 4 -14.149 7.715 26.292 27 2HB ASP 4 2HB ASP 4 -12.566 7.341 25.615 28 HD2 ASP 4 HD2 ASP 4 -15.672 7.344 23.249 29 H GLU 5 H GLU 5 -11.319 6.310 27.215 30 HA GLU 5 HA GLU 5 -9.742 4.655 25.525 31 1HB GLU 5 1HB GLU 5 -9.285 6.646 27.614 32 2HB GLU 5 2HB GLU 5 -8.104 5.345 27.644 33 1HG GLU 5 1HG GLU 5 -7.483 5.773 25.372 34 2HG GLU 5 2HG GLU 5 -8.785 6.948 25.192 35 HE2 GLU 5 HE2 GLU 5 -5.603 8.060 27.305 36 H TRP 6 H TRP 6 -11.226 4.228 28.626 37 HA TRP 6 HA TRP 6 -9.598 2.031 29.468 38 1HB TRP 6 1HB TRP 6 -10.836 3.451 31.067 39 2HB TRP 6 2HB TRP 6 -12.355 2.856 30.405 40 HD1 TRP 6 HD1 TRP 6 -9.197 1.353 32.102 41 HE1 TRP 6 HE1 TRP 6 -9.960 -0.611 33.580 42 HE3 TRP 6 HE3 TRP 6 -14.189 1.395 30.996 43 HZ2 TRP 6 HZ2 TRP 6 -12.359 -1.963 34.196 44 HZ3 TRP 6 HZ3 TRP 6 -15.649 -0.268 32.072 45 HH2 TRP 6 HH2 TRP 6 -14.752 -1.912 33.639 46 H MET 7 H MET 7 -12.547 2.401 27.627 47 HA MET 7 HA MET 7 -13.226 -0.390 27.690 48 1HB MET 7 1HB MET 7 -14.333 2.069 26.489 49 2HB MET 7 2HB MET 7 -14.637 0.591 25.586 50 1HG MET 7 1HG MET 7 -15.309 -0.253 28.031 51 2HG MET 7 2HG MET 7 -15.669 1.463 28.210 52 1HE MET 7 1HE MET 7 -19.193 0.016 27.720 53 2HE MET 7 2HE MET 7 -17.908 0.362 28.876 54 3HE MET 7 3HE MET 7 -18.001 -1.224 28.110 55 H THR 8 H THR 8 -11.823 1.817 25.288 56 HA THR 8 HA THR 8 -11.563 -0.018 23.196 57 HB THR 8 HB THR 8 -11.294 2.395 22.889 58 HG1 THR 8 HG1 THR 8 -8.954 0.939 22.219 59 1HG2 THR 8 1HG2 THR 8 -8.559 2.207 24.094 60 2HG2 THR 8 2HG2 THR 8 -9.961 2.731 25.026 61 3HG2 THR 8 3HG2 THR 8 -9.458 3.644 23.604 62 H THR 9 H THR 9 -9.261 0.870 25.754 63 HA THR 9 HA THR 9 -7.141 -0.752 24.911 64 HB THR 9 HB THR 9 -6.918 1.015 26.613 65 HG1 THR 9 HG1 THR 9 -5.444 -0.073 27.823 66 1HG2 THR 9 1HG2 THR 9 -8.291 -0.893 28.490 67 2HG2 THR 9 2HG2 THR 9 -8.980 0.610 27.874 68 3HG2 THR 9 3HG2 THR 9 -7.552 0.653 28.908 69 H PHE 10 H PHE 10 -9.833 -1.439 27.114 70 HA PHE 10 HA PHE 10 -8.982 -4.064 27.773 71 1HB PHE 10 1HB PHE 10 -10.768 -2.453 28.886 72 2HB PHE 10 2HB PHE 10 -11.876 -3.332 27.837 73 HD1 PHE 10 HD1 PHE 10 -10.659 -3.220 31.034 74 HD2 PHE 10 HD2 PHE 10 -11.330 -6.010 27.892 75 HE1 PHE 10 HE1 PHE 10 -10.761 -5.044 32.681 76 HE2 PHE 10 HE2 PHE 10 -11.434 -7.840 29.533 77 HZ PHE 10 HZ PHE 10 -11.149 -7.358 31.932 78 H ARG 11 H ARG 11 -11.334 -2.806 25.430 79 HA ARG 11 HA ARG 11 -12.178 -5.310 24.453 80 1HB ARG 11 1HB ARG 11 -12.463 -2.493 23.671 81 2HB ARG 11 2HB ARG 11 -12.510 -3.618 22.319 82 1HG ARG 11 1HG ARG 11 -14.485 -4.521 22.956 83 2HG ARG 11 2HG ARG 11 -14.164 -4.293 24.675 84 1HD ARG 11 1HD ARG 11 -15.643 -2.619 24.533 85 2HD ARG 11 2HD ARG 11 -14.325 -1.718 23.788 86 HE ARG 11 HE ARG 11 -16.677 -2.772 22.485 87 1HH1 ARG 11 1HH1 ARG 11 -13.428 -1.565 22.058 88 2HH1 ARG 11 2HH1 ARG 11 -13.676 -1.130 20.401 89 1HH2 ARG 11 1HH2 ARG 11 -17.001 -2.200 20.306 90 2HH2 ARG 11 2HH2 ARG 11 -15.703 -1.489 19.407 91 H GLU 12 H GLU 12 -9.497 -3.211 23.603 92 HA GLU 12 HA GLU 12 -8.774 -4.655 21.241 93 1HB GLU 12 1HB GLU 12 -7.400 -2.559 22.907 94 2HB GLU 12 2HB GLU 12 -6.586 -3.338 21.558 95 1HG GLU 12 1HG GLU 12 -9.249 -2.279 20.943 96 2HG GLU 12 2HG GLU 12 -8.044 -1.067 21.380 97 HE2 GLU 12 HE2 GLU 12 -7.335 -1.275 17.984 98 H ASN 13 H ASN 13 -7.864 -4.769 24.626 99 HA ASN 13 HA ASN 13 -5.600 -6.443 24.325 100 1HB ASN 13 1HB ASN 13 -6.595 -5.035 26.390 101 2HB ASN 13 2HB ASN 13 -7.192 -6.634 26.822 102 1HD2 ASN 13 1HD2 ASN 13 -5.176 -4.943 28.103 103 2HD2 ASN 13 2HD2 ASN 13 -3.736 -5.896 28.173 104 H ILE 14 H ILE 14 -8.956 -7.163 25.277 105 HA ILE 14 HA ILE 14 -8.620 -9.957 25.429 106 HB ILE 14 HB ILE 14 -10.518 -8.784 26.463 107 1HG1 ILE 14 1HG1 ILE 14 -12.333 -10.375 25.598 108 2HG1 ILE 14 2HG1 ILE 14 -11.118 -10.966 24.470 109 1HG2 ILE 14 1HG2 ILE 14 -10.774 -7.363 24.249 110 2HG2 ILE 14 2HG2 ILE 14 -12.137 -7.648 25.332 111 3HG2 ILE 14 3HG2 ILE 14 -11.954 -8.618 23.870 112 1HD1 ILE 14 1HD1 ILE 14 -10.028 -12.115 26.056 113 2HD1 ILE 14 2HD1 ILE 14 -11.569 -12.013 26.908 114 3HD1 ILE 14 3HD1 ILE 14 -10.277 -10.871 27.281 115 H ALA 15 H ALA 15 -9.379 -7.803 22.770 116 HA ALA 15 HA ALA 15 -10.157 -9.863 20.948 117 1HB ALA 15 1HB ALA 15 -9.561 -6.948 20.719 118 2HB ALA 15 2HB ALA 15 -11.044 -7.827 20.347 119 3HB ALA 15 3HB ALA 15 -9.660 -7.932 19.259 120 H GLN 16 H GLN 16 -7.145 -8.329 21.829 121 HA GLN 16 HA GLN 16 -5.673 -9.346 19.584 122 1HB GLN 16 1HB GLN 16 -5.160 -7.620 21.872 123 2HB GLN 16 2HB GLN 16 -3.823 -8.720 21.563 124 1HG GLN 16 1HG GLN 16 -4.779 -7.541 19.114 125 2HG GLN 16 2HG GLN 16 -4.351 -6.304 20.294 126 1HE2 GLN 16 1HE2 GLN 16 -2.253 -5.911 20.722 127 2HE2 GLN 16 2HE2 GLN 16 -0.932 -6.747 19.987 128 H THR 17 H THR 17 -5.832 -10.156 23.045 129 HA THR 17 HA THR 17 -4.025 -12.282 23.009 130 HB THR 17 HB THR 17 -4.726 -11.369 25.107 131 HG1 THR 17 HG1 THR 17 -4.505 -13.277 25.906 132 1HG2 THR 17 1HG2 THR 17 -6.814 -10.981 25.793 133 2HG2 THR 17 2HG2 THR 17 -7.414 -12.515 25.162 134 3HG2 THR 17 3HG2 THR 17 -7.223 -11.133 24.084 135 H TRP 18 H TRP 18 -7.380 -12.120 22.064 136 HA TRP 18 HA TRP 18 -7.753 -14.966 21.955 137 1HB TRP 18 1HB TRP 18 -9.395 -12.631 21.714 138 2HB TRP 18 2HB TRP 18 -9.665 -13.661 20.312 139 HD1 TRP 18 HD1 TRP 18 -11.840 -14.928 20.791 140 HE1 TRP 18 HE1 TRP 18 -12.768 -16.311 22.754 141 HE3 TRP 18 HE3 TRP 18 -8.109 -14.118 24.191 142 HZ2 TRP 18 HZ2 TRP 18 -12.018 -16.970 25.394 143 HZ3 TRP 18 HZ3 TRP 18 -8.290 -15.161 26.413 144 HH2 TRP 18 HH2 TRP 18 -10.205 -16.557 27.000 145 H GLN 19 H GLN 19 -7.580 -12.431 19.447 146 HA GLN 19 HA GLN 19 -7.505 -14.151 17.248 147 1HB GLN 19 1HB GLN 19 -7.640 -11.479 17.526 148 2HB GLN 19 2HB GLN 19 -5.948 -11.633 17.074 149 1HG GLN 19 1HG GLN 19 -7.373 -11.225 15.140 150 2HG GLN 19 2HG GLN 19 -6.565 -12.789 15.039 151 1HE2 GLN 19 1HE2 GLN 19 -7.766 -14.663 15.185 152 2HE2 GLN 19 2HE2 GLN 19 -9.490 -14.677 15.067 153 H GLN 20 H GLN 20 -4.747 -12.411 18.703 154 HA GLN 20 HA GLN 20 -2.532 -12.908 18.832 155 1HB GLN 20 1HB GLN 20 -3.746 -15.112 19.722 156 2HB GLN 20 2HB GLN 20 -2.994 -15.799 18.288 157 1HG GLN 20 1HG GLN 20 -1.026 -15.902 19.291 158 2HG GLN 20 2HG GLN 20 -1.100 -14.197 19.733 159 1HE2 GLN 20 1HE2 GLN 20 -0.565 -17.053 21.017 160 2HE2 GLN 20 2HE2 GLN 20 -1.256 -16.857 22.588 161 HA PRO 21 HA PRO 21 -2.445 -12.875 14.150 162 1HB PRO 21 1HB PRO 21 -0.284 -10.971 14.921 163 2HB PRO 21 2HB PRO 21 -1.505 -10.834 13.649 164 1HG PRO 21 1HG PRO 21 -1.742 -9.445 15.907 165 2HG PRO 21 2HG PRO 21 -3.163 -10.167 15.129 166 1HD PRO 21 1HD PRO 21 -1.669 -11.060 17.553 167 2HD PRO 21 2HD PRO 21 -3.407 -11.140 17.204 168 H GLU 22 H GLU 22 -0.476 -13.183 12.743 169 HA GLU 22 HA GLU 22 1.266 -15.164 14.004 170 1HB GLU 22 1HB GLU 22 0.437 -14.587 11.186 171 2HB GLU 22 2HB GLU 22 1.923 -15.480 11.482 172 1HG GLU 22 1HG GLU 22 0.391 -16.945 13.007 173 2HG GLU 22 2HG GLU 22 -0.899 -16.263 12.018 174 HE2 GLU 22 HE2 GLU 22 -0.064 -18.237 9.328 175 H HIS 23 H HIS 23 1.476 -12.279 11.943 176 HA HIS 23 HA HIS 23 4.096 -11.702 13.086 177 1HB HIS 23 1HB HIS 23 3.661 -11.727 10.094 178 2HB HIS 23 2HB HIS 23 5.162 -11.373 10.943 179 HD1 HIS 23 HD1 HIS 23 3.003 -14.192 9.820 180 HD2 HIS 23 HD2 HIS 23 6.535 -13.625 11.934 181 HE1 HIS 23 HE1 HIS 23 4.065 -16.466 9.977 182 HE2 HIS 23 HE2 HIS 23 6.241 -16.083 11.187 183 H TYR 24 H TYR 24 4.239 -9.621 13.611 184 HA TYR 24 HA TYR 24 2.135 -7.804 12.870 185 1HB TYR 24 1HB TYR 24 3.712 -8.043 15.080 186 2HB TYR 24 2HB TYR 24 4.501 -6.707 14.248 187 HD1 TYR 24 HD1 TYR 24 2.352 -7.293 16.777 188 HD2 TYR 24 HD2 TYR 24 2.468 -5.098 13.135 189 HE1 TYR 24 HE1 TYR 24 0.652 -5.752 17.659 190 HE2 TYR 24 HE2 TYR 24 0.770 -3.548 14.008 191 HH TYR 24 HH TYR 24 -1.216 -3.989 16.109 192 H ASP 25 H ASP 25 2.183 -6.212 11.394 193 HA ASP 25 HA ASP 25 4.485 -6.080 9.624 194 1HB ASP 25 1HB ASP 25 1.699 -4.931 9.473 195 2HB ASP 25 2HB ASP 25 2.948 -4.549 8.292 196 HD2 ASP 25 HD2 ASP 25 1.015 -7.902 7.935 197 H LEU 26 H LEU 26 5.564 -4.148 9.079 198 HA LEU 26 HA LEU 26 5.163 -1.892 10.918 199 1HB LEU 26 1HB LEU 26 7.189 -3.612 11.304 200 2HB LEU 26 2HB LEU 26 7.948 -2.544 10.140 201 HG LEU 26 HG LEU 26 6.662 -1.523 12.664 202 1HD1 LEU 26 1HD1 LEU 26 9.278 -1.319 13.189 203 2HD1 LEU 26 2HD1 LEU 26 9.287 -2.808 12.246 204 3HD1 LEU 26 3HD1 LEU 26 8.296 -2.691 13.699 205 1HD2 LEU 26 1HD2 LEU 26 8.776 -0.311 10.893 206 2HD2 LEU 26 2HD2 LEU 26 7.937 0.456 12.242 207 3HD2 LEU 26 3HD2 LEU 26 7.054 0.049 10.770 208 H TYR 27 H TYR 27 4.979 -0.020 9.885 209 HA TYR 27 HA TYR 27 5.642 0.100 7.049 210 1HB TYR 27 1HB TYR 27 3.657 1.303 8.746 211 2HB TYR 27 2HB TYR 27 4.549 2.563 7.902 212 HD1 TYR 27 HD1 TYR 27 4.615 2.554 5.403 213 HD2 TYR 27 HD2 TYR 27 2.097 -0.075 7.606 214 HE1 TYR 27 HE1 TYR 27 3.275 2.150 3.381 215 HE2 TYR 27 HE2 TYR 27 0.752 -0.488 5.589 216 HH TYR 27 HH TYR 27 1.195 -0.358 3.022 217 H ILE 28 H ILE 28 7.592 0.773 6.475 218 HA ILE 28 HA ILE 28 8.714 3.153 7.730 219 HB ILE 28 HB ILE 28 10.977 2.051 7.851 220 1HG1 ILE 28 1HG1 ILE 28 10.677 -0.524 8.280 221 2HG1 ILE 28 2HG1 ILE 28 9.258 -0.331 7.254 222 1HG2 ILE 28 1HG2 ILE 28 9.944 2.501 9.899 223 2HG2 ILE 28 2HG2 ILE 28 10.382 0.795 9.998 224 3HG2 ILE 28 3HG2 ILE 28 8.715 1.260 9.656 225 1HD1 ILE 28 1HD1 ILE 28 11.851 0.749 6.295 226 2HD1 ILE 28 2HD1 ILE 28 10.496 0.079 5.386 227 3HD1 ILE 28 3HD1 ILE 28 11.591 -0.994 6.259 228 HA PRO 29 HA PRO 29 9.941 4.136 3.614 229 1HB PRO 29 1HB PRO 29 12.272 5.485 4.033 230 2HB PRO 29 2HB PRO 29 10.680 6.173 4.369 231 1HG PRO 29 1HG PRO 29 12.640 4.920 6.253 232 2HG PRO 29 2HG PRO 29 11.661 6.384 6.465 233 1HD PRO 29 1HD PRO 29 10.974 4.023 7.577 234 2HD PRO 29 2HD PRO 29 9.761 5.189 7.009 235 H ALA 30 H ALA 30 11.954 4.086 2.130 236 HA ALA 30 HA ALA 30 12.838 1.443 1.908 237 1HB ALA 30 1HB ALA 30 12.814 3.562 0.246 238 2HB ALA 30 2HB ALA 30 13.738 2.091 -0.054 239 3HB ALA 30 3HB ALA 30 14.529 3.501 0.650 240 H ILE 31 H ILE 31 14.972 4.248 2.452 241 HA ILE 31 HA ILE 31 16.562 2.571 4.280 242 HB ILE 31 HB ILE 31 18.577 3.843 3.461 243 1HG1 ILE 31 1HG1 ILE 31 17.098 4.402 0.933 244 2HG1 ILE 31 2HG1 ILE 31 16.886 5.523 2.274 245 1HG2 ILE 31 1HG2 ILE 31 17.120 2.051 1.525 246 2HG2 ILE 31 2HG2 ILE 31 18.221 1.552 2.809 247 3HG2 ILE 31 3HG2 ILE 31 18.832 2.459 1.425 248 1HD1 ILE 31 1HD1 ILE 31 18.754 5.882 0.470 249 2HD1 ILE 31 2HD1 ILE 31 19.646 4.758 1.495 250 3HD1 ILE 31 3HD1 ILE 31 19.037 6.270 2.167 251 H THR 32 H THR 32 18.082 3.951 5.639 252 HA THR 32 HA THR 32 17.308 6.666 6.146 253 HB THR 32 HB THR 32 16.727 6.084 8.600 254 HG1 THR 32 HG1 THR 32 16.717 4.038 8.995 255 1HG2 THR 32 1HG2 THR 32 15.124 6.819 6.694 256 2HG2 THR 32 2HG2 THR 32 14.473 6.156 8.192 257 3HG2 THR 32 3HG2 THR 32 14.589 5.140 6.755 258 H TRP 33 H TRP 33 19.290 7.487 6.315 259 HA TRP 33 HA TRP 33 21.409 7.884 7.041 260 1HB TRP 33 1HB TRP 33 20.204 6.432 9.367 261 2HB TRP 33 2HB TRP 33 21.925 6.805 9.378 262 HD1 TRP 33 HD1 TRP 33 19.185 9.163 8.027 263 HE1 TRP 33 HE1 TRP 33 19.225 11.323 9.424 264 HE3 TRP 33 HE3 TRP 33 22.645 7.797 11.534 265 HZ2 TRP 33 HZ2 TRP 33 20.549 12.318 11.711 266 HZ3 TRP 33 HZ3 TRP 33 23.242 9.411 13.292 267 HH2 TRP 33 HH2 TRP 33 22.215 11.624 13.378 268 H HIS 34 H HIS 34 22.945 6.991 5.832 269 HA HIS 34 HA HIS 34 23.587 4.151 6.274 270 1HB HIS 34 1HB HIS 34 22.469 4.935 3.995 271 2HB HIS 34 2HB HIS 34 24.127 5.386 3.613 272 HD1 HIS 34 HD1 HIS 34 22.016 2.792 2.857 273 HD2 HIS 34 HD2 HIS 34 25.807 2.867 4.556 274 HE1 HIS 34 HE1 HIS 34 22.977 0.504 2.456 275 HE2 HIS 34 HE2 HIS 34 25.304 0.599 3.418 276 H ALA 35 H ALA 35 25.150 4.933 7.815 277 HA ALA 35 HA ALA 35 27.510 6.181 6.568 278 1HB ALA 35 1HB ALA 35 27.887 7.394 8.435 279 2HB ALA 35 2HB ALA 35 27.322 6.117 9.512 280 3HB ALA 35 3HB ALA 35 26.158 7.148 8.678 281 H ARG 36 H ARG 36 29.378 5.088 6.521 282 HA ARG 36 HA ARG 36 29.440 2.450 7.809 283 1HB ARG 36 1HB ARG 36 30.681 3.591 5.350 284 2HB ARG 36 2HB ARG 36 31.537 2.303 6.188 285 1HG ARG 36 1HG ARG 36 28.808 1.547 5.940 286 2HG ARG 36 2HG ARG 36 29.385 2.096 4.367 287 1HD ARG 36 1HD ARG 36 29.689 -0.362 4.867 288 2HD ARG 36 2HD ARG 36 31.130 0.507 4.341 289 HE ARG 36 HE ARG 36 30.909 0.454 7.180 290 1HH1 ARG 36 1HH1 ARG 36 31.840 -1.470 4.421 291 2HH1 ARG 36 2HH1 ARG 36 32.943 -2.455 5.323 292 1HH2 ARG 36 1HH2 ARG 36 32.358 -0.841 8.368 293 2HH2 ARG 36 2HH2 ARG 36 33.237 -2.098 7.563 294 H PHE 37 H PHE 37 29.938 4.825 9.328 295 HA PHE 37 HA PHE 37 32.636 4.188 10.251 296 1HB PHE 37 1HB PHE 37 32.324 6.374 8.692 297 2HB PHE 37 2HB PHE 37 31.973 7.075 10.269 298 HD1 PHE 37 HD1 PHE 37 33.695 6.666 12.133 299 HD2 PHE 37 HD2 PHE 37 34.515 6.102 7.996 300 HE1 PHE 37 HE1 PHE 37 36.105 6.845 12.590 301 HE2 PHE 37 HE2 PHE 37 36.927 6.279 8.446 302 HZ PHE 37 HZ PHE 37 37.725 6.651 10.746 303 H ALA 38 H ALA 38 32.959 4.482 12.445 304 HA ALA 38 HA ALA 38 30.731 4.244 14.120 305 1HB ALA 38 1HB ALA 38 32.217 3.986 15.836 306 2HB ALA 38 2HB ALA 38 33.290 5.255 15.245 307 3HB ALA 38 3HB ALA 38 33.283 3.673 14.466 308 H TYR 39 H TYR 39 30.931 5.834 16.261 309 HA TYR 39 HA TYR 39 30.504 8.555 15.211 310 1HB TYR 39 1HB TYR 39 28.763 8.830 16.956 311 2HB TYR 39 2HB TYR 39 28.365 7.568 15.794 312 HD1 TYR 39 HD1 TYR 39 28.846 5.144 16.472 313 HD2 TYR 39 HD2 TYR 39 28.782 8.367 19.248 314 HE1 TYR 39 HE1 TYR 39 28.528 3.545 18.311 315 HE2 TYR 39 HE2 TYR 39 28.464 6.777 21.096 316 HH TYR 39 HH TYR 39 27.464 3.711 20.733 317 H ASP 40 H ASP 40 32.450 9.437 15.773 318 HA ASP 40 HA ASP 40 33.571 9.037 18.401 319 1HB ASP 40 1HB ASP 40 34.453 10.157 15.858 320 2HB ASP 40 2HB ASP 40 34.956 11.140 17.229 321 HD2 ASP 40 HD2 ASP 40 37.603 8.923 17.327 322 H LYS 41 H LYS 41 33.390 10.334 20.130 323 HA LYS 41 HA LYS 41 31.459 12.462 20.065 324 1HB LYS 41 1HB LYS 41 33.211 11.384 22.278 325 2HB LYS 41 2HB LYS 41 32.021 12.658 22.505 326 1HG LYS 41 1HG LYS 41 30.809 10.844 23.159 327 2HG LYS 41 2HG LYS 41 30.396 10.891 21.444 328 1HD LYS 41 1HD LYS 41 31.987 9.170 20.948 329 2HD LYS 41 2HD LYS 41 32.630 9.222 22.591 330 1HE LYS 41 1HE LYS 41 30.023 8.736 23.098 331 2HE LYS 41 2HE LYS 41 30.197 7.930 21.539 332 1HZ LYS 41 1HZ LYS 41 30.809 6.259 22.935 333 2HZ LYS 41 2HZ LYS 41 31.446 7.296 24.111 334 3HZ LYS 41 3HZ LYS 41 32.326 6.971 22.703 335 H GLU 42 H GLU 42 32.197 14.203 18.939 336 HA GLU 42 HA GLU 42 34.625 15.505 19.984 337 1HB GLU 42 1HB GLU 42 34.907 14.584 17.679 338 2HB GLU 42 2HB GLU 42 33.614 15.646 17.139 339 1HG GLU 42 1HG GLU 42 35.498 16.831 16.565 340 2HG GLU 42 2HG GLU 42 35.074 17.536 18.125 341 HE2 GLU 42 HE2 GLU 42 38.545 15.807 17.735 342 H LYS 43 H LYS 43 31.494 16.023 18.394 343 HA LYS 43 HA LYS 43 31.495 18.840 18.977 344 1HB LYS 43 1HB LYS 43 30.151 17.215 17.183 345 2HB LYS 43 2HB LYS 43 28.898 17.670 18.330 346 1HG LYS 43 1HG LYS 43 28.690 19.419 16.922 347 2HG LYS 43 2HG LYS 43 29.983 20.073 17.929 348 1HD LYS 43 1HD LYS 43 30.350 18.606 15.317 349 2HD LYS 43 2HD LYS 43 30.468 20.353 15.543 350 1HE LYS 43 1HE LYS 43 32.204 18.333 16.953 351 2HE LYS 43 2HE LYS 43 32.666 19.179 15.477 352 1HZ LYS 43 1HZ LYS 43 31.922 20.563 17.994 353 2HZ LYS 43 2HZ LYS 43 32.612 21.249 16.611 354 3HZ LYS 43 3HZ LYS 43 33.517 20.189 17.570 355 H THR 44 H THR 44 29.634 19.837 20.163 356 HA THR 44 HA THR 44 28.464 18.224 22.270 357 HB THR 44 HB THR 44 30.465 18.721 23.411 358 HG1 THR 44 HG1 THR 44 28.794 20.876 24.157 359 1HG2 THR 44 1HG2 THR 44 31.606 20.773 23.480 360 2HG2 THR 44 2HG2 THR 44 30.269 21.631 22.711 361 3HG2 THR 44 3HG2 THR 44 31.233 20.483 21.780 362 H ASP 45 H ASP 45 27.023 19.611 23.692 363 HA ASP 45 HA ASP 45 25.275 21.047 23.921 364 1HB ASP 45 1HB ASP 45 27.319 22.604 22.541 365 2HB ASP 45 2HB ASP 45 25.690 23.149 22.153 366 HD2 ASP 45 HD2 ASP 45 26.954 23.557 25.893 367 H ARG 46 H ARG 46 23.795 22.559 22.243 368 HA ARG 46 HA ARG 46 22.190 22.476 20.634 369 1HB ARG 46 1HB ARG 46 24.482 21.964 19.303 370 2HB ARG 46 2HB ARG 46 23.608 20.473 18.978 371 1HG ARG 46 1HG ARG 46 21.728 21.795 18.096 372 2HG ARG 46 2HG ARG 46 22.668 23.266 18.361 373 1HD ARG 46 1HD ARG 46 23.809 21.030 16.737 374 2HD ARG 46 2HD ARG 46 22.649 22.141 16.012 375 HE ARG 46 HE ARG 46 24.521 23.752 17.186 376 1HH1 ARG 46 1HH1 ARG 46 24.596 21.196 14.811 377 2HH1 ARG 46 2HH1 ARG 46 25.972 21.838 13.980 378 1HH2 ARG 46 1HH2 ARG 46 26.332 24.598 16.094 379 2HH2 ARG 46 2HH2 ARG 46 26.958 23.770 14.708 380 H TYR 47 H TYR 47 20.489 21.493 21.572 381 HA TYR 47 HA TYR 47 20.427 18.701 22.171 382 1HB TYR 47 1HB TYR 47 18.188 20.733 22.096 383 2HB TYR 47 2HB TYR 47 18.067 19.114 22.777 384 HD1 TYR 47 HD1 TYR 47 17.977 22.205 23.880 385 HD2 TYR 47 HD2 TYR 47 20.569 18.853 24.265 386 HE1 TYR 47 HE1 TYR 47 18.760 23.066 26.047 387 HE2 TYR 47 HE2 TYR 47 21.357 19.704 26.433 388 HH TYR 47 HH TYR 47 21.500 22.020 27.560 389 H ASN 48 H ASN 48 19.448 17.039 21.103 390 HA ASN 48 HA ASN 48 18.338 17.653 18.442 391 1HB ASN 48 1HB ASN 48 20.108 15.362 19.300 392 2HB ASN 48 2HB ASN 48 19.213 15.366 17.783 393 1HD2 ASN 48 1HD2 ASN 48 21.479 15.120 17.005 394 2HD2 ASN 48 2HD2 ASN 48 22.365 16.564 16.667 395 H GLU 49 H GLU 49 16.548 16.493 17.758 396 HA GLU 49 HA GLU 49 15.212 14.909 19.853 397 1HB GLU 49 1HB GLU 49 14.290 17.209 18.773 398 2HB GLU 49 2HB GLU 49 13.591 16.047 17.655 399 1HG GLU 49 1HG GLU 49 13.256 15.329 20.465 400 2HG GLU 49 2HG GLU 49 12.480 16.847 20.011 401 HE2 GLU 49 HE2 GLU 49 10.376 13.863 19.280 402 H ARG 50 H ARG 50 14.001 13.072 19.220 403 HA ARG 50 HA ARG 50 15.109 11.743 16.882 404 1HB ARG 50 1HB ARG 50 13.445 10.781 19.205 405 2HB ARG 50 2HB ARG 50 13.837 9.755 17.832 406 1HG ARG 50 1HG ARG 50 16.146 11.091 19.039 407 2HG ARG 50 2HG ARG 50 15.311 9.959 20.104 408 1HD ARG 50 1HD ARG 50 16.596 8.414 19.103 409 2HD ARG 50 2HD ARG 50 15.418 8.533 17.795 410 HE ARG 50 HE ARG 50 17.207 10.459 17.178 411 1HH1 ARG 50 1HH1 ARG 50 17.541 7.075 17.964 412 2HH1 ARG 50 2HH1 ARG 50 18.958 6.861 16.993 413 1HH2 ARG 50 1HH2 ARG 50 19.072 10.179 15.900 414 2HH2 ARG 50 2HH2 ARG 50 19.828 8.623 15.821 415 HA PRO 51 HA PRO 51 11.317 12.995 14.732 416 1HB PRO 51 1HB PRO 51 12.146 12.198 12.268 417 2HB PRO 51 2HB PRO 51 12.626 13.735 12.997 418 1HG PRO 51 1HG PRO 51 14.133 11.151 12.860 419 2HG PRO 51 2HG PRO 51 14.719 12.803 12.593 420 1HD PRO 51 1HD PRO 51 15.123 11.487 14.917 421 2HD PRO 51 2HD PRO 51 14.885 13.245 14.853 422 H TRP 52 H TRP 52 9.631 11.864 13.648 423 HA TRP 52 HA TRP 52 9.779 8.943 13.988 424 1HB TRP 52 1HB TRP 52 7.569 10.916 14.408 425 2HB TRP 52 2HB TRP 52 7.165 9.263 13.961 426 HD1 TRP 52 HD1 TRP 52 9.394 7.777 15.714 427 HE1 TRP 52 HE1 TRP 52 9.126 7.699 18.272 428 HE3 TRP 52 HE3 TRP 52 6.225 11.743 16.318 429 HZ2 TRP 52 HZ2 TRP 52 7.752 9.130 20.281 430 HZ3 TRP 52 HZ3 TRP 52 5.482 12.323 18.590 431 HH2 TRP 52 HH2 TRP 52 6.230 11.042 20.530 432 H GLY 53 H GLY 53 7.874 7.916 12.564 433 1HA GLY 53 1HA GLY 53 6.950 8.790 10.202 434 2HA GLY 53 2HA GLY 53 8.644 8.510 9.830 435 H GLY 54 H GLY 54 5.563 7.088 10.306 436 1HA GLY 54 1HA GLY 54 5.520 4.899 8.974 437 2HA GLY 54 2HA GLY 54 6.726 4.384 10.144 438 H GLY 55 H GLY 55 5.278 2.655 10.701 439 1HA GLY 55 1HA GLY 55 3.846 3.064 13.042 440 2HA GLY 55 2HA GLY 55 2.675 3.134 11.734 441 H PHE 56 H PHE 56 1.682 1.259 12.666 442 HA PHE 56 HA PHE 56 3.008 -1.213 11.806 443 1HB PHE 56 1HB PHE 56 1.472 -1.032 14.398 444 2HB PHE 56 2HB PHE 56 2.448 -2.375 13.815 445 HD1 PHE 56 HD1 PHE 56 4.955 -2.011 13.587 446 HD2 PHE 56 HD2 PHE 56 2.401 0.622 15.745 447 HE1 PHE 56 HE1 PHE 56 6.902 -1.122 14.800 448 HE2 PHE 56 HE2 PHE 56 4.344 1.516 16.961 449 HZ PHE 56 HZ PHE 56 6.598 0.644 16.489 450 H GLY 57 H GLY 57 1.334 -3.095 11.952 451 1HA GLY 57 1HA GLY 57 -1.426 -2.507 11.731 452 2HA GLY 57 2HA GLY 57 -0.710 -2.577 10.128 453 H LEU 58 H LEU 58 -2.659 -4.333 10.657 454 HA LEU 58 HA LEU 58 -1.204 -6.874 10.962 455 1HB LEU 58 1HB LEU 58 -4.063 -6.420 11.803 456 2HB LEU 58 2HB LEU 58 -3.099 -7.863 12.057 457 HG LEU 58 HG LEU 58 -1.564 -6.160 13.403 458 1HD1 LEU 58 1HD1 LEU 58 -4.276 -4.997 13.930 459 2HD1 LEU 58 2HD1 LEU 58 -3.182 -4.292 12.741 460 3HD1 LEU 58 3HD1 LEU 58 -2.697 -4.397 14.432 461 1HD2 LEU 58 1HD2 LEU 58 -2.283 -7.256 15.240 462 2HD2 LEU 58 2HD2 LEU 58 -3.157 -8.223 14.053 463 3HD2 LEU 58 3HD2 LEU 58 -3.983 -6.921 14.910 464 H SER 59 H SER 59 -2.760 -8.726 10.106 465 HA SER 59 HA SER 59 -4.219 -7.891 7.728 466 1HB SER 59 1HB SER 59 -1.629 -8.414 7.334 467 2HB SER 59 2HB SER 59 -2.236 -10.069 7.287 468 HG SER 59 HG SER 59 -3.107 -9.680 5.414 469 H ARG 60 H ARG 60 -5.485 -9.618 6.779 470 HA ARG 60 HA ARG 60 -5.764 -12.047 8.368 471 1HB ARG 60 1HB ARG 60 -8.235 -11.734 8.511 472 2HB ARG 60 2HB ARG 60 -7.318 -10.581 9.471 473 1HG ARG 60 1HG ARG 60 -7.697 -8.843 7.888 474 2HG ARG 60 2HG ARG 60 -8.389 -9.977 6.727 475 1HD ARG 60 1HD ARG 60 -10.183 -8.785 7.769 476 2HD ARG 60 2HD ARG 60 -10.204 -10.444 8.366 477 HE ARG 60 HE ARG 60 -8.742 -9.146 10.228 478 1HH1 ARG 60 1HH1 ARG 60 -11.870 -8.528 8.809 479 2HH1 ARG 60 2HH1 ARG 60 -12.498 -7.756 10.226 480 1HH2 ARG 60 1HH2 ARG 60 -9.568 -8.132 12.092 481 2HH2 ARG 60 2HH2 ARG 60 -11.192 -7.530 12.089 482 H TRP 61 H TRP 61 -6.806 -13.753 7.281 483 HA TRP 61 HA TRP 61 -6.787 -13.451 4.375 484 1HB TRP 61 1HB TRP 61 -6.959 -15.982 4.432 485 2HB TRP 61 2HB TRP 61 -5.488 -15.299 5.117 486 HD1 TRP 61 HD1 TRP 61 -5.125 -15.548 7.748 487 HE1 TRP 61 HE1 TRP 61 -6.223 -17.072 9.506 488 HE3 TRP 61 HE3 TRP 61 -9.192 -17.090 5.061 489 HZ2 TRP 61 HZ2 TRP 61 -8.510 -18.712 9.726 490 HZ3 TRP 61 HZ3 TRP 61 -10.787 -18.637 6.119 491 HH2 TRP 61 HH2 TRP 61 -10.451 -19.431 8.403 492 H ASP 62 H ASP 62 -8.539 -13.788 3.082 493 HA ASP 62 HA ASP 62 -11.118 -14.175 4.454 494 1HB ASP 62 1HB ASP 62 -10.501 -11.938 3.206 495 2HB ASP 62 2HB ASP 62 -10.932 -12.863 1.770 496 HD2 ASP 62 HD2 ASP 62 -13.879 -12.296 4.379 497 H GLU 63 H GLU 63 -12.279 -15.894 3.923 498 HA GLU 63 HA GLU 63 -11.386 -17.974 2.355 499 1HB GLU 63 1HB GLU 63 -13.698 -18.831 2.430 500 2HB GLU 63 2HB GLU 63 -13.144 -18.260 3.998 501 1HG GLU 63 1HG GLU 63 -14.346 -16.123 3.567 502 2HG GLU 63 2HG GLU 63 -15.011 -16.852 2.106 503 HE2 GLU 63 HE2 GLU 63 -16.754 -17.599 5.488 504 H LYS 64 H LYS 64 -12.949 -15.062 1.336 505 HA LYS 64 HA LYS 64 -13.653 -16.146 -1.268 506 1HB LYS 64 1HB LYS 64 -14.878 -14.287 0.201 507 2HB LYS 64 2HB LYS 64 -13.805 -13.229 -0.705 508 1HG LYS 64 1HG LYS 64 -15.127 -15.150 -2.422 509 2HG LYS 64 2HG LYS 64 -16.276 -14.166 -1.514 510 1HD LYS 64 1HD LYS 64 -13.976 -12.800 -2.815 511 2HD LYS 64 2HD LYS 64 -15.294 -13.371 -3.841 512 1HE LYS 64 1HE LYS 64 -16.205 -11.371 -3.359 513 2HE LYS 64 2HE LYS 64 -16.689 -12.169 -1.863 514 1HZ LYS 64 1HZ LYS 64 -15.650 -10.408 -0.955 515 2HZ LYS 64 2HZ LYS 64 -14.673 -10.125 -2.307 516 3HZ LYS 64 3HZ LYS 64 -14.257 -11.336 -1.202 517 H GLY 65 H GLY 65 -10.810 -15.940 -0.370 518 1HA GLY 65 1HA GLY 65 -8.785 -15.436 -1.316 519 2HA GLY 65 2HA GLY 65 -9.670 -15.149 -2.807 520 H ASN 66 H ASN 66 -9.719 -13.474 0.332 521 HA ASN 66 HA ASN 66 -8.761 -11.055 -1.039 522 1HB ASN 66 1HB ASN 66 -11.299 -11.455 0.433 523 2HB ASN 66 2HB ASN 66 -10.433 -9.964 0.785 524 1HD2 ASN 66 1HD2 ASN 66 -11.495 -8.431 -0.262 525 2HD2 ASN 66 2HD2 ASN 66 -11.908 -8.460 -1.939 526 H TRP 67 H TRP 67 -7.172 -10.018 -0.008 527 HA TRP 67 HA TRP 67 -6.547 -10.862 2.740 528 1HB TRP 67 1HB TRP 67 -4.904 -10.308 0.366 529 2HB TRP 67 2HB TRP 67 -4.293 -9.580 1.848 530 HD1 TRP 67 HD1 TRP 67 -5.708 -13.101 0.974 531 HE1 TRP 67 HE1 TRP 67 -4.139 -14.855 2.017 532 HE3 TRP 67 HE3 TRP 67 -2.302 -9.960 3.133 533 HZ2 TRP 67 HZ2 TRP 67 -1.772 -14.900 3.554 534 HZ3 TRP 67 HZ3 TRP 67 -0.415 -10.939 4.372 535 HH2 TRP 67 HH2 TRP 67 -0.158 -13.358 4.578 536 H HIS 68 H HIS 68 -7.604 -9.426 4.011 537 HA HIS 68 HA HIS 68 -7.691 -6.617 3.399 538 1HB HIS 68 1HB HIS 68 -8.554 -8.191 5.832 539 2HB HIS 68 2HB HIS 68 -8.787 -6.455 5.657 540 HD1 HIS 68 HD1 HIS 68 -9.286 -8.168 2.491 541 HD2 HIS 68 HD2 HIS 68 -11.599 -7.279 5.825 542 HE1 HIS 68 HE1 HIS 68 -11.672 -8.455 1.749 543 HE2 HIS 68 HE2 HIS 68 -13.050 -7.996 3.808 544 H GLY 69 H GLY 69 -6.507 -4.981 4.274 545 1HA GLY 69 1HA GLY 69 -4.480 -5.700 6.290 546 2HA GLY 69 2HA GLY 69 -4.008 -4.848 4.827 547 H LEU 70 H LEU 70 -4.647 -4.426 7.996 548 HA LEU 70 HA LEU 70 -5.476 -1.628 7.583 549 1HB LEU 70 1HB LEU 70 -6.667 -1.676 9.674 550 2HB LEU 70 2HB LEU 70 -7.253 -2.968 8.644 551 HG LEU 70 HG LEU 70 -5.414 -4.342 10.035 552 1HD1 LEU 70 1HD1 LEU 70 -5.129 -2.032 11.315 553 2HD1 LEU 70 2HD1 LEU 70 -4.983 -3.587 12.133 554 3HD1 LEU 70 3HD1 LEU 70 -6.488 -2.673 12.236 555 1HD2 LEU 70 1HD2 LEU 70 -7.995 -3.897 11.434 556 2HD2 LEU 70 2HD2 LEU 70 -7.187 -5.401 10.998 557 3HD2 LEU 70 3HD2 LEU 70 -8.047 -4.475 9.768 558 H TYR 71 H TYR 71 -3.963 -0.220 8.140 559 HA TYR 71 HA TYR 71 -2.243 -0.786 10.439 560 1HB TYR 71 1HB TYR 71 -0.230 -0.121 9.221 561 2HB TYR 71 2HB TYR 71 -0.982 -1.517 8.455 562 HD1 TYR 71 HD1 TYR 71 -0.145 2.019 8.104 563 HD2 TYR 71 HD2 TYR 71 -2.088 -1.299 6.283 564 HE1 TYR 71 HE1 TYR 71 -0.179 3.224 5.961 565 HE2 TYR 71 HE2 TYR 71 -2.126 -0.104 4.134 566 HH TYR 71 HH TYR 71 -2.048 2.230 3.324 567 H ALA 72 H ALA 72 -1.047 1.156 11.169 568 HA ALA 72 HA ALA 72 -2.319 3.677 10.365 569 1HB ALA 72 1HB ALA 72 -1.797 3.349 13.255 570 2HB ALA 72 2HB ALA 72 -3.160 2.449 12.590 571 3HB ALA 72 3HB ALA 72 -3.097 4.204 12.425 572 H MET 73 H MET 73 -0.801 5.077 9.801 573 HA MET 73 HA MET 73 1.822 4.929 11.139 574 1HB MET 73 1HB MET 73 2.708 5.974 9.011 575 2HB MET 73 2HB MET 73 2.157 4.310 8.874 576 1HG MET 73 1HG MET 73 0.476 4.836 7.481 577 2HG MET 73 2HG MET 73 0.135 6.363 8.294 578 1HE MET 73 1HE MET 73 3.588 5.438 5.600 579 2HE MET 73 2HE MET 73 2.086 5.191 4.709 580 3HE MET 73 3HE MET 73 2.359 4.341 6.230 581 H ALA 74 H ALA 74 3.040 7.099 10.882 582 HA ALA 74 HA ALA 74 1.290 9.423 11.007 583 1HB ALA 74 1HB ALA 74 2.099 10.141 13.182 584 2HB ALA 74 2HB ALA 74 3.077 8.679 13.320 585 3HB ALA 74 3HB ALA 74 1.318 8.563 13.306 586 H PHE 75 H PHE 75 2.299 11.331 10.488 587 HA PHE 75 HA PHE 75 5.132 11.106 9.715 588 1HB PHE 75 1HB PHE 75 2.784 12.398 8.433 589 2HB PHE 75 2HB PHE 75 4.326 13.238 8.298 590 HD1 PHE 75 HD1 PHE 75 3.426 9.619 8.213 591 HD2 PHE 75 HD2 PHE 75 5.154 12.934 6.180 592 HE1 PHE 75 HE1 PHE 75 4.064 8.140 6.353 593 HE2 PHE 75 HE2 PHE 75 5.797 11.461 4.315 594 HZ PHE 75 HZ PHE 75 5.251 9.061 4.401 595 H LYS 76 H LYS 76 6.554 12.350 10.740 596 HA LYS 76 HA LYS 76 5.557 14.711 12.196 597 1HB LYS 76 1HB LYS 76 6.338 12.627 13.544 598 2HB LYS 76 2HB LYS 76 7.956 13.150 13.100 599 1HG LYS 76 1HG LYS 76 7.207 15.440 14.057 600 2HG LYS 76 2HG LYS 76 5.954 14.492 14.860 601 1HD LYS 76 1HD LYS 76 7.487 13.306 16.134 602 2HD LYS 76 2HD LYS 76 8.817 13.640 15.022 603 1HE LYS 76 1HE LYS 76 9.102 14.914 17.061 604 2HE LYS 76 2HE LYS 76 8.774 16.000 15.712 605 1HZ LYS 76 1HZ LYS 76 7.326 16.843 17.212 606 2HZ LYS 76 2HZ LYS 76 7.132 15.382 18.042 607 3HZ LYS 76 3HZ LYS 76 6.317 15.640 16.583 608 H ASP 77 H ASP 77 6.301 16.515 11.318 609 HA ASP 77 HA ASP 77 8.514 16.564 9.523 610 1HB ASP 77 1HB ASP 77 6.558 18.522 10.580 611 2HB ASP 77 2HB ASP 77 8.096 19.182 10.031 612 HD2 ASP 77 HD2 ASP 77 7.249 18.744 6.738 613 H SER 78 H SER 78 10.030 18.683 9.974 614 HA SER 78 HA SER 78 11.613 17.874 12.267 615 1HB SER 78 1HB SER 78 12.476 20.187 10.625 616 2HB SER 78 2HB SER 78 13.399 18.794 11.189 617 HG SER 78 HG SER 78 12.510 19.170 8.788 618 H TRP 79 H TRP 79 9.611 20.551 11.253 619 HA TRP 79 HA TRP 79 10.442 22.248 13.440 620 1HB TRP 79 1HB TRP 79 8.544 22.494 11.148 621 2HB TRP 79 2HB TRP 79 8.316 23.551 12.537 622 HD1 TRP 79 HD1 TRP 79 11.684 22.504 10.932 623 HE1 TRP 79 HE1 TRP 79 12.922 24.644 10.218 624 HE3 TRP 79 HE3 TRP 79 8.092 25.949 12.104 625 HZ2 TRP 79 HZ2 TRP 79 12.440 27.424 10.160 626 HZ3 TRP 79 HZ3 TRP 79 8.561 28.328 11.688 627 HH2 TRP 79 HH2 TRP 79 10.690 29.050 10.736 628 H ASN 80 H ASN 80 7.119 21.415 12.508 629 HA ASN 80 HA ASN 80 6.501 20.033 14.904 630 1HB ASN 80 1HB ASN 80 6.120 22.976 14.851 631 2HB ASN 80 2HB ASN 80 4.794 22.024 15.512 632 1HD2 ASN 80 1HD2 ASN 80 7.279 23.770 16.439 633 2HD2 ASN 80 2HD2 ASN 80 7.781 22.922 17.858 634 H LYS 81 H LYS 81 6.097 19.751 12.079 635 HA LYS 81 HA LYS 81 3.192 20.054 11.799 636 1HB LYS 81 1HB LYS 81 5.456 20.044 9.934 637 2HB LYS 81 2HB LYS 81 4.089 19.081 9.390 638 1HG LYS 81 1HG LYS 81 3.782 21.233 8.491 639 2HG LYS 81 2HG LYS 81 2.643 21.097 9.832 640 1HD LYS 81 1HD LYS 81 3.555 23.192 10.187 641 2HD LYS 81 2HD LYS 81 4.560 22.174 11.220 642 1HE LYS 81 1HE LYS 81 6.312 22.136 9.589 643 2HE LYS 81 2HE LYS 81 5.290 22.941 8.399 644 1HZ LYS 81 1HZ LYS 81 7.032 24.276 9.783 645 2HZ LYS 81 2HZ LYS 81 5.809 24.290 10.951 646 3HZ LYS 81 3HZ LYS 81 5.524 24.954 9.422 647 H TRP 82 H TRP 82 2.752 18.303 13.265 648 HA TRP 82 HA TRP 82 3.323 15.642 12.141 649 1HB TRP 82 1HB TRP 82 4.221 16.000 14.407 650 2HB TRP 82 2HB TRP 82 2.601 16.383 14.985 651 HD1 TRP 82 HD1 TRP 82 4.390 13.379 13.286 652 HE1 TRP 82 HE1 TRP 82 3.396 11.216 14.268 653 HE3 TRP 82 HE3 TRP 82 0.847 15.429 16.351 654 HZ2 TRP 82 HZ2 TRP 82 1.378 10.477 16.097 655 HZ3 TRP 82 HZ3 TRP 82 -0.573 13.924 17.682 656 HH2 TRP 82 HH2 TRP 82 -0.312 11.500 17.557 657 H GLU 83 H GLU 83 1.682 14.395 11.477 658 HA GLU 83 HA GLU 83 -1.030 14.957 12.396 659 1HB GLU 83 1HB GLU 83 -0.011 15.531 9.712 660 2HB GLU 83 2HB GLU 83 -1.449 14.520 9.707 661 1HG GLU 83 1HG GLU 83 -2.338 16.331 11.382 662 2HG GLU 83 2HG GLU 83 -1.106 17.329 10.612 663 HE2 GLU 83 HE2 GLU 83 -2.857 17.328 7.575 664 HA PRO 84 HA PRO 84 -1.139 10.525 12.319 665 1HB PRO 84 1HB PRO 84 -3.772 10.130 12.704 666 2HB PRO 84 2HB PRO 84 -2.726 10.760 13.982 667 1HG PRO 84 1HG PRO 84 -4.585 12.234 12.158 668 2HG PRO 84 2HG PRO 84 -4.325 12.445 13.900 669 1HD PRO 84 1HD PRO 84 -3.196 14.052 12.001 670 2HD PRO 84 2HD PRO 84 -2.461 13.745 13.587 671 H ILE 85 H ILE 85 -1.843 8.755 11.045 672 HA ILE 85 HA ILE 85 -3.478 9.281 8.701 673 HB ILE 85 HB ILE 85 -0.693 8.179 8.344 674 1HG1 ILE 85 1HG1 ILE 85 -1.746 10.956 7.757 675 2HG1 ILE 85 2HG1 ILE 85 -0.552 10.536 8.982 676 1HG2 ILE 85 1HG2 ILE 85 -2.073 7.347 6.642 677 2HG2 ILE 85 2HG2 ILE 85 -1.263 8.739 5.922 678 3HG2 ILE 85 3HG2 ILE 85 -2.933 8.877 6.471 679 1HD1 ILE 85 1HD1 ILE 85 1.119 10.476 7.501 680 2HD1 ILE 85 2HD1 ILE 85 0.028 11.426 6.494 681 3HD1 ILE 85 3HD1 ILE 85 0.139 9.681 6.270 682 H ALA 86 H ALA 86 -4.789 7.608 8.403 683 HA ALA 86 HA ALA 86 -3.957 4.975 9.437 684 1HB ALA 86 1HB ALA 86 -6.072 6.385 10.306 685 2HB ALA 86 2HB ALA 86 -6.013 4.623 10.304 686 3HB ALA 86 3HB ALA 86 -6.830 5.480 8.997 687 H GLY 87 H GLY 87 -4.751 3.093 8.281 688 1HA GLY 87 1HA GLY 87 -5.609 3.559 5.522 689 2HA GLY 87 2HA GLY 87 -4.080 2.729 5.763 690 H TYR 88 H TYR 88 -6.896 2.000 4.725 691 HA TYR 88 HA TYR 88 -6.850 -0.683 5.782 692 1HB TYR 88 1HB TYR 88 -8.240 0.546 7.440 693 2HB TYR 88 2HB TYR 88 -9.344 0.992 6.143 694 HD1 TYR 88 HD1 TYR 88 -8.658 -1.374 8.669 695 HD2 TYR 88 HD2 TYR 88 -10.344 -1.010 4.779 696 HE1 TYR 88 HE1 TYR 88 -9.903 -3.465 9.019 697 HE2 TYR 88 HE2 TYR 88 -11.594 -3.100 5.118 698 HH TYR 88 HH TYR 88 -12.050 -4.510 8.082 699 H GLY 89 H GLY 89 -7.343 -2.073 4.206 700 1HA GLY 89 1HA GLY 89 -9.377 -1.581 2.262 701 2HA GLY 89 2HA GLY 89 -7.774 -1.353 1.582 702 H TRP 90 H TRP 90 -8.329 -3.121 0.154 703 HA TRP 90 HA TRP 90 -7.704 -5.704 1.387 704 1HB TRP 90 1HB TRP 90 -9.405 -6.805 -0.064 705 2HB TRP 90 2HB TRP 90 -10.108 -5.739 1.148 706 HD1 TRP 90 HD1 TRP 90 -11.642 -3.826 0.300 707 HE1 TRP 90 HE1 TRP 90 -12.400 -3.016 -2.022 708 HE3 TRP 90 HE3 TRP 90 -8.471 -6.596 -2.600 709 HZ2 TRP 90 HZ2 TRP 90 -11.742 -3.490 -4.725 710 HZ3 TRP 90 HZ3 TRP 90 -8.601 -6.359 -5.045 711 HH2 TRP 90 HH2 TRP 90 -10.203 -4.837 -6.084 712 H GLU 91 H GLU 91 -6.669 -7.195 0.013 713 HA GLU 91 HA GLU 91 -5.937 -6.269 -2.661 714 1HB GLU 91 1HB GLU 91 -4.063 -6.707 -0.376 715 2HB GLU 91 2HB GLU 91 -3.531 -7.135 -1.996 716 1HG GLU 91 1HG GLU 91 -2.860 -5.019 -2.136 717 2HG GLU 91 2HG GLU 91 -4.563 -4.641 -2.382 718 HE2 GLU 91 HE2 GLU 91 -2.819 -3.466 0.928 719 H SER 92 H SER 92 -5.508 -7.894 -4.117 720 HA SER 92 HA SER 92 -6.351 -10.552 -3.298 721 1HB SER 92 1HB SER 92 -5.788 -9.311 -5.995 722 2HB SER 92 2HB SER 92 -6.183 -11.017 -5.789 723 HG SER 92 HG SER 92 -8.182 -10.458 -5.028 724 H THR 93 H THR 93 -4.865 -11.871 -2.481 725 HA THR 93 HA THR 93 -2.070 -11.593 -3.117 726 HB THR 93 HB THR 93 -2.010 -13.784 -1.677 727 HG1 THR 93 HG1 THR 93 -3.897 -14.439 -1.095 728 1HG2 THR 93 1HG2 THR 93 -2.921 -11.214 -0.410 729 2HG2 THR 93 2HG2 THR 93 -1.259 -11.595 -0.860 730 3HG2 THR 93 3HG2 THR 93 -2.075 -12.542 0.383 731 H TRP 94 H TRP 94 -0.753 -13.129 -4.136 732 HA TRP 94 HA TRP 94 -1.994 -15.398 -5.455 733 1HB TRP 94 1HB TRP 94 -1.678 -12.949 -6.828 734 2HB TRP 94 2HB TRP 94 -0.428 -14.025 -7.442 735 HD1 TRP 94 HD1 TRP 94 -2.301 -16.715 -7.136 736 HE1 TRP 94 HE1 TRP 94 -4.111 -17.101 -8.925 737 HE3 TRP 94 HE3 TRP 94 -2.719 -11.940 -8.915 738 HZ2 TRP 94 HZ2 TRP 94 -5.527 -15.584 -10.837 739 HZ3 TRP 94 HZ3 TRP 94 -4.324 -11.492 -10.726 740 HH2 TRP 94 HH2 TRP 94 -5.699 -13.278 -11.666 741 H ARG 95 H ARG 95 -0.607 -17.062 -5.725 742 HA ARG 95 HA ARG 95 2.254 -16.532 -5.252 743 1HB ARG 95 1HB ARG 95 0.706 -18.967 -4.348 744 2HB ARG 95 2HB ARG 95 2.408 -18.643 -4.049 745 1HG ARG 95 1HG ARG 95 1.978 -17.277 -2.326 746 2HG ARG 95 2HG ARG 95 0.584 -16.544 -3.121 747 1HD ARG 95 1HD ARG 95 0.234 -19.350 -2.318 748 2HD ARG 95 2HD ARG 95 0.436 -18.211 -0.987 749 HE ARG 95 HE ARG 95 -1.427 -17.018 -2.540 750 1HH1 ARG 95 1HH1 ARG 95 -1.161 -20.218 -1.174 751 2HH1 ARG 95 2HH1 ARG 95 -2.874 -20.437 -1.037 752 1HH2 ARG 95 1HH2 ARG 95 -3.679 -17.304 -2.361 753 2HH2 ARG 95 2HH2 ARG 95 -4.303 -18.784 -1.711 754 HA PRO 96 HA PRO 96 3.044 -18.672 -9.026 755 1HB PRO 96 1HB PRO 96 5.498 -19.721 -8.537 756 2HB PRO 96 2HB PRO 96 5.232 -17.996 -8.817 757 1HG PRO 96 1HG PRO 96 5.572 -19.466 -6.231 758 2HG PRO 96 2HG PRO 96 6.272 -17.917 -6.738 759 1HD PRO 96 1HD PRO 96 4.111 -18.080 -5.112 760 2HD PRO 96 2HD PRO 96 4.345 -16.747 -6.260 761 H LEU 97 H LEU 97 3.148 -20.402 -6.000 762 HA LEU 97 HA LEU 97 2.665 -22.549 -5.433 763 1HB LEU 97 1HB LEU 97 1.297 -22.221 -8.052 764 2HB LEU 97 2HB LEU 97 1.470 -23.851 -7.430 765 HG LEU 97 HG LEU 97 0.163 -21.587 -5.922 766 1HD1 LEU 97 1HD1 LEU 97 -1.034 -22.302 -8.008 767 2HD1 LEU 97 2HD1 LEU 97 -1.941 -22.514 -6.510 768 3HD1 LEU 97 3HD1 LEU 97 -1.184 -23.905 -7.287 769 1HD2 LEU 97 1HD2 LEU 97 -0.768 -23.828 -4.799 770 2HD2 LEU 97 2HD2 LEU 97 0.685 -23.005 -4.235 771 3HD2 LEU 97 3HD2 LEU 97 0.821 -24.402 -5.303 772 H ALA 98 H ALA 98 4.982 -22.908 -5.412 773 HA ALA 98 HA ALA 98 5.732 -25.240 -6.796 774 1HB ALA 98 1HB ALA 98 5.902 -23.622 -8.680 775 2HB ALA 98 2HB ALA 98 7.417 -24.442 -8.301 776 3HB ALA 98 3HB ALA 98 7.161 -22.776 -7.780 777 H ASP 99 H ASP 99 7.409 -22.275 -5.722 778 HA ASP 99 HA ASP 99 9.023 -23.954 -3.922 779 1HB ASP 99 1HB ASP 99 9.612 -21.436 -5.432 780 2HB ASP 99 2HB ASP 99 10.487 -21.767 -3.940 781 HD2 ASP 99 HD2 ASP 99 12.260 -23.253 -6.764 782 H GLU 100 H GLU 100 6.820 -21.283 -4.096 783 HA GLU 100 HA GLU 100 5.741 -20.075 -2.502 784 1HB GLU 100 1HB GLU 100 6.600 -22.511 -1.057 785 2HB GLU 100 2HB GLU 100 6.167 -21.136 -0.052 786 1HG GLU 100 1HG GLU 100 4.368 -22.142 -2.228 787 2HG GLU 100 2HG GLU 100 4.339 -22.811 -0.597 788 HE2 GLU 100 HE2 GLU 100 2.613 -20.101 0.631 789 H ASN 101 H ASN 101 7.287 -18.383 -2.983 790 HA ASN 101 HA ASN 101 8.684 -17.539 -0.591 791 1HB ASN 101 1HB ASN 101 10.783 -17.029 -1.887 792 2HB ASN 101 2HB ASN 101 10.475 -18.744 -1.628 793 1HD2 ASN 101 1HD2 ASN 101 9.611 -19.973 -3.388 794 2HD2 ASN 101 2HD2 ASN 101 9.923 -19.489 -5.016 795 H PHE 102 H PHE 102 8.022 -16.842 -4.009 796 HA PHE 102 HA PHE 102 8.077 -13.981 -3.491 797 1HB PHE 102 1HB PHE 102 8.796 -15.429 -5.673 798 2HB PHE 102 2HB PHE 102 7.164 -14.951 -6.128 799 HD1 PHE 102 HD1 PHE 102 6.775 -12.313 -5.286 800 HD2 PHE 102 HD2 PHE 102 10.387 -14.108 -6.643 801 HE1 PHE 102 HE1 PHE 102 7.613 -10.102 -5.968 802 HE2 PHE 102 HE2 PHE 102 11.232 -11.901 -7.327 803 HZ PHE 102 HZ PHE 102 9.844 -9.893 -6.989 804 H HIS 103 H HIS 103 6.333 -13.098 -2.602 805 HA HIS 103 HA HIS 103 3.683 -14.121 -3.369 806 1HB HIS 103 1HB HIS 103 4.730 -13.771 -0.853 807 2HB HIS 103 2HB HIS 103 3.805 -12.290 -1.076 808 HD1 HIS 103 HD1 HIS 103 1.454 -13.575 -2.716 809 HD2 HIS 103 HD2 HIS 103 2.993 -15.042 0.854 810 HE1 HIS 103 HE1 HIS 103 -0.390 -14.953 -1.705 811 HE2 HIS 103 HE2 HIS 103 0.531 -15.749 0.501 812 H LEU 104 H LEU 104 2.595 -12.921 -4.766 813 HA LEU 104 HA LEU 104 3.135 -10.028 -4.865 814 1HB LEU 104 1HB LEU 104 2.474 -10.061 -7.175 815 2HB LEU 104 2HB LEU 104 3.698 -11.289 -6.915 816 HG LEU 104 HG LEU 104 1.537 -12.827 -6.614 817 1HD1 LEU 104 1HD1 LEU 104 0.631 -10.430 -8.140 818 2HD1 LEU 104 2HD1 LEU 104 -0.230 -11.393 -6.940 819 3HD1 LEU 104 3HD1 LEU 104 0.009 -12.023 -8.570 820 1HD2 LEU 104 1HD2 LEU 104 3.489 -12.908 -8.280 821 2HD2 LEU 104 2HD2 LEU 104 2.396 -12.078 -9.388 822 3HD2 LEU 104 3HD2 LEU 104 1.966 -13.664 -8.748 823 H GLY 105 H GLY 105 1.405 -8.577 -5.032 824 1HA GLY 105 1HA GLY 105 -1.316 -9.592 -4.906 825 2HA GLY 105 2HA GLY 105 -0.742 -8.796 -3.449 826 H LEU 106 H LEU 106 -2.939 -7.886 -4.918 827 HA LEU 106 HA LEU 106 -2.111 -5.177 -5.406 828 1HB LEU 106 1HB LEU 106 -1.648 -6.228 -7.584 829 2HB LEU 106 2HB LEU 106 -3.312 -6.776 -7.669 830 HG LEU 106 HG LEU 106 -2.818 -3.855 -7.358 831 1HD1 LEU 106 1HD1 LEU 106 -2.020 -5.490 -9.688 832 2HD1 LEU 106 2HD1 LEU 106 -1.390 -3.946 -9.112 833 3HD1 LEU 106 3HD1 LEU 106 -2.900 -3.999 -10.021 834 1HD2 LEU 106 1HD2 LEU 106 -5.061 -4.176 -7.441 835 2HD2 LEU 106 2HD2 LEU 106 -4.926 -5.670 -8.370 836 3HD2 LEU 106 3HD2 LEU 106 -4.754 -4.111 -9.176 837 H GLY 107 H GLY 107 -3.761 -3.732 -5.116 838 1HA GLY 107 1HA GLY 107 -6.504 -4.304 -5.394 839 2HA GLY 107 2HA GLY 107 -6.044 -4.557 -3.717 840 H PHE 108 H PHE 108 -7.549 -2.825 -3.245 841 HA PHE 108 HA PHE 108 -6.371 -0.169 -3.743 842 1HB PHE 108 1HB PHE 108 -9.166 -1.131 -3.917 843 2HB PHE 108 2HB PHE 108 -8.939 0.441 -3.160 844 HD1 PHE 108 HD1 PHE 108 -8.372 -1.499 -6.247 845 HD2 PHE 108 HD2 PHE 108 -8.420 2.353 -4.439 846 HE1 PHE 108 HE1 PHE 108 -8.209 -0.457 -8.470 847 HE2 PHE 108 HE2 PHE 108 -8.259 3.401 -6.659 848 HZ PHE 108 HZ PHE 108 -8.153 1.996 -8.678 849 H THR 109 H THR 109 -6.410 1.336 -2.044 850 HA THR 109 HA THR 109 -7.092 0.250 0.604 851 HB THR 109 HB THR 109 -5.074 1.352 1.522 852 HG1 THR 109 HG1 THR 109 -4.602 1.918 -1.206 853 1HG2 THR 109 1HG2 THR 109 -3.438 -0.203 0.812 854 2HG2 THR 109 2HG2 THR 109 -4.274 -0.483 -0.715 855 3HG2 THR 109 3HG2 THR 109 -4.990 -1.038 0.798 856 H ALA 110 H ALA 110 -8.113 1.621 1.969 857 HA ALA 110 HA ALA 110 -8.616 4.346 0.970 858 1HB ALA 110 1HB ALA 110 -10.394 3.243 3.047 859 2HB ALA 110 2HB ALA 110 -10.468 2.458 1.469 860 3HB ALA 110 3HB ALA 110 -10.774 4.190 1.608 861 H GLY 111 H GLY 111 -7.484 5.849 2.005 862 1HA GLY 111 1HA GLY 111 -6.675 5.372 4.784 863 2HA GLY 111 2HA GLY 111 -5.981 6.569 3.701 864 H VAL 112 H VAL 112 -7.340 6.574 6.472 865 HA VAL 112 HA VAL 112 -9.239 8.755 5.893 866 HB VAL 112 HB VAL 112 -10.251 8.267 8.109 867 1HG1 VAL 112 1HG1 VAL 112 -11.607 7.324 6.569 868 2HG1 VAL 112 2HG1 VAL 112 -11.018 5.824 7.285 869 3HG1 VAL 112 3HG1 VAL 112 -10.294 6.435 5.798 870 1HG2 VAL 112 1HG2 VAL 112 -8.564 5.769 8.042 871 2HG2 VAL 112 2HG2 VAL 112 -9.732 6.231 9.282 872 3HG2 VAL 112 3HG2 VAL 112 -8.249 7.163 9.075 873 H THR 113 H THR 113 -8.998 10.688 6.917 874 HA THR 113 HA THR 113 -7.025 10.961 9.043 875 HB THR 113 HB THR 113 -6.864 12.772 6.641 876 HG1 THR 113 HG1 THR 113 -5.152 11.500 5.927 877 1HG2 THR 113 1HG2 THR 113 -5.714 13.804 8.353 878 2HG2 THR 113 2HG2 THR 113 -4.447 12.892 7.530 879 3HG2 THR 113 3HG2 THR 113 -5.145 12.278 9.030 880 H ALA 114 H ALA 114 -7.647 12.398 10.536 881 HA ALA 114 HA ALA 114 -10.009 14.040 9.940 882 1HB ALA 114 1HB ALA 114 -9.655 12.306 11.968 883 2HB ALA 114 2HB ALA 114 -10.719 13.709 12.056 884 3HB ALA 114 3HB ALA 114 -9.093 13.793 12.731 885 H ARG 115 H ARG 115 -9.903 16.197 9.911 886 HA ARG 115 HA ARG 115 -7.826 17.617 11.344 887 1HB ARG 115 1HB ARG 115 -6.890 16.937 9.064 888 2HB ARG 115 2HB ARG 115 -8.050 18.062 8.372 889 1HG ARG 115 1HG ARG 115 -5.973 19.192 8.544 890 2HG ARG 115 2HG ARG 115 -7.035 19.853 9.789 891 1HD ARG 115 1HD ARG 115 -5.713 17.688 10.980 892 2HD ARG 115 2HD ARG 115 -4.481 18.553 10.061 893 HE ARG 115 HE ARG 115 -5.906 20.469 11.453 894 1HH1 ARG 115 1HH1 ARG 115 -3.927 17.698 12.218 895 2HH1 ARG 115 2HH1 ARG 115 -3.382 18.348 13.727 896 1HH2 ARG 115 1HH2 ARG 115 -5.190 21.325 13.438 897 2HH2 ARG 115 2HH2 ARG 115 -4.099 20.407 14.421 898 H ASP 116 H ASP 116 -9.206 18.877 12.458 899 HA ASP 116 HA ASP 116 -10.505 21.029 11.129 900 1HB ASP 116 1HB ASP 116 -12.049 18.819 11.058 901 2HB ASP 116 2HB ASP 116 -12.527 19.460 12.627 902 HD2 ASP 116 HD2 ASP 116 -14.536 20.945 9.929 903 H ASN 117 H ASN 117 -12.123 22.090 12.887 904 HA ASN 117 HA ASN 117 -10.502 22.290 15.328 905 1HB ASN 117 1HB ASN 117 -10.872 24.344 13.909 906 2HB ASN 117 2HB ASN 117 -12.577 24.251 14.339 907 1HD2 ASN 117 1HD2 ASN 117 -10.874 26.423 14.896 908 2HD2 ASN 117 2HD2 ASN 117 -10.746 26.575 16.612 909 H TRP 118 H TRP 118 -11.259 21.139 16.973 910 HA TRP 118 HA TRP 118 -12.663 20.206 18.500 911 1HB TRP 118 1HB TRP 118 -14.421 22.497 17.605 912 2HB TRP 118 2HB TRP 118 -14.800 21.445 18.965 913 HD1 TRP 118 HD1 TRP 118 -11.452 21.511 19.700 914 HE1 TRP 118 HE1 TRP 118 -10.696 23.523 21.116 915 HE3 TRP 118 HE3 TRP 118 -15.423 24.626 18.874 916 HZ2 TRP 118 HZ2 TRP 118 -11.655 26.090 21.793 917 HZ3 TRP 118 HZ3 TRP 118 -15.426 26.842 19.944 918 HH2 TRP 118 HH2 TRP 118 -13.580 27.556 21.374 919 H ASN 119 H ASN 119 -12.643 19.120 15.866 920 HA ASN 119 HA ASN 119 -15.224 17.764 15.929 921 1HB ASN 119 1HB ASN 119 -14.969 19.779 14.162 922 2HB ASN 119 2HB ASN 119 -14.267 18.474 13.211 923 1HD2 ASN 119 1HD2 ASN 119 -17.134 19.616 14.834 924 2HD2 ASN 119 2HD2 ASN 119 -18.246 18.571 14.026 925 H TYR 120 H TYR 120 -15.230 15.781 14.604 926 HA TYR 120 HA TYR 120 -12.564 14.735 13.988 927 1HB TYR 120 1HB TYR 120 -14.422 13.742 16.083 928 2HB TYR 120 2HB TYR 120 -13.608 12.527 15.104 929 HD1 TYR 120 HD1 TYR 120 -11.046 12.662 14.954 930 HD2 TYR 120 HD2 TYR 120 -13.323 14.730 17.892 931 HE1 TYR 120 HE1 TYR 120 -9.035 12.878 16.352 932 HE2 TYR 120 HE2 TYR 120 -11.319 14.953 19.298 933 HH TYR 120 HH TYR 120 -8.426 13.236 18.661 934 H ILE 121 H ILE 121 -13.409 15.116 11.815 935 HA ILE 121 HA ILE 121 -15.383 13.109 10.962 936 HB ILE 121 HB ILE 121 -15.471 14.497 8.838 937 1HG1 ILE 121 1HG1 ILE 121 -14.559 16.867 10.339 938 2HG1 ILE 121 2HG1 ILE 121 -13.280 15.752 9.869 939 1HG2 ILE 121 1HG2 ILE 121 -16.474 15.337 11.512 940 2HG2 ILE 121 2HG2 ILE 121 -17.358 14.726 10.115 941 3HG2 ILE 121 3HG2 ILE 121 -16.764 16.386 10.125 942 1HD1 ILE 121 1HD1 ILE 121 -13.729 17.605 8.259 943 2HD1 ILE 121 2HD1 ILE 121 -15.299 16.865 7.943 944 3HD1 ILE 121 3HD1 ILE 121 -13.817 15.984 7.570 945 HA PRO 122 HA PRO 122 -11.691 11.095 9.285 946 1HB PRO 122 1HB PRO 122 -12.984 8.849 8.445 947 2HB PRO 122 2HB PRO 122 -12.473 9.107 10.117 948 1HG PRO 122 1HG PRO 122 -15.172 9.491 8.880 949 2HG PRO 122 2HG PRO 122 -14.749 8.759 10.439 950 1HD PRO 122 1HD PRO 122 -15.670 11.288 10.240 951 2HD PRO 122 2HD PRO 122 -14.486 10.809 11.473 952 H LEU 123 H LEU 123 -10.936 11.777 7.390 953 HA LEU 123 HA LEU 123 -12.760 11.996 5.107 954 1HB LEU 123 1HB LEU 123 -10.014 13.138 5.609 955 2HB LEU 123 2HB LEU 123 -10.868 13.298 4.085 956 HG LEU 123 HG LEU 123 -12.231 14.222 6.570 957 1HD1 LEU 123 1HD1 LEU 123 -11.148 16.352 6.517 958 2HD1 LEU 123 2HD1 LEU 123 -10.187 15.886 5.113 959 3HD1 LEU 123 3HD1 LEU 123 -9.907 15.109 6.671 960 1HD2 LEU 123 1HD2 LEU 123 -13.428 14.239 4.454 961 2HD2 LEU 123 2HD2 LEU 123 -12.151 15.210 3.722 962 3HD2 LEU 123 3HD2 LEU 123 -13.141 15.885 5.015 963 HA PRO 124 HA PRO 124 -10.671 8.127 3.895 964 1HB PRO 124 1HB PRO 124 -12.543 7.405 2.064 965 2HB PRO 124 2HB PRO 124 -12.726 7.104 3.796 966 1HG PRO 124 1HG PRO 124 -13.881 9.301 2.122 967 2HG PRO 124 2HG PRO 124 -14.659 8.331 3.387 968 1HD PRO 124 1HD PRO 124 -13.746 10.837 3.838 969 2HD PRO 124 2HD PRO 124 -13.730 9.579 5.091 970 H VAL 125 H VAL 125 -9.632 7.457 1.966 971 HA VAL 125 HA VAL 125 -9.781 9.191 -0.365 972 HB VAL 125 HB VAL 125 -7.126 8.722 0.990 973 1HG1 VAL 125 1HG1 VAL 125 -7.952 10.410 -1.366 974 2HG1 VAL 125 2HG1 VAL 125 -6.920 8.981 -1.391 975 3HG1 VAL 125 3HG1 VAL 125 -6.359 10.460 -0.609 976 1HG2 VAL 125 1HG2 VAL 125 -8.843 11.203 0.975 977 2HG2 VAL 125 2HG2 VAL 125 -7.185 11.114 1.570 978 3HG2 VAL 125 3HG2 VAL 125 -8.461 10.200 2.374 979 H LEU 126 H LEU 126 -9.562 8.056 -2.190 980 HA LEU 126 HA LEU 126 -8.971 5.229 -2.010 981 1HB LEU 126 1HB LEU 126 -9.554 6.775 -4.524 982 2HB LEU 126 2HB LEU 126 -9.782 5.061 -4.232 983 HG LEU 126 HG LEU 126 -11.405 7.312 -3.045 984 1HD1 LEU 126 1HD1 LEU 126 -13.001 6.874 -4.576 985 2HD1 LEU 126 2HD1 LEU 126 -12.634 5.150 -4.626 986 3HD1 LEU 126 3HD1 LEU 126 -11.629 6.290 -5.520 987 1HD2 LEU 126 1HD2 LEU 126 -11.344 4.369 -2.482 988 2HD2 LEU 126 2HD2 LEU 126 -12.817 5.313 -2.255 989 3HD2 LEU 126 3HD2 LEU 126 -11.360 5.719 -1.347 990 H LEU 127 H LEU 127 -7.009 4.412 -2.257 991 HA LEU 127 HA LEU 127 -5.174 5.607 -4.185 992 1HB LEU 127 1HB LEU 127 -3.306 5.425 -2.514 993 2HB LEU 127 2HB LEU 127 -4.462 6.710 -2.219 994 HG LEU 127 HG LEU 127 -4.954 4.131 -0.837 995 1HD1 LEU 127 1HD1 LEU 127 -3.368 4.612 0.921 996 2HD1 LEU 127 2HD1 LEU 127 -2.798 6.038 0.053 997 3HD1 LEU 127 3HD1 LEU 127 -2.521 4.430 -0.616 998 1HD2 LEU 127 1HD2 LEU 127 -6.131 5.414 0.598 999 2HD2 LEU 127 2HD2 LEU 127 -6.137 6.543 -0.757 1000 3HD2 LEU 127 3HD2 LEU 127 -4.965 6.735 0.546 1001 HA PRO 128 HA PRO 128 -5.088 1.077 -4.664 1002 1HB PRO 128 1HB PRO 128 -4.191 1.110 -7.223 1003 2HB PRO 128 2HB PRO 128 -5.890 1.346 -6.801 1004 1HG PRO 128 1HG PRO 128 -3.802 3.387 -7.463 1005 2HG PRO 128 2HG PRO 128 -5.492 3.301 -7.997 1006 1HD PRO 128 1HD PRO 128 -4.677 4.932 -5.995 1007 2HD PRO 128 2HD PRO 128 -6.291 4.192 -6.027 1008 H LEU 129 H LEU 129 -3.426 -0.324 -4.386 1009 HA LEU 129 HA LEU 129 -0.725 0.367 -5.139 1010 1HB LEU 129 1HB LEU 129 0.082 -0.090 -2.757 1011 2HB LEU 129 2HB LEU 129 -0.618 1.482 -3.093 1012 HG LEU 129 HG LEU 129 -2.827 0.276 -2.231 1013 1HD1 LEU 129 1HD1 LEU 129 -2.217 -1.857 -1.699 1014 2HD1 LEU 129 2HD1 LEU 129 -1.912 -1.064 -0.154 1015 3HD1 LEU 129 3HD1 LEU 129 -0.574 -1.397 -1.254 1016 1HD2 LEU 129 1HD2 LEU 129 -0.635 1.697 -0.821 1017 2HD2 LEU 129 2HD2 LEU 129 -1.920 0.985 0.156 1018 3HD2 LEU 129 3HD2 LEU 129 -2.312 2.176 -1.086 1019 H ALA 130 H ALA 130 0.817 -1.433 -4.393 1020 HA ALA 130 HA ALA 130 -0.482 -4.014 -4.044 1021 1HB ALA 130 1HB ALA 130 1.069 -4.818 -6.020 1022 2HB ALA 130 2HB ALA 130 0.863 -3.150 -6.551 1023 3HB ALA 130 3HB ALA 130 -0.548 -4.181 -6.322 1024 H SER 131 H SER 131 1.022 -5.735 -3.543 1025 HA SER 131 HA SER 131 3.674 -4.796 -2.690 1026 1HB SER 131 1HB SER 131 3.486 -5.802 -0.569 1027 2HB SER 131 2HB SER 131 1.927 -5.013 -0.806 1028 HG SER 131 HG SER 131 1.272 -6.967 -0.273 1029 H VAL 132 H VAL 132 5.314 -6.076 -3.280 1030 HA VAL 132 HA VAL 132 4.780 -8.885 -3.924 1031 HB VAL 132 HB VAL 132 6.206 -8.682 -5.969 1032 1HG1 VAL 132 1HG1 VAL 132 4.067 -8.873 -6.670 1033 2HG1 VAL 132 2HG1 VAL 132 4.310 -7.198 -7.166 1034 3HG1 VAL 132 3HG1 VAL 132 3.499 -7.558 -5.641 1035 1HG2 VAL 132 1HG2 VAL 132 6.061 -6.179 -6.859 1036 2HG2 VAL 132 2HG2 VAL 132 7.431 -6.764 -5.915 1037 3HG2 VAL 132 3HG2 VAL 132 6.152 -5.837 -5.132 1038 H GLY 133 H GLY 133 6.341 -10.238 -3.246 1039 1HA GLY 133 1HA GLY 133 8.965 -10.244 -3.226 1040 2HA GLY 133 2HA GLY 133 8.692 -9.038 -1.977 1041 H TYR 134 H TYR 134 9.649 -10.273 -0.367 1042 HA TYR 134 HA TYR 134 8.484 -12.879 0.245 1043 1HB TYR 134 1HB TYR 134 11.066 -11.772 0.513 1044 2HB TYR 134 2HB TYR 134 10.471 -12.029 2.149 1045 HD1 TYR 134 HD1 TYR 134 9.213 -14.420 2.401 1046 HD2 TYR 134 HD2 TYR 134 12.269 -13.498 -0.413 1047 HE1 TYR 134 HE1 TYR 134 9.766 -16.809 2.227 1048 HE2 TYR 134 HE2 TYR 134 12.829 -15.885 -0.595 1049 HH TYR 134 HH TYR 134 10.837 -18.348 0.725 1050 H GLY 135 H GLY 135 7.508 -13.374 2.217 1051 1HA GLY 135 1HA GLY 135 5.696 -11.632 3.284 1052 2HA GLY 135 2HA GLY 135 6.347 -13.000 4.172 1053 HA PRO 136 HA PRO 136 8.605 -10.465 6.988 1054 1HB PRO 136 1HB PRO 136 11.284 -10.901 6.556 1055 2HB PRO 136 2HB PRO 136 10.229 -12.004 7.445 1056 1HG PRO 136 1HG PRO 136 11.143 -12.136 4.602 1057 2HG PRO 136 2HG PRO 136 10.977 -13.443 5.789 1058 1HD PRO 136 1HD PRO 136 9.149 -13.041 3.863 1059 2HD PRO 136 2HD PRO 136 8.688 -13.599 5.483 1060 H VAL 137 H VAL 137 9.802 -10.236 3.686 1061 HA VAL 137 HA VAL 137 10.102 -7.340 4.059 1062 HB VAL 137 HB VAL 137 12.101 -7.447 2.496 1063 1HG1 VAL 137 1HG1 VAL 137 13.461 -7.284 4.285 1064 2HG1 VAL 137 2HG1 VAL 137 12.950 -8.836 4.949 1065 3HG1 VAL 137 3HG1 VAL 137 11.952 -7.401 5.189 1066 1HG2 VAL 137 1HG2 VAL 137 11.986 -9.625 1.609 1067 2HG2 VAL 137 2HG2 VAL 137 11.848 -10.356 3.207 1068 3HG2 VAL 137 3HG2 VAL 137 13.375 -9.638 2.695 1069 H THR 138 H THR 138 8.611 -6.486 2.761 1070 HA THR 138 HA THR 138 8.490 -7.423 -0.020 1071 HB THR 138 HB THR 138 5.918 -6.748 0.318 1072 HG1 THR 138 HG1 THR 138 5.938 -6.350 2.475 1073 1HG2 THR 138 1HG2 THR 138 7.296 -9.157 0.029 1074 2HG2 THR 138 2HG2 THR 138 5.577 -8.861 -0.226 1075 3HG2 THR 138 3HG2 THR 138 6.153 -9.410 1.348 1076 H PHE 139 H PHE 139 7.958 -5.854 -1.555 1077 HA PHE 139 HA PHE 139 8.290 -3.098 -0.604 1078 1HB PHE 139 1HB PHE 139 9.812 -4.219 -2.395 1079 2HB PHE 139 2HB PHE 139 8.461 -3.929 -3.486 1080 HD1 PHE 139 HD1 PHE 139 7.537 -1.480 -3.491 1081 HD2 PHE 139 HD2 PHE 139 11.418 -2.592 -2.142 1082 HE1 PHE 139 HE1 PHE 139 8.318 0.827 -3.845 1083 HE2 PHE 139 HE2 PHE 139 12.204 -0.287 -2.492 1084 HZ PHE 139 HZ PHE 139 10.653 1.426 -3.345 1085 H GLN 140 H GLN 140 6.625 -1.746 -0.628 1086 HA GLN 140 HA GLN 140 4.226 -2.508 -2.144 1087 1HB GLN 140 1HB GLN 140 4.683 -1.112 0.432 1088 2HB GLN 140 2HB GLN 140 3.330 -0.546 -0.537 1089 1HG GLN 140 1HG GLN 140 2.727 -3.078 -0.659 1090 2HG GLN 140 2HG GLN 140 3.749 -3.189 0.772 1091 1HE2 GLN 140 1HE2 GLN 140 1.898 -3.818 1.962 1092 2HE2 GLN 140 2HE2 GLN 140 0.742 -2.648 2.487 1093 H MET 141 H MET 141 3.292 -1.141 -3.599 1094 HA MET 141 HA MET 141 4.724 1.378 -4.144 1095 1HB MET 141 1HB MET 141 3.362 -0.438 -6.141 1096 2HB MET 141 2HB MET 141 4.189 1.068 -6.515 1097 1HG MET 141 1HG MET 141 5.978 -0.595 -5.067 1098 2HG MET 141 2HG MET 141 5.255 -1.548 -6.363 1099 1HE MET 141 1HE MET 141 7.004 2.547 -6.854 1100 2HE MET 141 2HE MET 141 8.204 1.535 -6.048 1101 3HE MET 141 3HE MET 141 6.594 1.715 -5.354 1102 H THR 142 H THR 142 3.532 3.112 -3.755 1103 HA THR 142 HA THR 142 0.606 2.875 -3.847 1104 HB THR 142 HB THR 142 2.067 5.223 -2.684 1105 HG1 THR 142 HG1 THR 142 2.774 4.079 -1.093 1106 1HG2 THR 142 1HG2 THR 142 -0.001 4.526 -1.020 1107 2HG2 THR 142 2HG2 THR 142 -0.647 4.199 -2.628 1108 3HG2 THR 142 3HG2 THR 142 -0.027 5.803 -2.235 1109 H TYR 143 H TYR 143 -0.520 3.848 -5.397 1110 HA TYR 143 HA TYR 143 0.863 5.826 -7.085 1111 1HB TYR 143 1HB TYR 143 -1.277 3.803 -7.725 1112 2HB TYR 143 2HB TYR 143 -0.925 5.158 -8.793 1113 HD1 TYR 143 HD1 TYR 143 0.971 2.505 -6.955 1114 HD2 TYR 143 HD2 TYR 143 0.486 4.718 -10.556 1115 HE1 TYR 143 HE1 TYR 143 2.786 1.207 -7.990 1116 HE2 TYR 143 HE2 TYR 143 2.298 3.426 -11.602 1117 HH TYR 143 HH TYR 143 3.367 0.616 -10.605 1118 H ILE 144 H ILE 144 0.193 7.849 -6.870 1119 HA ILE 144 HA ILE 144 -2.296 8.434 -5.514 1120 HB ILE 144 HB ILE 144 -0.315 10.389 -6.681 1121 1HG1 ILE 144 1HG1 ILE 144 -0.342 9.940 -3.768 1122 2HG1 ILE 144 2HG1 ILE 144 0.261 8.580 -4.711 1123 1HG2 ILE 144 1HG2 ILE 144 -2.560 10.656 -4.697 1124 2HG2 ILE 144 2HG2 ILE 144 -2.377 11.471 -6.250 1125 3HG2 ILE 144 3HG2 ILE 144 -1.307 11.879 -4.909 1126 1HD1 ILE 144 1HD1 ILE 144 1.502 10.834 -5.787 1127 2HD1 ILE 144 2HD1 ILE 144 2.224 9.591 -4.764 1128 3HD1 ILE 144 3HD1 ILE 144 1.551 11.050 -4.037 1129 HA PRO 145 HA PRO 145 -4.518 8.927 -9.357 1130 1HB PRO 145 1HB PRO 145 -6.825 9.890 -8.341 1131 2HB PRO 145 2HB PRO 145 -6.356 8.194 -8.174 1132 1HG PRO 145 1HG PRO 145 -6.117 10.428 -6.196 1133 2HG PRO 145 2HG PRO 145 -6.659 8.760 -5.937 1134 1HD PRO 145 1HD PRO 145 -4.148 9.616 -5.333 1135 2HD PRO 145 2HD PRO 145 -4.509 7.949 -5.825 1136 H GLY 146 H GLY 146 -4.311 10.525 -10.790 1137 1HA GLY 146 1HA GLY 146 -5.140 13.203 -10.240 1138 2HA GLY 146 2HA GLY 146 -3.389 13.067 -10.271 1139 H THR 147 H THR 147 -2.343 12.945 -12.196 1140 HA THR 147 HA THR 147 -1.996 13.122 -14.437 1141 HB THR 147 HB THR 147 -4.591 11.848 -15.121 1142 HG1 THR 147 HG1 THR 147 -4.246 10.572 -13.428 1143 1HG2 THR 147 1HG2 THR 147 -2.437 10.338 -16.045 1144 2HG2 THR 147 2HG2 THR 147 -1.961 12.024 -16.245 1145 3HG2 THR 147 3HG2 THR 147 -3.457 11.437 -16.970 1146 H TYR 148 H TYR 148 -2.203 15.361 -14.528 1147 HA TYR 148 HA TYR 148 -4.602 16.284 -15.914 1148 1HB TYR 148 1HB TYR 148 -4.352 16.762 -13.230 1149 2HB TYR 148 2HB TYR 148 -3.619 18.208 -13.917 1150 HD1 TYR 148 HD1 TYR 148 -6.552 16.115 -14.920 1151 HD2 TYR 148 HD2 TYR 148 -5.111 19.965 -13.824 1152 HE1 TYR 148 HE1 TYR 148 -8.790 17.057 -15.308 1153 HE2 TYR 148 HE2 TYR 148 -7.344 20.918 -14.207 1154 HH TYR 148 HH TYR 148 -9.529 19.860 -15.910 1155 H ASN 149 H ASN 149 -1.516 17.465 -14.564 1156 HA ASN 149 HA ASN 149 -0.572 18.190 -17.185 1157 1HB ASN 149 1HB ASN 149 -0.245 20.590 -16.633 1158 2HB ASN 149 2HB ASN 149 -1.944 20.138 -16.739 1159 1HD2 ASN 149 1HD2 ASN 149 -3.232 20.497 -15.047 1160 2HD2 ASN 149 2HD2 ASN 149 -2.706 21.077 -13.507 1161 H ASN 150 H ASN 150 -0.111 18.614 -13.690 1162 HA ASN 150 HA ASN 150 2.588 17.586 -13.921 1163 1HB ASN 150 1HB ASN 150 2.399 20.258 -14.148 1164 2HB ASN 150 2HB ASN 150 2.434 20.127 -12.393 1165 1HD2 ASN 150 1HD2 ASN 150 4.429 20.947 -12.048 1166 2HD2 ASN 150 2HD2 ASN 150 5.888 20.205 -12.601 1167 H GLY 151 H GLY 151 3.627 17.472 -11.678 1168 1HA GLY 151 1HA GLY 151 3.433 17.165 -9.354 1169 2HA GLY 151 2HA GLY 151 1.689 17.322 -9.500 1170 H ASN 152 H ASN 152 3.648 15.195 -11.489 1171 HA ASN 152 HA ASN 152 2.137 12.920 -10.448 1172 1HB ASN 152 1HB ASN 152 2.578 13.549 -12.984 1173 2HB ASN 152 2HB ASN 152 4.072 12.658 -12.709 1174 1HD2 ASN 152 1HD2 ASN 152 0.585 12.369 -12.129 1175 2HD2 ASN 152 2HD2 ASN 152 0.489 10.686 -12.508 1176 H VAL 153 H VAL 153 3.048 12.121 -8.647 1177 HA VAL 153 HA VAL 153 5.866 11.301 -8.815 1178 HB VAL 153 HB VAL 153 5.769 13.303 -7.408 1179 1HG1 VAL 153 1HG1 VAL 153 3.471 13.164 -6.652 1180 2HG1 VAL 153 2HG1 VAL 153 4.557 13.253 -5.266 1181 3HG1 VAL 153 3HG1 VAL 153 3.839 11.709 -5.725 1182 1HG2 VAL 153 1HG2 VAL 153 7.423 11.615 -6.872 1183 2HG2 VAL 153 2HG2 VAL 153 6.260 10.759 -5.861 1184 3HG2 VAL 153 3HG2 VAL 153 6.826 12.362 -5.390 1185 H TYR 154 H TYR 154 6.404 9.401 -7.715 1186 HA TYR 154 HA TYR 154 4.089 7.744 -6.978 1187 1HB TYR 154 1HB TYR 154 6.841 6.742 -7.697 1188 2HB TYR 154 2HB TYR 154 5.341 5.825 -7.630 1189 HD1 TYR 154 HD1 TYR 154 3.733 5.933 -9.444 1190 HD2 TYR 154 HD2 TYR 154 7.340 8.185 -9.593 1191 HE1 TYR 154 HE1 TYR 154 3.377 6.334 -11.843 1192 HE2 TYR 154 HE2 TYR 154 6.993 8.593 -11.993 1193 HH TYR 154 HH TYR 154 4.790 6.880 -13.849 1194 H PHE 155 H PHE 155 3.859 7.086 -4.941 1195 HA PHE 155 HA PHE 155 6.097 7.530 -3.087 1196 1HB PHE 155 1HB PHE 155 3.212 7.946 -2.915 1197 2HB PHE 155 2HB PHE 155 3.846 7.046 -1.541 1198 HD1 PHE 155 HD1 PHE 155 4.491 10.116 -3.545 1199 HD2 PHE 155 HD2 PHE 155 4.771 8.187 0.238 1200 HE1 PHE 155 HE1 PHE 155 5.274 12.218 -2.536 1201 HE2 PHE 155 HE2 PHE 155 5.555 10.286 1.255 1202 HZ PHE 155 HZ PHE 155 5.807 12.305 -0.132 1203 H ALA 156 H ALA 156 7.158 5.806 -2.394 1204 HA ALA 156 HA ALA 156 5.776 3.203 -2.393 1205 1HB ALA 156 1HB ALA 156 8.526 3.998 -3.170 1206 2HB ALA 156 2HB ALA 156 7.445 2.804 -3.887 1207 3HB ALA 156 3HB ALA 156 8.313 2.426 -2.399 1208 H TRP 157 H TRP 157 6.312 1.711 -0.702 1209 HA TRP 157 HA TRP 157 7.710 2.762 1.625 1210 1HB TRP 157 1HB TRP 157 4.786 2.002 1.645 1211 2HB TRP 157 2HB TRP 157 5.763 2.106 3.108 1212 HD1 TRP 157 HD1 TRP 157 7.285 4.759 2.770 1213 HE1 TRP 157 HE1 TRP 157 6.055 7.017 2.679 1214 HE3 TRP 157 HE3 TRP 157 2.652 3.105 1.375 1215 HZ2 TRP 157 HZ2 TRP 157 3.463 7.972 2.093 1216 HZ3 TRP 157 HZ3 TRP 157 0.854 4.755 1.072 1217 HH2 TRP 157 HH2 TRP 157 1.252 7.138 1.424 1218 H MET 158 H MET 158 8.659 1.198 2.843 1219 HA MET 158 HA MET 158 8.525 -1.515 1.793 1220 1HB MET 158 1HB MET 158 10.461 0.055 3.393 1221 2HB MET 158 2HB MET 158 10.386 -1.666 3.743 1222 1HG MET 158 1HG MET 158 10.548 -1.869 1.128 1223 2HG MET 158 2HG MET 158 11.262 -0.264 1.275 1224 1HE MET 158 1HE MET 158 13.064 -3.013 0.158 1225 2HE MET 158 2HE MET 158 14.489 -2.159 0.750 1226 3HE MET 158 3HE MET 158 13.160 -1.258 0.021 1227 H ARG 159 H ARG 159 7.982 -3.321 2.995 1228 HA ARG 159 HA ARG 159 6.658 -2.782 5.572 1229 1HB ARG 159 1HB ARG 159 5.722 -4.156 3.167 1230 2HB ARG 159 2HB ARG 159 5.520 -5.116 4.627 1231 1HG ARG 159 1HG ARG 159 4.669 -2.323 4.880 1232 2HG ARG 159 2HG ARG 159 3.746 -3.279 3.718 1233 1HD ARG 159 1HD ARG 159 4.310 -4.519 6.348 1234 2HD ARG 159 2HD ARG 159 3.152 -3.189 6.321 1235 HE ARG 159 HE ARG 159 2.779 -5.839 5.268 1236 1HH1 ARG 159 1HH1 ARG 159 1.754 -2.509 5.068 1237 2HH1 ARG 159 2HH1 ARG 159 0.200 -2.897 4.409 1238 1HH2 ARG 159 1HH2 ARG 159 0.737 -6.350 4.401 1239 2HH2 ARG 159 2HH2 ARG 159 -0.377 -5.077 4.029 1240 H PHE 160 H PHE 160 7.177 -4.036 7.279 1241 HA PHE 160 HA PHE 160 8.947 -6.340 6.796 1242 1HB PHE 160 1HB PHE 160 9.273 -4.032 8.666 1243 2HB PHE 160 2HB PHE 160 9.863 -5.612 9.171 1244 HD1 PHE 160 HD1 PHE 160 10.018 -3.298 6.252 1245 HD2 PHE 160 HD2 PHE 160 12.017 -6.203 8.634 1246 HE1 PHE 160 HE1 PHE 160 12.079 -2.937 4.956 1247 HE2 PHE 160 HE2 PHE 160 14.082 -5.847 7.343 1248 HZ PHE 160 HZ PHE 160 14.114 -4.212 5.502 1249 H GLN 161 H GLN 161 8.660 -8.130 8.093 1250 HA GLN 161 HA GLN 161 6.410 -8.022 9.990 1251 1HB GLN 161 1HB GLN 161 6.856 -9.797 7.669 1252 2HB GLN 161 2HB GLN 161 6.305 -10.592 9.137 1253 1HG GLN 161 1HG GLN 161 4.314 -9.350 9.191 1254 2HG GLN 161 2HG GLN 161 4.914 -8.188 8.008 1255 1HE2 GLN 161 1HE2 GLN 161 4.321 -8.465 5.977 1256 2HE2 GLN 161 2HE2 GLN 161 3.667 -9.914 5.300 1257 H PHE 162 H PHE 162 7.124 -8.413 11.970 1258 HA PHE 162 HA PHE 162 9.065 -10.574 12.374 1259 1HB PHE 162 1HB PHE 162 10.304 -9.232 14.005 1260 2HB PHE 162 2HB PHE 162 10.325 -8.463 12.422 1261 HD1 PHE 162 HD1 PHE 162 9.547 -8.080 15.880 1262 HD2 PHE 162 HD2 PHE 162 8.678 -6.574 11.996 1263 HE1 PHE 162 HE1 PHE 162 8.679 -6.007 16.882 1264 HE2 PHE 162 HE2 PHE 162 7.808 -4.499 12.991 1265 HZ PHE 162 HZ PHE 162 7.809 -4.213 15.437 1266 H LEU 163 H LEU 163 9.323 -10.659 15.011 1267 HA LEU 163 HA LEU 163 6.565 -10.830 16.036 1268 1HB LEU 163 1HB LEU 163 8.813 -12.763 16.093 1269 2HB LEU 163 2HB LEU 163 7.822 -12.663 17.537 1270 HG LEU 163 HG LEU 163 6.655 -13.128 14.799 1271 1HD1 LEU 163 1HD1 LEU 163 6.787 -15.422 15.068 1272 2HD1 LEU 163 2HD1 LEU 163 7.093 -15.305 16.801 1273 3HD1 LEU 163 3HD1 LEU 163 8.360 -14.878 15.651 1274 1HD2 LEU 163 1HD2 LEU 163 5.415 -14.054 17.328 1275 2HD2 LEU 163 2HD2 LEU 163 4.664 -13.471 15.842 1276 3HD2 LEU 163 3HD2 LEU 163 5.374 -12.326 16.981 1277 H GLU 164 H GLU 164 6.220 -10.359 18.226 1278 HA GLU 164 HA GLU 164 8.462 -9.024 19.594 1279 1HB GLU 164 1HB GLU 164 6.515 -7.583 18.550 1280 2HB GLU 164 2HB GLU 164 5.656 -8.080 20.001 1281 1HG GLU 164 1HG GLU 164 6.586 -6.322 20.983 1282 2HG GLU 164 2HG GLU 164 8.088 -7.245 20.972 1283 HE2 GLU 164 HE2 GLU 164 9.453 -4.725 19.102 1284 H HIS 165 H HIS 165 8.591 -9.268 21.812 1285 HA HIS 165 HA HIS 165 6.740 -11.243 22.977 1286 1HB HIS 165 1HB HIS 165 9.231 -11.867 22.576 1287 2HB HIS 165 2HB HIS 165 9.547 -10.835 23.967 1288 HD1 HIS 165 HD1 HIS 165 10.311 -12.805 25.431 1289 HD2 HIS 165 HD2 HIS 165 6.428 -13.183 24.002 1290 HE1 HIS 165 HE1 HIS 165 9.297 -14.700 26.735 1291 HE2 HIS 165 HE2 HIS 165 6.976 -14.968 25.791 1292 H HIS 166 H HIS 166 9.121 -8.838 24.112 1293 HA HIS 166 HA HIS 166 7.095 -7.895 26.036 1294 1HB HIS 166 1HB HIS 166 9.936 -8.638 26.410 1295 2HB HIS 166 2HB HIS 166 9.409 -7.178 27.240 1296 HD1 HIS 166 HD1 HIS 166 10.148 -9.166 29.177 1297 HD2 HIS 166 HD2 HIS 166 6.406 -9.312 27.375 1298 HE1 HIS 166 HE1 HIS 166 8.714 -10.541 30.717 1299 HE2 HIS 166 HE2 HIS 166 6.478 -10.686 29.565 1300 H HIS 167 H HIS 167 8.149 -5.659 26.991 1301 HA HIS 167 HA HIS 167 9.347 -3.984 25.014 1302 1HB HIS 167 1HB HIS 167 7.460 -2.480 24.639 1303 2HB HIS 167 2HB HIS 167 7.063 -4.107 24.098 1304 HD1 HIS 167 HD1 HIS 167 6.737 -4.403 27.568 1305 HD2 HIS 167 HD2 HIS 167 4.459 -2.519 24.648 1306 HE1 HIS 167 HE1 HIS 167 4.450 -4.130 28.572 1307 HE2 HIS 167 HE2 HIS 167 3.065 -3.066 26.756 1308 H HIS 168 H HIS 168 9.258 -1.616 25.758 1309 HA HIS 168 HA HIS 168 10.307 -1.451 28.348 1310 1HB HIS 168 1HB HIS 168 10.718 0.163 26.459 1311 2HB HIS 168 2HB HIS 168 9.121 0.838 26.771 1312 HD1 HIS 168 HD1 HIS 168 10.235 3.123 27.364 1313 HD2 HIS 168 HD2 HIS 168 11.287 -0.020 29.871 1314 HE1 HIS 168 HE1 HIS 168 11.322 4.192 29.364 1315 HE2 HIS 168 HE2 HIS 168 11.872 2.278 30.906 1316 H HIS 169 H HIS 169 9.214 -1.798 30.165 1317 HA HIS 169 HA HIS 169 6.392 -1.058 30.325 1318 1HB HIS 169 1HB HIS 169 7.731 -3.276 31.212 1319 2HB HIS 169 2HB HIS 169 7.633 -2.309 32.681 1320 HD1 HIS 169 HD1 HIS 169 5.973 -4.044 33.694 1321 HD2 HIS 169 HD2 HIS 169 4.602 -2.141 30.264 1322 HE1 HIS 169 HE1 HIS 169 3.510 -4.541 33.589 1323 HE2 HIS 169 HE2 HIS 169 2.713 -3.432 31.472 1324 H HIS 170 H HIS 170 5.667 -0.158 32.494 1325 HA HIS 170 HA HIS 170 7.617 1.796 33.517 1326 1HB HIS 170 1HB HIS 170 5.582 2.527 31.885 1327 2HB HIS 170 2HB HIS 170 4.784 2.646 33.450 1328 HD1 HIS 170 HD1 HIS 170 4.840 5.268 32.483 1329 HD2 HIS 170 HD2 HIS 170 8.352 3.645 33.999 1330 HE1 HIS 170 HE1 HIS 170 6.310 7.235 33.027 1331 HE2 HIS 170 HE2 HIS 170 8.461 6.225 33.862
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