NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21881 | 2ife | 4394 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA VAL 90 HA VAL 90 -4.404 16.644 16.644 2 HB VAL 90 HB VAL 90 -2.997 17.260 17.260 3 1HG1 VAL 90 1HG1 VAL 90 -3.583 19.264 19.264 4 2HG1 VAL 90 3HG1 VAL 90 -3.310 19.612 19.612 5 3HG1 VAL 90 2HG1 VAL 90 -4.685 18.549 18.549 6 1HG2 VAL 90 3HG2 VAL 90 -0.969 18.102 18.102 7 2HG2 VAL 90 2HG2 VAL 90 -0.780 16.808 16.808 8 3HG2 VAL 90 1HG2 VAL 90 -0.947 18.526 18.526 9 H ILE 91 H ILE 91 -3.582 15.649 15.649 10 HA ILE 91 HA ILE 91 -2.860 12.900 12.900 11 HB ILE 91 HB ILE 91 -4.015 14.116 14.116 12 1HG1 ILE 91 2HG1 ILE 91 -5.662 14.257 14.257 13 2HG1 ILE 91 1HG1 ILE 91 -6.104 12.897 12.897 14 1HG2 ILE 91 2HG2 ILE 91 -3.433 11.199 11.199 15 2HG2 ILE 91 1HG2 ILE 91 -4.506 11.667 11.667 16 3HG2 ILE 91 3HG2 ILE 91 -2.765 12.089 12.089 17 1HD1 ILE 91 1HD1 ILE 91 -5.022 11.287 11.287 18 2HD1 ILE 91 3HD1 ILE 91 -4.713 12.679 12.679 19 3HD1 ILE 91 2HD1 ILE 91 -6.410 12.209 12.209 20 H GLN 92 H GLN 92 -0.942 11.971 11.971 21 HA GLN 92 HA GLN 92 1.022 13.746 13.746 22 1HB GLN 92 2HB GLN 92 1.388 10.975 10.975 23 2HB GLN 92 1HB GLN 92 2.646 12.253 12.253 24 1HG GLN 92 2HG GLN 92 0.191 12.256 12.256 25 2HG GLN 92 1HG GLN 92 1.882 11.904 11.904 26 1HE2 GLN 92 1HE2 GLN 92 -0.518 14.251 14.251 27 2HE2 GLN 92 2HE2 GLN 92 0.450 15.682 15.682 28 H VAL 93 H VAL 93 2.673 12.580 12.580 29 HA VAL 93 HA VAL 93 1.364 10.298 10.298 30 HB VAL 93 HB VAL 93 3.645 12.012 12.012 31 1HG1 VAL 93 2HG1 VAL 93 2.384 9.293 9.293 32 2HG1 VAL 93 1HG1 VAL 93 3.351 10.272 10.272 33 3HG1 VAL 93 3HG1 VAL 93 4.181 9.559 9.559 34 1HG2 VAL 93 3HG2 VAL 93 1.006 12.494 12.494 35 2HG2 VAL 93 2HG2 VAL 93 2.084 12.369 12.369 36 3HG2 VAL 93 1HG2 VAL 93 1.160 10.922 10.922 37 H LYS 94 H LYS 94 1.863 8.501 8.501 38 HA LYS 94 HA LYS 94 4.800 8.080 8.080 39 1HB LYS 94 2HB LYS 94 2.628 6.294 6.294 40 2HB LYS 94 1HB LYS 94 4.392 6.171 6.171 41 1HG LYS 94 2HG LYS 94 2.634 8.556 8.556 42 2HG LYS 94 1HG LYS 94 3.054 7.188 7.188 43 1HD LYS 94 2HD LYS 94 5.539 7.649 7.649 44 2HD LYS 94 1HD LYS 94 5.014 9.250 9.250 45 1HE LYS 94 2HE LYS 94 4.492 8.148 8.148 46 2HE LYS 94 1HE LYS 94 5.755 9.366 9.366 47 1HZ LYS 94 3HZ LYS 94 4.004 10.817 10.817 48 2HZ LYS 94 2HZ LYS 94 2.819 9.680 9.680 49 3HZ LYS 94 1HZ LYS 94 3.787 10.392 10.392 50 H GLU 95 H GLU 95 5.167 5.572 5.572 51 HA GLU 95 HA GLU 95 3.802 5.016 5.016 52 1HB GLU 95 2HB GLU 95 5.922 6.462 6.462 53 2HB GLU 95 1HB GLU 95 6.743 4.986 4.986 54 1HG GLU 95 2HG GLU 95 6.178 3.795 3.795 55 2HG GLU 95 1HG GLU 95 5.316 5.279 5.279 56 H ILE 96 H ILE 96 4.182 2.793 2.793 57 HA ILE 96 HA ILE 96 5.726 1.020 1.020 58 HB ILE 96 HB ILE 96 2.991 0.876 0.876 59 1HG1 ILE 96 2HG1 ILE 96 3.272 -1.654 -1.654 60 2HG1 ILE 96 1HG1 ILE 96 4.980 -1.488 -1.488 61 1HG2 ILE 96 2HG2 ILE 96 2.686 0.679 0.679 62 2HG2 ILE 96 1HG2 ILE 96 3.470 -0.977 -0.977 63 3HG2 ILE 96 3HG2 ILE 96 2.002 -0.688 -0.688 64 1HD1 ILE 96 1HD1 ILE 96 3.629 -0.040 -0.040 65 2HD1 ILE 96 3HD1 ILE 96 4.753 -1.447 -1.447 66 3HD1 ILE 96 2HD1 ILE 96 5.360 0.145 0.145 67 H LYS 97 H LYS 97 6.489 -0.870 -0.870 68 HA LYS 97 HA LYS 97 5.897 -0.210 -0.210 69 1HB LYS 97 2HB LYS 97 8.498 -1.563 -1.563 70 2HB LYS 97 1HB LYS 97 7.855 -1.176 -1.176 71 1HG LYS 97 2HG LYS 97 7.820 1.311 1.311 72 2HG LYS 97 1HG LYS 97 8.939 0.766 0.766 73 1HD LYS 97 2HD LYS 97 10.540 -0.052 -0.052 74 2HD LYS 97 1HD LYS 97 9.354 0.363 0.363 75 1HE LYS 97 2HE LYS 97 9.502 2.794 2.794 76 2HE LYS 97 1HE LYS 97 10.749 2.384 2.384 77 1HZ LYS 97 3HZ LYS 97 10.949 1.859 1.859 78 2HZ LYS 97 2HZ LYS 97 11.720 3.107 3.107 79 3HZ LYS 97 1HZ LYS 97 12.124 1.488 1.488 80 H PHE 98 H PHE 98 5.800 -2.025 -2.025 81 HA PHE 98 HA PHE 98 5.623 -4.638 -4.638 82 1HB PHE 98 2HB PHE 98 3.509 -3.289 -3.289 83 2HB PHE 98 1HB PHE 98 3.637 -5.063 -5.063 84 HD1 PHE 98 2HD PHE 98 3.875 -5.845 -5.845 85 HD2 PHE 98 1HD PHE 98 1.945 -2.467 -2.467 86 HE1 PHE 98 2HE PHE 98 2.570 -5.708 -5.708 87 HE2 PHE 98 1HE PHE 98 0.515 -2.317 -2.317 88 HZ PHE 98 HZ PHE 98 0.735 -4.111 -4.111 89 H ARG 99 H ARG 99 7.619 -5.234 -5.234 90 HA ARG 99 HA ARG 99 8.074 -4.584 -4.584 91 1HB ARG 99 2HB ARG 99 10.251 -5.712 -5.712 92 2HB ARG 99 1HB ARG 99 9.738 -4.630 -4.630 93 1HG ARG 99 2HG ARG 99 8.927 -6.504 -6.504 94 2HG ARG 99 1HG ARG 99 9.381 -7.686 -7.686 95 1HD ARG 99 2HD ARG 99 11.791 -7.108 -7.108 96 2HD ARG 99 1HD ARG 99 11.313 -5.906 -5.906 97 HE ARG 99 HE ARG 99 10.096 -8.513 -8.513 98 1HH1 ARG 99 1HH1 ARG 99 13.156 -6.694 -6.694 99 2HH1 ARG 99 2HH1 ARG 99 13.763 -7.602 -7.602 100 1HH2 ARG 99 1HH2 ARG 99 10.923 -9.734 -9.734 101 2HH2 ARG 99 2HH2 ARG 99 12.475 -9.356 -9.356 102 HA PRO 100 HA PRO 100 6.588 -8.479 -8.479 103 1HB PRO 100 2HB PRO 100 8.785 -9.422 -9.422 104 2HB PRO 100 1HB PRO 100 7.458 -8.350 -8.350 105 1HG PRO 100 2HG PRO 100 10.263 -7.628 -7.628 106 2HG PRO 100 1HG PRO 100 9.215 -6.814 -6.814 107 1HD PRO 100 2HD PRO 100 9.647 -5.829 -5.829 108 2HD PRO 100 1HD PRO 100 8.066 -5.552 -5.552 109 H GLY 101 H GLY 101 6.675 -10.673 -10.673 110 1HA GLY 101 2HA GLY 101 7.668 -12.529 -12.529 111 2HA GLY 101 1HA GLY 101 9.136 -11.519 -11.519 112 H THR 102 H THR 102 6.447 -9.967 -9.967 113 HA THR 102 HA THR 102 6.452 -10.719 -10.719 114 HB THR 102 HB THR 102 5.459 -8.020 -8.020 115 HG1 THR 102 1HG THR 102 7.743 -8.286 -8.286 116 1HG2 THR 102 1HG2 THR 102 5.288 -9.713 -9.713 117 2HG2 THR 102 3HG2 THR 102 5.615 -7.934 -7.934 118 3HG2 THR 102 2HG2 THR 102 4.139 -8.470 -8.470 119 H ASP 103 H ASP 103 5.230 -12.391 -12.391 120 HA ASP 103 HA ASP 103 2.497 -11.721 -11.721 121 1HB ASP 103 2HB ASP 103 3.797 -13.130 -13.130 122 2HB ASP 103 1HB ASP 103 3.664 -14.395 -14.395 123 H GLU 104 H GLU 104 1.286 -13.959 -13.959 124 HA GLU 104 HA GLU 104 0.291 -12.829 -12.829 125 1HB GLU 104 2HB GLU 104 0.616 -15.848 -15.848 126 2HB GLU 104 1HB GLU 104 -0.611 -14.955 -14.955 127 1HG GLU 104 2HG GLU 104 -0.398 -14.873 -14.873 128 2HG GLU 104 1HG GLU 104 -1.535 -15.914 -15.914 129 H GLY 105 H GLY 105 2.658 -15.266 -15.266 130 1HA GLY 105 2HA GLY 105 3.392 -15.561 -15.561 131 2HA GLY 105 1HA GLY 105 4.386 -14.950 -14.950 132 H ASP 106 H ASP 106 4.866 -13.144 -13.144 133 HA ASP 106 HA ASP 106 6.119 -11.760 -11.760 134 1HB ASP 106 2HB ASP 106 7.069 -12.433 -12.433 135 2HB ASP 106 1HB ASP 106 5.965 -11.304 -11.304 136 H TYR 107 H TYR 107 3.597 -11.578 -11.578 137 HA TYR 107 HA TYR 107 3.515 -8.739 -8.739 138 1HB TYR 107 2HB TYR 107 2.963 -10.449 -10.449 139 2HB TYR 107 1HB TYR 107 1.572 -11.019 -11.019 140 HD1 TYR 107 1HD TYR 107 1.797 -7.402 -7.402 141 HD2 TYR 107 2HD TYR 107 0.627 -11.085 -11.085 142 HE1 TYR 107 1HE TYR 107 -0.334 -6.386 -6.386 143 HE2 TYR 107 2HE TYR 107 -1.177 -9.943 -9.943 144 HH TYR 107 HH TYR 107 -2.067 -6.629 -6.629 145 H GLN 108 H GLN 108 0.581 -10.629 -10.629 146 HA GLN 108 HA GLN 108 -0.459 -8.575 -8.575 147 1HB GLN 108 2HB GLN 108 -1.446 -11.081 -11.081 148 2HB GLN 108 1HB GLN 108 -2.243 -9.706 -9.706 149 1HG GLN 108 2HG GLN 108 -0.651 -11.697 -11.697 150 2HG GLN 108 1HG GLN 108 -2.185 -12.093 -12.093 151 1HE2 GLN 108 1HE2 GLN 108 -0.954 -8.808 -8.808 152 2HE2 GLN 108 2HE2 GLN 108 -2.155 -8.554 -8.554 153 H VAL 109 H VAL 109 2.002 -10.266 -10.266 154 HA VAL 109 HA VAL 109 1.610 -9.543 -9.543 155 HB VAL 109 HB VAL 109 4.183 -9.782 -9.782 156 1HG1 VAL 109 3HG1 VAL 109 3.750 -9.386 -9.386 157 2HG1 VAL 109 2HG1 VAL 109 5.268 -10.025 -10.025 158 3HG1 VAL 109 1HG1 VAL 109 4.747 -8.360 -8.360 159 1HG2 VAL 109 2HG2 VAL 109 2.760 -11.878 -11.878 160 2HG2 VAL 109 1HG2 VAL 109 4.368 -11.986 -11.986 161 3HG2 VAL 109 3HG2 VAL 109 2.882 -11.692 -11.692 162 H LYS 110 H LYS 110 3.101 -7.876 -7.876 163 HA LYS 110 HA LYS 110 3.155 -5.410 -5.410 164 1HB LYS 110 2HB LYS 110 4.229 -6.212 -6.212 165 2HB LYS 110 1HB LYS 110 4.332 -4.565 -4.565 166 1HG LYS 110 2HG LYS 110 5.687 -7.120 -7.120 167 2HG LYS 110 1HG LYS 110 6.350 -5.464 -5.464 168 1HD LYS 110 2HD LYS 110 5.520 -4.546 -4.546 169 2HD LYS 110 1HD LYS 110 4.790 -6.129 -6.129 170 1HE LYS 110 2HE LYS 110 7.075 -7.171 -7.171 171 2HE LYS 110 1HE LYS 110 7.808 -5.565 -5.565 172 1HZ LYS 110 2HZ LYS 110 6.131 -6.161 -6.161 173 2HZ LYS 110 1HZ LYS 110 7.822 -6.003 -6.003 174 3HZ LYS 110 3HZ LYS 110 6.838 -4.665 -4.665 175 H LEU 111 H LEU 111 0.749 -6.878 -6.878 176 HA LEU 111 HA LEU 111 -0.380 -4.417 -4.417 177 1HB LEU 111 2HB LEU 111 -0.912 -6.693 -6.693 178 2HB LEU 111 1HB LEU 111 -1.797 -7.076 -7.076 179 HG LEU 111 HG LEU 111 -2.434 -4.583 -4.583 180 1HD1 LEU 111 2HD1 LEU 111 -2.277 -6.542 -6.542 181 2HD1 LEU 111 1HD1 LEU 111 -3.480 -7.428 -7.428 182 3HD1 LEU 111 3HD1 LEU 111 -3.959 -5.910 -5.910 183 1HD2 LEU 111 2HD2 LEU 111 -4.069 -6.464 -6.464 184 2HD2 LEU 111 1HD2 LEU 111 -3.689 -4.725 -4.725 185 3HD2 LEU 111 3HD2 LEU 111 -4.826 -5.200 -5.200 186 H ARG 112 H ARG 112 -0.102 -6.645 -6.645 187 HA ARG 112 HA ARG 112 -1.796 -5.227 -5.227 188 1HB ARG 112 2HB ARG 112 -0.815 -7.512 -7.512 189 2HB ARG 112 1HB ARG 112 0.656 -6.652 -6.652 190 1HG ARG 112 2HG ARG 112 -0.672 -5.419 -5.419 191 2HG ARG 112 1HG ARG 112 -2.176 -6.215 -6.215 192 1HD ARG 112 2HD ARG 112 -1.273 -8.449 -8.449 193 2HD ARG 112 1HD ARG 112 0.259 -7.683 -7.683 194 HE ARG 112 HE ARG 112 -2.464 -7.479 -7.479 195 1HH1 ARG 112 1HH2 ARG 112 0.955 -6.413 -6.413 196 2HH1 ARG 112 2HH2 ARG 112 0.902 -5.803 -5.803 197 1HH2 ARG 112 1HH1 ARG 112 -2.502 -6.645 -6.645 198 2HH2 ARG 112 2HH1 ARG 112 -1.080 -5.934 -5.934 199 H SER 113 H SER 113 1.842 -4.764 -4.764 200 HA SER 113 HA SER 113 2.081 -2.799 -2.799 201 1HB SER 113 2HB SER 113 3.983 -3.819 -3.819 202 2HB SER 113 1HB SER 113 3.574 -3.089 -3.089 203 HG SER 113 HG SER 113 5.109 -1.898 -1.898 204 H LEU 114 H LEU 114 0.814 -2.632 -2.632 205 HA LEU 114 HA LEU 114 0.872 0.062 0.062 206 1HB LEU 114 2HB LEU 114 1.157 -1.465 -1.465 207 2HB LEU 114 1HB LEU 114 -0.388 -2.277 -2.277 208 HG LEU 114 HG LEU 114 -1.595 -0.298 -0.298 209 1HD1 LEU 114 2HD1 LEU 114 0.246 1.491 1.491 210 2HD1 LEU 114 1HD1 LEU 114 0.972 0.952 0.952 211 3HD1 LEU 114 3HD1 LEU 114 -0.631 1.694 1.694 212 1HD2 LEU 114 3HD2 LEU 114 -1.325 -2.102 -2.102 213 2HD2 LEU 114 2HD2 LEU 114 -1.625 -0.542 -0.542 214 3HD2 LEU 114 1HD2 LEU 114 0.039 -1.249 -1.249 215 H ILE 115 H ILE 115 -1.689 -2.276 -2.276 216 HA ILE 115 HA ILE 115 -3.737 -0.483 -0.483 217 HB ILE 115 HB ILE 115 -3.181 -2.009 -2.009 218 1HG1 ILE 115 2HG1 ILE 115 -2.891 -3.737 -3.737 219 2HG1 ILE 115 1HG1 ILE 115 -4.395 -3.952 -3.952 220 1HG2 ILE 115 3HG2 ILE 115 -5.574 -0.936 -0.936 221 2HG2 ILE 115 2HG2 ILE 115 -5.743 -2.043 -2.043 222 3HG2 ILE 115 1HG2 ILE 115 -4.961 -0.447 -0.447 223 1HD1 ILE 115 1HD1 ILE 115 -5.684 -2.988 -2.988 224 2HD1 ILE 115 3HD1 ILE 115 -4.087 -2.935 -2.935 225 3HD1 ILE 115 2HD1 ILE 115 -4.808 -4.519 -4.519 226 H ARG 116 H ARG 116 -1.142 -1.100 -1.100 227 HA ARG 116 HA ARG 116 -1.647 0.510 0.510 228 1HB ARG 116 2HB ARG 116 0.341 -1.170 -1.170 229 2HB ARG 116 1HB ARG 116 1.231 0.377 0.377 230 1HG ARG 116 2HG ARG 116 0.700 0.801 0.801 231 2HG ARG 116 1HG ARG 116 -0.297 -0.705 -0.705 232 1HD ARG 116 2HD ARG 116 2.738 -0.629 -0.629 233 2HD ARG 116 1HD ARG 116 1.970 -1.112 -1.112 234 HE ARG 116 HE ARG 116 0.720 -2.701 -2.701 235 1HH1 ARG 116 1HH2 ARG 116 4.051 -2.115 -2.115 236 2HH1 ARG 116 2HH2 ARG 116 4.645 -3.663 -3.663 237 1HH2 ARG 116 1HH1 ARG 116 1.535 -4.790 -4.790 238 2HH2 ARG 116 2HH1 ARG 116 3.196 -5.204 -5.204 239 H PHE 117 H PHE 117 0.209 1.375 1.375 240 HA PHE 117 HA PHE 117 0.695 4.099 4.099 241 1HB PHE 117 2HB PHE 117 0.375 2.610 2.610 242 2HB PHE 117 1HB PHE 117 0.651 4.423 4.423 243 HD1 PHE 117 2HD PHE 117 2.322 5.234 5.234 244 HD2 PHE 117 1HD PHE 117 2.039 1.185 1.185 245 HE1 PHE 117 2HE PHE 117 4.734 4.973 4.973 246 HE2 PHE 117 1HE PHE 117 4.405 0.793 0.793 247 HZ PHE 117 HZ PHE 117 5.745 2.719 2.719 248 H LEU 118 H LEU 118 -1.945 2.739 2.739 249 HA LEU 118 HA LEU 118 -3.322 5.019 5.019 250 1HB LEU 118 2HB LEU 118 -3.845 2.394 2.394 251 2HB LEU 118 1HB LEU 118 -5.153 2.992 2.992 252 HG LEU 118 HG LEU 118 -4.913 5.170 5.170 253 1HD1 LEU 118 3HD1 LEU 118 -3.984 2.669 2.669 254 2HD1 LEU 118 2HD1 LEU 118 -4.971 3.915 3.915 255 3HD1 LEU 118 1HD1 LEU 118 -3.391 4.387 4.387 256 1HD2 LEU 118 3HD2 LEU 118 -6.653 2.741 2.741 257 2HD2 LEU 118 2HD2 LEU 118 -6.866 4.438 4.438 258 3HD2 LEU 118 1HD2 LEU 118 -6.883 4.113 4.113 259 H GLU 119 H GLU 119 -3.341 3.019 3.019 260 HA GLU 119 HA GLU 119 -5.789 3.959 3.959 261 1HB GLU 119 2HB GLU 119 -5.095 1.565 1.565 262 2HB GLU 119 1HB GLU 119 -3.748 1.886 1.886 263 1HG GLU 119 2HG GLU 119 -5.383 2.224 2.224 264 2HG GLU 119 1HG GLU 119 -6.771 2.117 2.117 265 H GLU 120 H GLU 120 -2.391 4.682 4.682 266 HA GLU 120 HA GLU 120 -2.606 6.055 6.055 267 1HB GLU 120 2HB GLU 120 -0.896 6.772 6.772 268 2HB GLU 120 1HB GLU 120 -0.728 7.497 7.497 269 1HG GLU 120 2HG GLU 120 0.091 4.690 4.690 270 2HG GLU 120 1HG GLU 120 1.090 6.000 6.000 271 H GLY 121 H GLY 121 -3.746 6.561 6.561 272 1HA GLY 121 2HA GLY 121 -5.228 8.078 8.078 273 2HA GLY 121 1HA GLY 121 -4.759 9.153 9.153 274 H ASP 122 H ASP 122 -3.088 7.341 7.341 275 HA ASP 122 HA ASP 122 -2.014 9.902 9.902 276 1HB ASP 122 2HB ASP 122 -0.467 7.286 7.286 277 2HB ASP 122 1HB ASP 122 0.137 8.937 8.937 278 H LYS 123 H LYS 123 -1.207 9.591 9.591 279 HA LYS 123 HA LYS 123 -3.104 7.966 7.966 280 1HB LYS 123 2HB LYS 123 -3.466 10.342 10.342 281 2HB LYS 123 1HB LYS 123 -1.689 10.635 10.635 282 1HG LYS 123 2HG LYS 123 -3.141 8.922 8.922 283 2HG LYS 123 1HG LYS 123 -3.438 10.682 10.682 284 1HD LYS 123 2HD LYS 123 -1.616 11.006 11.006 285 2HD LYS 123 1HD LYS 123 -0.708 10.632 10.632 286 1HE LYS 123 2HE LYS 123 -0.153 8.436 8.436 287 2HE LYS 123 1HE LYS 123 -1.512 8.405 8.405 288 1HZ LYS 123 3HZ LYS 123 -0.353 10.108 10.108 289 2HZ LYS 123 2HZ LYS 123 0.903 10.155 10.155 290 3HZ LYS 123 1HZ LYS 123 0.647 8.753 8.753 291 H ALA 124 H ALA 124 -2.267 6.219 6.219 292 HA ALA 124 HA ALA 124 0.584 5.885 5.885 293 1HB ALA 124 3HB ALA 124 -0.990 4.282 4.282 294 2HB ALA 124 2HB ALA 124 -1.605 3.834 3.834 295 3HB ALA 124 1HB ALA 124 0.173 3.592 3.592 296 H LYS 125 H LYS 125 1.801 5.924 5.924 297 HA LYS 125 HA LYS 125 0.423 5.678 5.678 298 1HB LYS 125 2HB LYS 125 1.931 7.721 7.721 299 2HB LYS 125 1HB LYS 125 3.296 6.600 6.600 300 1HG LYS 125 2HG LYS 125 3.207 5.988 5.988 301 2HG LYS 125 1HG LYS 125 1.855 7.151 7.151 302 1HD LYS 125 2HD LYS 125 4.600 7.939 7.939 303 2HD LYS 125 1HD LYS 125 4.290 7.888 7.888 304 1HE LYS 125 2HE LYS 125 2.478 9.578 9.578 305 2HE LYS 125 1HE LYS 125 2.805 9.707 9.707 306 1HZ LYS 125 3HZ LYS 125 4.774 10.217 10.217 307 2HZ LYS 125 2HZ LYS 125 3.925 11.395 11.395 308 3HZ LYS 125 1HZ LYS 125 5.037 10.383 10.383 309 H ILE 126 H ILE 126 0.529 3.658 3.658 310 HA ILE 126 HA ILE 126 2.605 1.868 1.868 311 HB ILE 126 HB ILE 126 0.787 1.707 1.707 312 1HG1 ILE 126 2HG1 ILE 126 -0.817 2.276 2.276 313 2HG1 ILE 126 1HG1 ILE 126 -0.860 0.506 0.506 314 1HG2 ILE 126 1HG2 ILE 126 2.197 -0.230 -0.230 315 2HG2 ILE 126 3HG2 ILE 126 0.979 -0.742 -0.742 316 3HG2 ILE 126 2HG2 ILE 126 2.543 -0.015 -0.015 317 1HD1 ILE 126 1HD1 ILE 126 0.562 0.233 0.233 318 2HD1 ILE 126 3HD1 ILE 126 0.358 1.997 1.997 319 3HD1 ILE 126 2HD1 ILE 126 -1.092 0.920 0.920 320 H THR 127 H THR 127 4.517 1.545 1.545 321 HA THR 127 HA THR 127 4.692 2.908 2.908 322 HB THR 127 HB THR 127 6.919 2.266 2.266 323 HG1 THR 127 1HG THR 127 5.696 4.737 4.737 324 1HG2 THR 127 1HG2 THR 127 6.751 3.766 3.766 325 2HG2 THR 127 3HG2 THR 127 8.160 3.927 3.927 326 3HG2 THR 127 2HG2 THR 127 7.768 2.326 2.326 327 H LEU 128 H LEU 128 4.728 1.405 1.405 328 HA LEU 128 HA LEU 128 5.687 -1.265 -1.265 329 1HB LEU 128 2HB LEU 128 4.049 -0.095 -0.095 330 2HB LEU 128 1HB LEU 128 5.441 -0.781 -0.781 331 HG LEU 128 HG LEU 128 3.916 -2.248 -2.248 332 1HD1 LEU 128 3HD1 LEU 128 2.305 -1.078 -1.078 333 2HD1 LEU 128 2HD1 LEU 128 2.861 -2.008 -2.008 334 3HD1 LEU 128 1HD1 LEU 128 2.153 -2.876 -2.876 335 1HD2 LEU 128 1HD2 LEU 128 5.874 -3.509 -3.509 336 2HD2 LEU 128 3HD2 LEU 128 4.329 -4.373 -4.373 337 3HD2 LEU 128 2HD2 LEU 128 5.206 -3.512 -3.512 338 H ARG 129 H ARG 129 7.512 -2.167 -2.167 339 HA ARG 129 HA ARG 129 9.239 -0.286 -0.286 340 1HB ARG 129 2HB ARG 129 9.879 0.012 0.012 341 2HB ARG 129 1HB ARG 129 9.880 -1.773 -1.773 342 1HG ARG 129 2HG ARG 129 11.900 -2.009 -2.009 343 2HG ARG 129 1HG ARG 129 11.522 -0.538 -0.538 344 1HD ARG 129 2HD ARG 129 12.272 0.929 0.929 345 2HD ARG 129 1HD ARG 129 12.456 -0.516 -0.516 346 HE ARG 129 HE ARG 129 14.450 -1.089 -1.089 347 1HH1 ARG 129 1HH2 ARG 129 12.801 1.508 1.508 348 2HH1 ARG 129 2HH2 ARG 129 14.168 1.833 1.833 349 1HH2 ARG 129 1HH1 ARG 129 16.264 -0.630 -0.630 350 2HH2 ARG 129 2HH1 ARG 129 16.155 0.607 0.607 351 H PHE 130 H PHE 130 8.980 -1.362 -1.362 352 HA PHE 130 HA PHE 130 8.456 -4.184 -4.184 353 1HB PHE 130 2HB PHE 130 9.149 -2.059 -2.059 354 2HB PHE 130 1HB PHE 130 8.564 -3.807 -3.807 355 HD1 PHE 130 1HD PHE 130 6.514 -4.590 -4.590 356 HD2 PHE 130 2HD PHE 130 7.660 -0.454 -0.454 357 HE1 PHE 130 1HE PHE 130 4.205 -3.853 -3.853 358 HE2 PHE 130 2HE PHE 130 5.324 0.179 0.179 359 HZ PHE 130 HZ PHE 130 3.536 -1.570 -1.570 360 H ARG 131 H ARG 131 9.993 -5.778 -5.778 361 HA ARG 131 HA ARG 131 12.677 -4.884 -4.884 362 1HB ARG 131 2HB ARG 131 12.325 -7.120 -7.120 363 2HB ARG 131 1HB ARG 131 11.394 -7.688 -7.688 364 1HG ARG 131 2HG ARG 131 14.315 -6.692 -6.692 365 2HG ARG 131 1HG ARG 131 13.889 -8.367 -8.367 366 1HD ARG 131 2HD ARG 131 12.718 -8.750 -8.750 367 2HD ARG 131 1HD ARG 131 13.264 -7.109 -7.109 368 HE ARG 131 HE ARG 131 15.555 -8.507 -8.507 369 1HH1 ARG 131 1HH1 ARG 131 13.110 -8.676 -8.676 370 2HH1 ARG 131 2HH1 ARG 131 14.167 -9.414 -9.414 371 1HH2 ARG 131 1HH2 ARG 131 16.989 -9.510 -9.510 372 2HH2 ARG 131 2HH2 ARG 131 16.405 -9.895 -9.895 373 H GLY 132 H GLY 132 12.187 -3.427 -3.427 374 1HA GLY 132 2HA GLY 132 11.015 -4.509 -4.509 375 2HA GLY 132 1HA GLY 132 9.794 -3.803 -3.803 376 H ARG 133 H ARG 133 9.133 -2.144 -2.144 377 HA ARG 133 HA ARG 133 11.115 -0.153 -0.153 378 1HB ARG 133 2HB ARG 133 9.493 -1.886 -1.886 379 2HB ARG 133 1HB ARG 133 10.302 -0.366 -0.366 380 1HG ARG 133 2HG ARG 133 12.497 -1.204 -1.204 381 2HG ARG 133 1HG ARG 133 11.893 -2.749 -2.749 382 1HD ARG 133 2HD ARG 133 11.235 -1.910 -1.910 383 2HD ARG 133 1HD ARG 133 12.669 -2.909 -2.909 384 HE ARG 133 HE ARG 133 11.149 -4.576 -4.576 385 1HH1 ARG 133 1HH2 ARG 133 9.634 -2.226 -2.226 386 2HH1 ARG 133 2HH2 ARG 133 8.260 -3.232 -3.232 387 1HH2 ARG 133 1HH1 ARG 133 9.295 -5.893 -5.893 388 2HH2 ARG 133 2HH1 ARG 133 8.065 -5.335 -5.335 389 H GLU 134 H GLU 134 9.469 1.077 1.077 390 HA GLU 134 HA GLU 134 7.549 2.399 2.399 391 1HB GLU 134 2HB GLU 134 8.099 2.445 2.445 392 2HB GLU 134 1HB GLU 134 6.837 3.431 3.431 393 1HG GLU 134 2HG GLU 134 8.725 4.880 4.880 394 2HG GLU 134 1HG GLU 134 8.639 4.480 4.480 395 H MET 135 H MET 135 7.378 -0.353 -0.353 396 HA MET 135 HA MET 135 4.866 -0.752 -0.752 397 1HB MET 135 2HB MET 135 4.191 -0.371 -0.371 398 2HB MET 135 1HB MET 135 5.327 -1.667 -1.667 399 1HG MET 135 2HG MET 135 4.002 -3.342 -3.342 400 2HG MET 135 1HG MET 135 2.963 -2.032 -2.032 401 1HE MET 135 3HE MET 135 0.976 -3.490 -3.490 402 2HE MET 135 2HE MET 135 0.619 -4.184 -4.184 403 3HE MET 135 1HE MET 135 2.056 -4.745 -4.745 404 H ALA 136 H ALA 136 6.102 -1.870 -1.870 405 HA ALA 136 HA ALA 136 8.016 -3.700 -3.700 406 1HB ALA 136 1HB ALA 136 6.312 -3.455 -3.455 407 2HB ALA 136 3HB ALA 136 7.758 -4.511 -4.511 408 3HB ALA 136 2HB ALA 136 7.907 -2.711 -2.711 409 H HIS 137 H HIS 137 5.047 -3.809 -3.809 410 HA HIS 137 HA HIS 137 4.834 -6.721 -6.721 411 1HB HIS 137 2HB HIS 137 3.516 -6.579 -6.579 412 2HB HIS 137 1HB HIS 137 4.913 -5.456 -5.456 413 HD1 HIS 137 1HD HIS 137 1.137 -5.387 -5.387 414 HD2 HIS 137 2HD HIS 137 4.405 -2.773 -2.773 415 HE1 HIS 137 1HE HIS 137 0.260 -3.042 -3.042 416 H GLN 138 H GLN 138 2.640 -7.696 -7.696 417 HA GLN 138 HA GLN 138 0.554 -5.800 -5.800 418 1HB GLN 138 2HB GLN 138 -0.862 -7.398 -7.398 419 2HB GLN 138 1HB GLN 138 0.545 -6.755 -6.755 420 1HG GLN 138 2HG GLN 138 1.829 -8.884 -8.884 421 2HG GLN 138 1HG GLN 138 0.347 -9.566 -9.566 422 1HE2 GLN 138 1HE2 GLN 138 2.086 -9.306 -9.306 423 2HE2 GLN 138 2HE2 GLN 138 0.835 -9.652 -9.652 424 H GLN 139 H GLN 139 2.318 -7.678 -7.678 425 HA GLN 139 HA GLN 139 0.215 -9.266 -9.266 426 1HB GLN 139 2HB GLN 139 3.208 -9.973 -9.973 427 2HB GLN 139 1HB GLN 139 1.791 -11.026 -11.026 428 1HG GLN 139 2HG GLN 139 1.472 -10.710 -10.710 429 2HG GLN 139 1HG GLN 139 3.000 -9.717 -9.717 430 1HE2 GLN 139 1HE2 GLN 139 3.162 -11.791 -11.791 431 2HE2 GLN 139 2HE2 GLN 139 4.085 -13.103 -13.103 432 H ILE 140 H ILE 140 3.458 -7.839 -7.839 433 HA ILE 140 HA ILE 140 3.806 -8.277 -8.277 434 HB ILE 140 HB ILE 140 4.931 -6.128 -6.128 435 1HG1 ILE 140 2HG1 ILE 140 6.042 -8.893 -8.893 436 2HG1 ILE 140 1HG1 ILE 140 5.225 -8.533 -8.533 437 1HG2 ILE 140 1HG2 ILE 140 5.584 -7.160 -7.160 438 2HG2 ILE 140 3HG2 ILE 140 6.785 -6.286 -6.286 439 3HG2 ILE 140 2HG2 ILE 140 5.287 -5.460 -5.460 440 1HD1 ILE 140 3HD1 ILE 140 6.930 -6.778 -6.778 441 2HD1 ILE 140 2HD1 ILE 140 7.829 -7.208 -7.208 442 3HD1 ILE 140 1HD1 ILE 140 7.644 -8.423 -8.423 443 H GLY 141 H GLY 141 2.404 -5.435 -5.435 444 1HA GLY 141 2HA GLY 141 2.438 -4.257 -4.257 445 2HA GLY 141 1HA GLY 141 1.704 -3.560 -3.560 446 H MET 142 H MET 142 -0.108 -5.166 -5.166 447 HA MET 142 HA MET 142 -2.066 -4.192 -4.192 448 1HB MET 142 2HB MET 142 -2.283 -5.555 -5.555 449 2HB MET 142 1HB MET 142 -3.728 -4.863 -4.863 450 1HG MET 142 2HG MET 142 -2.508 -2.611 -2.611 451 2HG MET 142 1HG MET 142 -1.480 -3.222 -3.222 452 1HE MET 142 2HE MET 142 -2.094 -3.922 -3.922 453 2HE MET 142 1HE MET 142 -3.197 -5.212 -5.212 454 3HE MET 142 3HE MET 142 -3.752 -4.072 -4.072 455 H GLU 143 H GLU 143 -0.681 -7.375 -7.375 456 HA GLU 143 HA GLU 143 -3.093 -8.376 -8.376 457 1HB GLU 143 2HB GLU 143 -0.837 -9.808 -9.808 458 2HB GLU 143 1HB GLU 143 -0.428 -9.474 -9.474 459 1HG GLU 143 2HG GLU 143 -1.563 -11.502 -11.502 460 2HG GLU 143 1HG GLU 143 -2.949 -10.413 -10.413 461 H VAL 144 H VAL 144 -0.087 -6.968 -6.968 462 HA VAL 144 HA VAL 144 -0.578 -7.601 -7.601 463 HB VAL 144 HB VAL 144 1.378 -5.604 -5.604 464 1HG1 VAL 144 3HG1 VAL 144 0.766 -7.048 -7.048 465 2HG1 VAL 144 2HG1 VAL 144 2.425 -6.532 -6.532 466 3HG1 VAL 144 1HG1 VAL 144 1.111 -5.293 -5.293 467 1HG2 VAL 144 2HG2 VAL 144 0.973 -8.593 -8.593 468 2HG2 VAL 144 1HG2 VAL 144 1.521 -7.776 -7.776 469 3HG2 VAL 144 3HG2 VAL 144 2.676 -7.893 -7.893 470 H LEU 145 H LEU 145 -0.442 -4.513 -4.513 471 HA LEU 145 HA LEU 145 -1.364 -2.792 -2.792 472 1HB LEU 145 2HB LEU 145 -1.885 -3.012 -3.012 473 2HB LEU 145 1HB LEU 145 -2.445 -1.605 -1.605 474 HG LEU 145 HG LEU 145 0.402 -2.562 -2.562 475 1HD1 LEU 145 3HD1 LEU 145 -1.335 -0.189 -0.189 476 2HD1 LEU 145 2HD1 LEU 145 0.454 -0.232 -0.232 477 3HD1 LEU 145 1HD1 LEU 145 -0.604 -1.500 -1.500 478 1HD2 LEU 145 1HD2 LEU 145 -0.698 -0.552 -0.552 479 2HD2 LEU 145 3HD2 LEU 145 0.468 -1.867 -1.867 480 3HD2 LEU 145 2HD2 LEU 145 1.002 -0.402 -0.402 481 H ASN 146 H ASN 146 -3.296 -4.323 -4.323 482 HA ASN 146 HA ASN 146 -5.874 -3.488 -3.488 483 1HB ASN 146 2HB ASN 146 -4.605 -4.608 -4.608 484 2HB ASN 146 1HB ASN 146 -5.392 -6.086 -6.086 485 1HD2 ASN 146 1HD2 ASN 146 -5.877 -6.325 -6.325 486 2HD2 ASN 146 2HD2 ASN 146 -7.255 -5.651 -5.651 487 H ARG 147 H ARG 147 -4.003 -6.447 -6.447 488 HA ARG 147 HA ARG 147 -6.313 -7.173 -7.173 489 1HB ARG 147 2HB ARG 147 -5.094 -8.815 -8.815 490 2HB ARG 147 1HB ARG 147 -3.521 -8.137 -8.137 491 1HG ARG 147 2HG ARG 147 -3.693 -9.206 -9.206 492 2HG ARG 147 1HG ARG 147 -5.519 -9.038 -9.038 493 1HD ARG 147 2HD ARG 147 -4.774 -11.479 -11.479 494 2HD ARG 147 1HD ARG 147 -5.604 -10.970 -10.970 495 HE ARG 147 HE ARG 147 -2.801 -10.427 -10.427 496 1HH1 ARG 147 1HH2 ARG 147 -5.047 -13.164 -13.164 497 2HH1 ARG 147 2HH2 ARG 147 -4.026 -14.316 -14.316 498 1HH2 ARG 147 1HH1 ARG 147 -1.417 -11.999 -11.999 499 2HH2 ARG 147 2HH1 ARG 147 -1.935 -13.644 -13.644 500 H VAL 148 H VAL 148 -3.661 -4.800 -4.800 501 HA VAL 148 HA VAL 148 -3.606 -5.378 -5.378 502 HB VAL 148 HB VAL 148 -2.936 -2.734 -2.734 503 1HG1 VAL 148 3HG1 VAL 148 -2.958 -3.557 -3.557 504 2HG1 VAL 148 2HG1 VAL 148 -1.612 -4.663 -4.663 505 3HG1 VAL 148 1HG1 VAL 148 -1.382 -2.882 -2.882 506 1HG2 VAL 148 1HG2 VAL 148 -1.232 -5.216 -5.216 507 2HG2 VAL 148 3HG2 VAL 148 -1.783 -4.050 -4.050 508 3HG2 VAL 148 2HG2 VAL 148 -0.580 -3.527 -3.527 509 H LYS 149 H LYS 149 -5.140 -2.950 -2.950 510 HA LYS 149 HA LYS 149 -6.638 -1.501 -1.501 511 1HB LYS 149 2HB LYS 149 -6.526 -1.162 -1.162 512 2HB LYS 149 1HB LYS 149 -7.320 -2.778 -2.778 513 1HG LYS 149 2HG LYS 149 -9.349 -2.167 -2.167 514 2HG LYS 149 1HG LYS 149 -8.821 -0.637 -0.637 515 1HD LYS 149 2HD LYS 149 -9.199 -1.277 -1.277 516 2HD LYS 149 1HD LYS 149 -10.219 -0.214 -0.214 517 1HE LYS 149 2HE LYS 149 -8.929 1.591 1.591 518 2HE LYS 149 1HE LYS 149 -7.501 0.649 0.649 519 1HZ LYS 149 2HZ LYS 149 -10.158 1.113 1.113 520 2HZ LYS 149 1HZ LYS 149 -8.709 1.919 1.919 521 3HZ LYS 149 3HZ LYS 149 -8.855 0.254 0.254 522 H ASP 150 H ASP 150 -7.386 -4.770 -4.770 523 HA ASP 150 HA ASP 150 -10.028 -4.655 -4.655 524 1HB ASP 150 2HB ASP 150 -8.167 -6.558 -6.558 525 2HB ASP 150 1HB ASP 150 -9.577 -7.184 -7.184 526 H ASP 151 H ASP 151 -7.008 -6.242 -6.242 527 HA ASP 151 HA ASP 151 -8.725 -7.234 -7.234 528 1HB ASP 151 2HB ASP 151 -6.469 -8.179 -8.179 529 2HB ASP 151 1HB ASP 151 -5.740 -6.798 -6.798 530 H LEU 152 H LEU 152 -6.838 -4.089 -4.089 531 HA LEU 152 HA LEU 152 -7.320 -3.573 -3.573 532 1HB LEU 152 2HB LEU 152 -5.973 -2.421 -2.421 533 2HB LEU 152 1HB LEU 152 -7.045 -1.237 -1.237 534 HG LEU 152 HG LEU 152 -5.286 -3.052 -3.052 535 1HD1 LEU 152 1HD1 LEU 152 -4.047 -2.367 -2.367 536 2HD1 LEU 152 3HD1 LEU 152 -4.214 -0.613 -0.613 537 3HD1 LEU 152 2HD1 LEU 152 -3.296 -1.730 -1.730 538 1HD2 LEU 152 1HD2 LEU 152 -6.246 -0.163 -0.163 539 2HD2 LEU 152 3HD2 LEU 152 -6.851 -1.680 -1.680 540 3HD2 LEU 152 2HD2 LEU 152 -5.213 -1.070 -1.070 541 H GLN 153 H GLN 153 -9.074 -2.850 -2.850 542 HA GLN 153 HA GLN 153 -10.558 -1.044 -1.044 543 1HB GLN 153 2HB GLN 153 -10.603 -3.498 -3.498 544 2HB GLN 153 1HB GLN 153 -11.969 -3.682 -3.682 545 1HG GLN 153 2HG GLN 153 -13.027 -1.669 -1.669 546 2HG GLN 153 1HG GLN 153 -11.415 -1.604 -1.604 547 1HE2 GLN 153 1HE2 GLN 153 -11.698 -2.324 -2.324 548 2HE2 GLN 153 2HE2 GLN 153 -12.490 -3.793 -3.793 549 H GLU 154 H GLU 154 -10.808 -3.028 -3.028 550 HA GLU 154 HA GLU 154 -13.297 -2.360 -2.360 551 1HB GLU 154 2HB GLU 154 -10.915 -2.830 -2.830 552 2HB GLU 154 1HB GLU 154 -12.571 -3.454 -3.454 553 1HG GLU 154 2HG GLU 154 -11.964 -5.004 -5.004 554 2HG GLU 154 1HG GLU 154 -10.311 -4.244 -4.244 555 H LEU 155 H LEU 155 -10.079 -1.214 -1.214 556 HA LEU 155 HA LEU 155 -11.097 0.854 0.854 557 1HB LEU 155 2HB LEU 155 -9.364 -0.986 -0.986 558 2HB LEU 155 1HB LEU 155 -8.186 -0.069 -0.069 559 HG LEU 155 HG LEU 155 -9.678 1.567 1.567 560 1HD1 LEU 155 1HD1 LEU 155 -9.637 -0.597 -0.597 561 2HD1 LEU 155 3HD1 LEU 155 -7.855 -0.724 -0.724 562 3HD1 LEU 155 2HD1 LEU 155 -8.532 0.604 0.604 563 1HD2 LEU 155 1HD2 LEU 155 -6.661 1.106 1.106 564 2HD2 LEU 155 3HD2 LEU 155 -7.672 2.466 2.466 565 3HD2 LEU 155 2HD2 LEU 155 -7.363 2.322 2.322 566 H ALA 156 H ALA 156 -8.801 0.186 0.186 567 HA ALA 156 HA ALA 156 -8.447 3.098 3.098 568 1HB ALA 156 3HB ALA 156 -6.281 1.777 1.777 569 2HB ALA 156 2HB ALA 156 -6.948 0.915 0.915 570 3HB ALA 156 1HB ALA 156 -6.734 2.712 2.712 571 H VAL 157 H VAL 157 -9.549 4.002 4.002 572 HA VAL 157 HA VAL 157 -8.647 2.114 2.114 573 HB VAL 157 HB VAL 157 -10.266 2.793 2.793 574 1HG1 VAL 157 3HG1 VAL 157 -11.658 2.491 2.491 575 2HG1 VAL 157 2HG1 VAL 157 -12.467 2.380 2.380 576 3HG1 VAL 157 1HG1 VAL 157 -11.159 1.204 1.204 577 1HG2 VAL 157 1HG2 VAL 157 -10.415 5.340 5.340 578 2HG2 VAL 157 3HG2 VAL 157 -10.481 5.016 5.016 579 3HG2 VAL 157 2HG2 VAL 157 -11.955 4.761 4.761 580 H VAL 158 H VAL 158 -8.461 2.674 2.674 581 HA VAL 158 HA VAL 158 -6.217 4.319 4.319 582 HB VAL 158 HB VAL 158 -7.547 2.950 2.950 583 1HG1 VAL 158 2HG1 VAL 158 -5.372 4.055 4.055 584 2HG1 VAL 158 1HG1 VAL 158 -4.595 2.955 2.955 585 3HG1 VAL 158 3HG1 VAL 158 -5.376 2.284 2.284 586 1HG2 VAL 158 1HG2 VAL 158 -6.224 1.533 1.533 587 2HG2 VAL 158 3HG2 VAL 158 -7.846 1.209 1.209 588 3HG2 VAL 158 2HG2 VAL 158 -6.328 0.800 0.800 589 H GLU 159 H GLU 159 -5.817 5.915 5.915 590 HA GLU 159 HA GLU 159 -8.012 7.671 7.671 591 1HB GLU 159 2HB GLU 159 -5.675 8.248 8.248 592 2HB GLU 159 1HB GLU 159 -5.218 7.753 7.753 593 1HG GLU 159 2HG GLU 159 -6.701 9.678 9.678 594 2HG GLU 159 1HG GLU 159 -7.119 10.061 10.061 595 H SER 160 H SER 160 -5.866 5.617 5.617 596 HA SER 160 HA SER 160 -7.614 5.885 5.885 597 1HB SER 160 2HB SER 160 -5.712 7.648 7.648 598 2HB SER 160 1HB SER 160 -4.716 6.187 6.187 599 HG SER 160 HG SER 160 -6.198 5.846 5.846 600 H PHE 161 H PHE 161 -7.187 4.095 4.095 601 HA PHE 161 HA PHE 161 -5.208 2.247 2.247 602 1HB PHE 161 2HB PHE 161 -7.642 1.441 1.441 603 2HB PHE 161 1HB PHE 161 -7.058 1.291 1.291 604 HD1 PHE 161 2HD PHE 161 -6.466 0.437 0.437 605 HD2 PHE 161 1HD PHE 161 -5.896 -0.732 -0.732 606 HE1 PHE 161 2HE PHE 161 -5.116 -1.337 -1.337 607 HE2 PHE 161 1HE PHE 161 -4.420 -2.477 -2.477 608 HZ PHE 161 HZ PHE 161 -3.829 -2.694 -2.694 609 HA PRO 162 HA PRO 162 -3.571 5.282 5.282 610 1HB PRO 162 2HB PRO 162 -0.911 4.272 4.272 611 2HB PRO 162 1HB PRO 162 -1.433 5.222 5.222 612 1HG PRO 162 2HG PRO 162 -1.150 2.218 2.218 613 2HG PRO 162 1HG PRO 162 -0.781 3.128 3.128 614 1HD PRO 162 2HD PRO 162 -3.083 1.699 1.699 615 2HD PRO 162 1HD PRO 162 -3.137 3.317 3.317 616 H THR 163 H THR 163 -2.565 2.011 2.011 617 HA THR 163 HA THR 163 -1.046 1.417 1.417 618 HB THR 163 HB THR 163 -3.533 1.791 1.791 619 HG1 THR 163 1HG THR 163 -4.337 0.141 0.141 620 1HG2 THR 163 1HG2 THR 163 -1.668 0.074 0.074 621 2HG2 THR 163 3HG2 THR 163 -1.709 -0.593 -0.593 622 3HG2 THR 163 2HG2 THR 163 -3.123 -0.837 -0.837 623 H LYS 164 H LYS 164 -0.660 3.948 3.948 624 HA LYS 164 HA LYS 164 0.605 4.050 4.050 625 1HB LYS 164 2HB LYS 164 -0.218 6.494 6.494 626 2HB LYS 164 1HB LYS 164 0.873 6.564 6.564 627 1HG LYS 164 2HG LYS 164 -0.977 5.666 5.666 628 2HG LYS 164 1HG LYS 164 -2.078 5.670 5.670 629 1HD LYS 164 2HD LYS 164 -1.773 8.144 8.144 630 2HD LYS 164 1HD LYS 164 -0.673 8.141 8.141 631 1HE LYS 164 2HE LYS 164 -2.559 7.309 7.309 632 2HE LYS 164 1HE LYS 164 -3.665 7.344 7.344 633 1HZ LYS 164 1HZ LYS 164 -3.222 9.701 9.701 634 2HZ LYS 164 3HZ LYS 164 -2.207 9.661 9.661 635 3HZ LYS 164 2HZ LYS 164 -3.861 9.317 9.317 636 H ILE 165 H ILE 165 2.641 3.187 3.187 637 HA ILE 165 HA ILE 165 3.804 3.685 3.685 638 HB ILE 165 HB ILE 165 5.182 2.619 2.619 639 1HG1 ILE 165 2HG1 ILE 165 2.809 1.343 1.343 640 2HG1 ILE 165 1HG1 ILE 165 3.278 1.387 1.387 641 1HG2 ILE 165 1HG2 ILE 165 6.562 2.883 2.883 642 2HG2 ILE 165 3HG2 ILE 165 5.467 1.832 1.832 643 3HG2 ILE 165 2HG2 ILE 165 6.415 1.165 1.165 644 1HD1 ILE 165 3HD1 ILE 165 5.229 -0.233 -0.233 645 2HD1 ILE 165 2HD1 ILE 165 4.331 -0.338 -0.338 646 3HD1 ILE 165 1HD1 ILE 165 3.547 -0.879 -0.879 647 H GLU 166 H GLU 166 5.589 4.923 4.923 648 HA GLU 166 HA GLU 166 6.489 6.687 6.687 649 1HB GLU 166 2HB GLU 166 6.219 7.370 7.370 650 2HB GLU 166 1HB GLU 166 7.049 8.398 8.398 651 1HG GLU 166 2HG GLU 166 4.876 8.651 8.651 652 2HG GLU 166 1HG GLU 166 4.042 7.674 7.674 653 H GLY 167 H GLY 167 8.429 5.754 5.754 654 1HA GLY 167 2HA GLY 167 10.585 5.113 5.113 655 2HA GLY 167 1HA GLY 167 10.340 5.331 5.331 656 H ARG 168 H ARG 168 11.329 3.346 3.346 657 HA ARG 168 HA ARG 168 10.051 0.976 0.976 658 1HB ARG 168 2HB ARG 168 11.998 -0.237 -0.237 659 2HB ARG 168 1HB ARG 168 12.461 0.952 0.952 660 1HG ARG 168 2HG ARG 168 13.045 2.637 2.637 661 2HG ARG 168 1HG ARG 168 12.607 1.467 1.467 662 1HD ARG 168 2HD ARG 168 14.404 -0.093 -0.093 663 2HD ARG 168 1HD ARG 168 14.856 1.108 1.108 664 HE ARG 168 HE ARG 168 14.776 2.424 2.424 665 1HH1 ARG 168 1HH2 ARG 168 16.639 0.043 0.043 666 2HH1 ARG 168 2HH2 ARG 168 18.146 0.378 0.378 667 1HH2 ARG 168 1HH1 ARG 168 16.825 2.875 2.875 668 2HH2 ARG 168 2HH1 ARG 168 18.253 2.011 2.011 669 H GLN 169 H GLN 169 8.503 2.526 2.526 670 HA GLN 169 HA GLN 169 8.087 0.840 0.840 671 1HB GLN 169 2HB GLN 169 9.005 3.696 3.696 672 2HB GLN 169 1HB GLN 169 8.276 2.864 2.864 673 1HG GLN 169 2HG GLN 169 10.333 1.298 1.298 674 2HG GLN 169 1HG GLN 169 11.050 2.393 2.393 675 1HE2 GLN 169 1HE2 GLN 169 9.432 2.498 2.498 676 2HE2 GLN 169 2HE2 GLN 169 10.353 3.817 3.817 677 H MET 170 H MET 170 5.946 1.397 1.397 678 HA MET 170 HA MET 170 4.621 3.628 3.628 679 1HB MET 170 2HB MET 170 3.922 1.549 1.549 680 2HB MET 170 1HB MET 170 3.432 0.808 0.808 681 1HG MET 170 2HG MET 170 1.574 2.441 2.441 682 2HG MET 170 1HG MET 170 2.294 3.331 3.331 683 1HE MET 170 3HE MET 170 1.608 -0.503 -0.503 684 2HE MET 170 2HE MET 170 -0.049 0.200 0.200 685 3HE MET 170 1HE MET 170 0.380 -0.915 -0.915 686 H ILE 171 H ILE 171 3.844 5.016 5.016 687 HA ILE 171 HA ILE 171 3.266 4.020 4.020 688 HB ILE 171 HB ILE 171 2.694 6.705 6.705 689 1HG1 ILE 171 2HG1 ILE 171 5.133 5.893 5.893 690 2HG1 ILE 171 1HG1 ILE 171 4.665 7.508 7.508 691 1HG2 ILE 171 3HG2 ILE 171 2.259 5.559 5.559 692 2HG2 ILE 171 2HG2 ILE 171 2.526 7.344 7.344 693 3HG2 ILE 171 1HG2 ILE 171 1.095 6.573 6.573 694 1HD1 ILE 171 3HD1 ILE 171 4.253 6.144 6.144 695 2HD1 ILE 171 2HD1 ILE 171 4.923 4.781 4.781 696 3HD1 ILE 171 1HD1 ILE 171 5.977 6.197 6.197 697 H MET 172 H MET 172 1.435 3.190 3.190 698 HA MET 172 HA MET 172 -1.154 4.063 4.063 699 1HB MET 172 2HB MET 172 -1.203 1.627 1.627 700 2HB MET 172 1HB MET 172 -0.348 1.595 1.595 701 1HG MET 172 2HG MET 172 -2.296 2.334 2.334 702 2HG MET 172 1HG MET 172 -3.087 2.905 2.905 703 1HE MET 172 1HE MET 172 -3.656 0.990 0.990 704 2HE MET 172 3HE MET 172 -4.223 -0.640 -0.640 705 3HE MET 172 2HE MET 172 -2.466 -0.328 -0.328 706 H VAL 173 H VAL 173 -2.289 5.376 5.376 707 HA VAL 173 HA VAL 173 -0.702 6.201 6.201 708 HB VAL 173 HB VAL 173 -3.181 7.492 7.492 709 1HG1 VAL 173 2HG1 VAL 173 -1.276 7.874 7.874 710 2HG1 VAL 173 1HG1 VAL 173 -1.745 9.419 9.419 711 3HG1 VAL 173 3HG1 VAL 173 -3.005 8.386 8.386 712 1HG2 VAL 173 1HG2 VAL 173 -0.192 8.041 8.041 713 2HG2 VAL 173 3HG2 VAL 173 -1.405 7.434 7.434 714 3HG2 VAL 173 2HG2 VAL 173 -1.548 9.098 9.098 715 H LEU 174 H LEU 174 -1.783 5.845 5.845 716 HA LEU 174 HA LEU 174 -4.625 4.808 4.808 717 1HB LEU 174 2HB LEU 174 -3.570 2.794 2.794 718 2HB LEU 174 1HB LEU 174 -2.188 3.406 3.406 719 HG LEU 174 HG LEU 174 -3.809 3.787 3.787 720 1HD1 LEU 174 1HD1 LEU 174 -5.441 2.708 2.708 721 2HD1 LEU 174 3HD1 LEU 174 -5.599 1.683 1.683 722 3HD1 LEU 174 2HD1 LEU 174 -5.958 3.473 3.473 723 1HD2 LEU 174 3HD2 LEU 174 -3.264 0.941 0.941 724 2HD2 LEU 174 2HD2 LEU 174 -2.164 2.106 2.106 725 3HD2 LEU 174 1HD2 LEU 174 -3.789 1.576 1.576 726 H ALA 175 H ALA 175 -5.973 5.605 5.605 727 HA ALA 175 HA ALA 175 -4.756 7.460 7.460 728 1HB ALA 175 1HB ALA 175 -6.008 8.408 8.408 729 2HB ALA 175 3HB ALA 175 -7.420 7.356 7.356 730 3HB ALA 175 2HB ALA 175 -6.944 8.805 8.805 731 HA PRO 176 HA PRO 176 -7.933 5.818 5.818 732 1HB PRO 176 2HB PRO 176 -8.883 8.701 8.701 733 2HB PRO 176 1HB PRO 176 -8.664 7.532 7.532 734 1HG PRO 176 2HG PRO 176 -6.790 9.482 9.482 735 2HG PRO 176 1HG PRO 176 -6.253 7.783 7.783 736 1HD PRO 176 2HD PRO 176 -6.416 9.189 9.189 737 2HD PRO 176 1HD PRO 176 -5.138 8.068 8.068 738 H LYS 177 H LYS 177 -10.062 5.054 5.054 739 HA LYS 177 HA LYS 177 -11.290 5.797 5.797 740 1HB LYS 177 2HB LYS 177 -11.693 3.577 3.577 741 2HB LYS 177 1HB LYS 177 -12.566 4.505 4.505 742 1HG LYS 177 2HG LYS 177 -14.206 5.290 5.290 743 2HG LYS 177 1HG LYS 177 -13.375 4.124 4.124 744 1HD LYS 177 2HD LYS 177 -14.781 3.466 3.466 745 2HD LYS 177 1HD LYS 177 -15.541 3.344 3.344 746 1HE LYS 177 2HE LYS 177 -13.848 1.623 1.623 747 2HE LYS 177 1HE LYS 177 -13.117 1.691 1.691 748 1HZ LYS 177 1HZ LYS 177 -15.270 1.066 1.066 749 2HZ LYS 177 3HZ LYS 177 -15.924 0.967 0.967 750 3HZ LYS 177 2HZ LYS 177 -14.679 -0.090 -0.090 751 H LYS 178 H LYS 178 -12.589 7.415 7.415 752 HA LYS 178 HA LYS 178 -12.681 9.528 9.528 753 1HB LYS 178 2HB LYS 178 -13.828 9.111 9.111 754 2HB LYS 178 1HB LYS 178 -13.807 10.697 10.697 755 1HG LYS 178 2HG LYS 178 -11.964 10.930 10.930 756 2HG LYS 178 1HG LYS 178 -11.175 10.274 10.274 757 1HD LYS 178 2HD LYS 178 -11.193 7.972 7.972 758 2HD LYS 178 1HD LYS 178 -11.997 8.691 8.691 759 1HE LYS 178 2HE LYS 178 -9.976 10.123 10.123 760 2HE LYS 178 1HE LYS 178 -9.185 9.424 9.424 761 1HZ LYS 178 3HZ LYS 178 -9.342 7.252 7.252 762 2HZ LYS 178 2HZ LYS 178 -10.083 7.907 7.907 763 3HZ LYS 178 1HZ LYS 178 -8.485 8.330 8.330 764 H LYS 179 H LYS 179 -14.285 10.111 10.111 765 HA LYS 179 HA LYS 179 -16.838 8.840 8.840 766 1HB LYS 179 2HB LYS 179 -15.857 11.358 11.358 767 2HB LYS 179 1HB LYS 179 -17.500 10.647 10.647 768 1HG LYS 179 2HG LYS 179 -16.500 8.525 8.525 769 2HG LYS 179 1HG LYS 179 -14.852 9.236 9.236 770 1HD LYS 179 2HD LYS 179 -15.440 10.993 10.993 771 2HD LYS 179 1HD LYS 179 -17.134 10.392 10.392 772 1HE LYS 179 2HE LYS 179 -15.839 9.601 9.601 773 2HE LYS 179 1HE LYS 179 -16.320 8.197 8.197 774 1HZ LYS 179 1HZ LYS 179 -14.122 8.242 8.242 775 2HZ LYS 179 3HZ LYS 179 -13.674 9.555 9.555 776 3HZ LYS 179 2HZ LYS 179 -14.047 8.056 8.056 777 H GLN 180 H GLN 180 -18.555 9.437 9.437 778 HA GLN 180 HA GLN 180 -18.205 11.604 11.604 779 1HB GLN 180 2HB GLN 180 -19.500 9.527 9.527 780 2HB GLN 180 1HB GLN 180 -20.725 9.969 9.969 781 1HG GLN 180 2HG GLN 180 -21.258 12.078 12.078 782 2HG GLN 180 1HG GLN 180 -19.995 11.652 11.652 783 1HE2 GLN 180 1HE2 GLN 180 -20.211 9.422 9.422 784 2HE2 GLN 180 2HE2 GLN 180 -21.802 8.852 8.852 Start of MODEL 2 1 HA VAL 90 HA VAL 90 -3.728 17.129 17.129 2 HB VAL 90 HB VAL 90 -2.454 17.343 17.343 3 1HG1 VAL 90 1HG1 VAL 90 -2.617 19.653 19.653 4 2HG1 VAL 90 3HG1 VAL 90 -2.469 19.749 19.749 5 3HG1 VAL 90 2HG1 VAL 90 -3.901 18.927 18.927 6 1HG2 VAL 90 3HG2 VAL 90 -0.165 18.202 18.202 7 2HG2 VAL 90 2HG2 VAL 90 -0.226 16.733 16.733 8 3HG2 VAL 90 1HG2 VAL 90 -0.248 18.377 18.377 9 H ILE 91 H ILE 91 -3.225 15.809 15.809 10 HA ILE 91 HA ILE 91 -2.796 13.094 13.094 11 HB ILE 91 HB ILE 91 -3.723 14.190 14.190 12 1HG1 ILE 91 2HG1 ILE 91 -5.388 14.656 14.656 13 2HG1 ILE 91 1HG1 ILE 91 -5.955 13.298 13.298 14 1HG2 ILE 91 1HG2 ILE 91 -3.486 11.303 11.303 15 2HG2 ILE 91 3HG2 ILE 91 -4.464 11.767 11.767 16 3HG2 ILE 91 2HG2 ILE 91 -2.688 11.996 11.996 17 1HD1 ILE 91 1HD1 ILE 91 -5.158 11.665 11.665 18 2HD1 ILE 91 3HD1 ILE 91 -4.716 13.067 13.067 19 3HD1 ILE 91 2HD1 ILE 91 -6.439 12.798 12.798 20 H GLN 92 H GLN 92 -1.035 11.997 11.997 21 HA GLN 92 HA GLN 92 1.220 13.440 13.440 22 1HB GLN 92 2HB GLN 92 1.055 10.931 10.931 23 2HB GLN 92 1HB GLN 92 2.516 11.945 11.945 24 1HG GLN 92 2HG GLN 92 1.572 13.754 13.754 25 2HG GLN 92 1HG GLN 92 -0.084 13.098 13.098 26 1HE2 GLN 92 1HE2 GLN 92 -0.877 12.251 12.251 27 2HE2 GLN 92 2HE2 GLN 92 -0.025 11.401 11.401 28 H VAL 93 H VAL 93 2.937 11.937 11.937 29 HA VAL 93 HA VAL 93 1.475 9.891 9.891 30 HB VAL 93 HB VAL 93 4.047 11.304 11.304 31 1HG1 VAL 93 1HG1 VAL 93 2.512 8.839 8.839 32 2HG1 VAL 93 3HG1 VAL 93 3.704 9.727 9.727 33 3HG1 VAL 93 2HG1 VAL 93 4.306 8.844 8.844 34 1HG2 VAL 93 2HG2 VAL 93 1.554 12.163 12.163 35 2HG2 VAL 93 1HG2 VAL 93 2.698 11.888 11.888 36 3HG2 VAL 93 3HG2 VAL 93 1.531 10.591 10.591 37 H LYS 94 H LYS 94 1.698 7.734 7.734 38 HA LYS 94 HA LYS 94 4.558 7.223 7.223 39 1HB LYS 94 2HB LYS 94 2.356 5.202 5.202 40 2HB LYS 94 1HB LYS 94 3.968 5.114 5.114 41 1HG LYS 94 2HG LYS 94 1.800 7.156 7.156 42 2HG LYS 94 1HG LYS 94 2.026 5.625 5.625 43 1HD LYS 94 2HD LYS 94 4.190 7.812 7.812 44 2HD LYS 94 1HD LYS 94 3.065 7.628 7.628 45 1HE LYS 94 2HE LYS 94 5.115 5.483 5.483 46 2HE LYS 94 1HE LYS 94 5.294 6.634 6.634 47 1HZ LYS 94 2HZ LYS 94 3.327 5.692 5.692 48 2HZ LYS 94 1HZ LYS 94 3.138 4.616 4.616 49 3HZ LYS 94 3HZ LYS 94 4.496 4.494 4.494 50 H GLU 95 H GLU 95 5.217 4.994 4.994 51 HA GLU 95 HA GLU 95 3.865 4.662 4.662 52 1HB GLU 95 2HB GLU 95 5.867 6.270 6.270 53 2HB GLU 95 1HB GLU 95 6.793 4.803 4.803 54 1HG GLU 95 2HG GLU 95 6.221 3.687 3.687 55 2HG GLU 95 1HG GLU 95 5.186 5.102 5.102 56 H ILE 96 H ILE 96 4.169 2.542 2.542 57 HA ILE 96 HA ILE 96 5.792 0.722 0.722 58 HB ILE 96 HB ILE 96 3.078 0.534 0.534 59 1HG1 ILE 96 2HG1 ILE 96 3.299 -1.990 -1.990 60 2HG1 ILE 96 1HG1 ILE 96 4.977 -1.877 -1.877 61 1HG2 ILE 96 2HG2 ILE 96 2.717 0.473 0.473 62 2HG2 ILE 96 1HG2 ILE 96 3.528 -1.162 -1.162 63 3HG2 ILE 96 3HG2 ILE 96 2.085 -0.944 -0.944 64 1HD1 ILE 96 2HD1 ILE 96 5.538 -0.416 -0.416 65 2HD1 ILE 96 1HD1 ILE 96 3.838 -0.643 -0.643 66 3HD1 ILE 96 3HD1 ILE 96 4.943 -2.057 -2.057 67 H LYS 97 H LYS 97 6.647 -1.101 -1.101 68 HA LYS 97 HA LYS 97 6.010 -0.440 -0.440 69 1HB LYS 97 2HB LYS 97 8.648 -1.747 -1.747 70 2HB LYS 97 1HB LYS 97 7.942 -1.419 -1.419 71 1HG LYS 97 2HG LYS 97 7.934 1.065 1.065 72 2HG LYS 97 1HG LYS 97 8.923 0.669 0.669 73 1HD LYS 97 2HD LYS 97 10.716 -0.252 -0.252 74 2HD LYS 97 1HD LYS 97 9.676 -0.003 -0.003 75 1HE LYS 97 2HE LYS 97 9.709 2.479 2.479 76 2HE LYS 97 1HE LYS 97 10.779 2.238 2.238 77 1HZ LYS 97 2HZ LYS 97 12.399 1.213 1.213 78 2HZ LYS 97 1HZ LYS 97 11.395 1.450 1.450 79 3HZ LYS 97 3HZ LYS 97 12.020 2.788 2.788 80 H PHE 98 H PHE 98 5.809 -2.194 -2.194 81 HA PHE 98 HA PHE 98 5.706 -4.824 -4.824 82 1HB PHE 98 2HB PHE 98 3.573 -3.444 -3.444 83 2HB PHE 98 1HB PHE 98 3.662 -5.227 -5.227 84 HD1 PHE 98 1HD PHE 98 4.001 -5.991 -5.991 85 HD2 PHE 98 2HD PHE 98 1.978 -2.715 -2.715 86 HE1 PHE 98 1HE PHE 98 2.766 -5.792 -5.792 87 HE2 PHE 98 2HE PHE 98 0.614 -2.489 -2.489 88 HZ PHE 98 HZ PHE 98 0.907 -4.226 -4.226 89 H ARG 99 H ARG 99 7.390 -5.779 -5.779 90 HA ARG 99 HA ARG 99 7.973 -5.005 -5.005 91 1HB ARG 99 2HB ARG 99 9.275 -6.864 -6.864 92 2HB ARG 99 1HB ARG 99 9.806 -6.631 -6.631 93 1HG ARG 99 2HG ARG 99 10.171 -4.212 -4.212 94 2HG ARG 99 1HG ARG 99 9.638 -4.398 -4.398 95 1HD ARG 99 2HD ARG 99 12.125 -4.306 -4.306 96 2HD ARG 99 1HD ARG 99 11.593 -5.952 -5.952 97 HE ARG 99 HE ARG 99 11.809 -5.953 -5.953 98 1HH1 ARG 99 1HH1 ARG 99 13.769 -5.749 -5.749 99 2HH1 ARG 99 2HH1 ARG 99 15.147 -6.553 -6.553 100 1HH2 ARG 99 1HH2 ARG 99 13.694 -7.040 -7.040 101 2HH2 ARG 99 2HH2 ARG 99 15.107 -7.288 -7.288 102 HA PRO 100 HA PRO 100 6.046 -8.787 -8.787 103 1HB PRO 100 2HB PRO 100 8.099 -9.632 -9.632 104 2HB PRO 100 1HB PRO 100 6.715 -8.570 -8.570 105 1HG PRO 100 2HG PRO 100 9.569 -7.852 -7.852 106 2HG PRO 100 1HG PRO 100 8.471 -7.000 -7.000 107 1HD PRO 100 2HD PRO 100 9.084 -6.094 -6.094 108 2HD PRO 100 1HD PRO 100 7.440 -5.772 -5.772 109 H GLY 101 H GLY 101 6.205 -10.924 -10.924 110 1HA GLY 101 2HA GLY 101 7.207 -12.800 -12.800 111 2HA GLY 101 1HA GLY 101 8.777 -11.887 -11.887 112 H THR 102 H THR 102 6.416 -10.145 -10.145 113 HA THR 102 HA THR 102 6.893 -10.953 -10.953 114 HB THR 102 HB THR 102 5.695 -8.247 -8.247 115 HG1 THR 102 1HG THR 102 8.271 -9.055 -9.055 116 1HG2 THR 102 1HG2 THR 102 6.238 -10.003 -10.003 117 2HG2 THR 102 3HG2 THR 102 6.532 -8.210 -8.210 118 3HG2 THR 102 2HG2 THR 102 4.909 -8.822 -8.822 119 H ASP 103 H ASP 103 5.640 -12.587 -12.587 120 HA ASP 103 HA ASP 103 2.835 -12.039 -12.039 121 1HB ASP 103 2HB ASP 103 3.756 -13.227 -13.227 122 2HB ASP 103 1HB ASP 103 4.015 -14.580 -14.580 123 H GLU 104 H GLU 104 3.850 -15.380 -15.380 124 HA GLU 104 HA GLU 104 1.391 -13.935 -13.935 125 1HB GLU 104 2HB GLU 104 0.518 -15.870 -15.870 126 2HB GLU 104 1HB GLU 104 0.907 -16.182 -16.182 127 1HG GLU 104 2HG GLU 104 3.111 -17.185 -17.185 128 2HG GLU 104 1HG GLU 104 2.708 -16.971 -16.971 129 H GLY 105 H GLY 105 3.323 -15.302 -15.302 130 1HA GLY 105 2HA GLY 105 2.218 -13.039 -13.039 131 2HA GLY 105 1HA GLY 105 2.769 -14.624 -14.624 132 H ASP 106 H ASP 106 4.477 -12.869 -12.869 133 HA ASP 106 HA ASP 106 6.135 -11.490 -11.490 134 1HB ASP 106 2HB ASP 106 7.200 -12.606 -12.606 135 2HB ASP 106 1HB ASP 106 6.386 -11.425 -11.425 136 H TYR 107 H TYR 107 3.868 -11.412 -11.412 137 HA TYR 107 HA TYR 107 3.736 -8.643 -8.643 138 1HB TYR 107 2HB TYR 107 3.221 -10.534 -10.534 139 2HB TYR 107 1HB TYR 107 1.810 -11.006 -11.006 140 HD1 TYR 107 2HD TYR 107 1.913 -7.474 -7.474 141 HD2 TYR 107 1HD TYR 107 0.973 -11.135 -11.135 142 HE1 TYR 107 2HE TYR 107 -0.181 -6.514 -6.514 143 HE2 TYR 107 1HE TYR 107 -0.728 -9.984 -9.984 144 HH TYR 107 HH TYR 107 -2.075 -8.218 -8.218 145 H GLN 108 H GLN 108 0.809 -10.550 -10.550 146 HA GLN 108 HA GLN 108 -0.150 -8.386 -8.386 147 1HB GLN 108 2HB GLN 108 -1.340 -10.620 -10.620 148 2HB GLN 108 1HB GLN 108 -1.984 -9.441 -9.441 149 1HG GLN 108 2HG GLN 108 -0.308 -11.868 -11.868 150 2HG GLN 108 1HG GLN 108 -2.026 -11.900 -11.900 151 1HE2 GLN 108 1HE2 GLN 108 -1.177 -8.716 -8.716 152 2HE2 GLN 108 2HE2 GLN 108 -1.512 -8.966 -8.966 153 H VAL 109 H VAL 109 2.240 -9.988 -9.988 154 HA VAL 109 HA VAL 109 1.781 -9.112 -9.112 155 HB VAL 109 HB VAL 109 4.357 -9.647 -9.647 156 1HG1 VAL 109 2HG1 VAL 109 3.956 -8.751 -8.751 157 2HG1 VAL 109 1HG1 VAL 109 5.422 -9.611 -9.611 158 3HG1 VAL 109 3HG1 VAL 109 5.030 -7.995 -7.995 159 1HG2 VAL 109 3HG2 VAL 109 2.851 -11.593 -11.593 160 2HG2 VAL 109 2HG2 VAL 109 4.361 -11.650 -11.650 161 3HG2 VAL 109 1HG2 VAL 109 2.816 -11.102 -11.102 162 H LYS 110 H LYS 110 3.246 -7.553 -7.553 163 HA LYS 110 HA LYS 110 3.392 -5.043 -5.043 164 1HB LYS 110 2HB LYS 110 4.316 -5.979 -5.979 165 2HB LYS 110 1HB LYS 110 4.403 -4.288 -4.288 166 1HG LYS 110 2HG LYS 110 5.886 -6.727 -6.727 167 2HG LYS 110 1HG LYS 110 6.468 -5.056 -5.056 168 1HD LYS 110 2HD LYS 110 5.643 -4.116 -4.116 169 2HD LYS 110 1HD LYS 110 5.096 -5.747 -5.747 170 1HE LYS 110 2HE LYS 110 7.463 -6.584 -6.584 171 2HE LYS 110 1HE LYS 110 8.020 -4.934 -4.934 172 1HZ LYS 110 2HZ LYS 110 7.106 -4.067 -4.067 173 2HZ LYS 110 1HZ LYS 110 6.605 -5.619 -5.619 174 3HZ LYS 110 3HZ LYS 110 8.259 -5.278 -5.278 175 H LEU 111 H LEU 111 1.062 -6.629 -6.629 176 HA LEU 111 HA LEU 111 -0.271 -4.231 -4.231 177 1HB LEU 111 2HB LEU 111 -0.641 -6.580 -6.580 178 2HB LEU 111 1HB LEU 111 -1.506 -6.960 -6.960 179 HG LEU 111 HG LEU 111 -2.323 -4.638 -4.638 180 1HD1 LEU 111 2HD1 LEU 111 -1.982 -6.695 -6.695 181 2HD1 LEU 111 1HD1 LEU 111 -3.125 -7.597 -7.597 182 3HD1 LEU 111 3HD1 LEU 111 -3.709 -6.194 -6.194 183 1HD2 LEU 111 2HD2 LEU 111 -3.845 -6.499 -6.499 184 2HD2 LEU 111 1HD2 LEU 111 -3.593 -4.715 -4.715 185 3HD2 LEU 111 3HD2 LEU 111 -4.662 -5.395 -5.395 186 H ARG 112 H ARG 112 0.266 -6.371 -6.371 187 HA ARG 112 HA ARG 112 -1.527 -5.136 -5.136 188 1HB ARG 112 2HB ARG 112 -0.221 -7.322 -7.322 189 2HB ARG 112 1HB ARG 112 0.973 -6.228 -6.228 190 1HG ARG 112 2HG ARG 112 -0.844 -5.335 -5.335 191 2HG ARG 112 1HG ARG 112 -2.030 -6.407 -6.407 192 1HD ARG 112 2HD ARG 112 -0.743 -8.428 -8.428 193 2HD ARG 112 1HD ARG 112 0.397 -7.332 -7.332 194 HE ARG 112 HE ARG 112 -2.281 -6.633 -6.633 195 1HH1 ARG 112 1HH2 ARG 112 -0.002 -9.366 -9.366 196 2HH1 ARG 112 2HH2 ARG 112 -0.669 -9.996 -9.996 197 1HH2 ARG 112 1HH1 ARG 112 -3.190 -7.500 -7.500 198 2HH2 ARG 112 2HH1 ARG 112 -2.507 -8.919 -8.919 199 H SER 113 H SER 113 2.081 -4.361 -4.361 200 HA SER 113 HA SER 113 2.129 -2.437 -2.437 201 1HB SER 113 2HB SER 113 3.761 -2.576 -2.576 202 2HB SER 113 1HB SER 113 3.987 -1.409 -1.409 203 HG SER 113 HG SER 113 4.137 -3.195 -3.195 204 H LEU 114 H LEU 114 1.015 -2.182 -2.182 205 HA LEU 114 HA LEU 114 0.757 0.555 0.555 206 1HB LEU 114 2HB LEU 114 1.222 -1.177 -1.177 207 2HB LEU 114 1HB LEU 114 -0.197 -2.124 -2.124 208 HG LEU 114 HG LEU 114 -1.672 -0.421 -0.421 209 1HD1 LEU 114 1HD1 LEU 114 0.919 0.979 0.979 210 2HD1 LEU 114 3HD1 LEU 114 -0.727 1.508 1.508 211 3HD1 LEU 114 2HD1 LEU 114 -0.246 1.591 1.591 212 1HD2 LEU 114 1HD2 LEU 114 -1.019 -2.364 -2.364 213 2HD2 LEU 114 3HD2 LEU 114 -1.447 -0.979 -0.979 214 3HD2 LEU 114 2HD2 LEU 114 0.282 -1.425 -1.425 215 H ILE 115 H ILE 115 -1.562 -2.138 -2.138 216 HA ILE 115 HA ILE 115 -3.789 -0.568 -0.568 217 HB ILE 115 HB ILE 115 -3.215 -2.055 -2.055 218 1HG1 ILE 115 2HG1 ILE 115 -2.672 -3.707 -3.707 219 2HG1 ILE 115 1HG1 ILE 115 -4.174 -4.099 -4.099 220 1HG2 ILE 115 2HG2 ILE 115 -5.616 -1.227 -1.227 221 2HG2 ILE 115 1HG2 ILE 115 -5.755 -2.353 -2.353 222 3HG2 ILE 115 3HG2 ILE 115 -5.161 -0.682 -0.682 223 1HD1 ILE 115 1HD1 ILE 115 -5.492 -3.305 -3.305 224 2HD1 ILE 115 3HD1 ILE 115 -3.872 -3.040 -3.040 225 3HD1 ILE 115 2HD1 ILE 115 -4.412 -4.710 -4.710 226 H ARG 116 H ARG 116 -1.267 -0.961 -0.961 227 HA ARG 116 HA ARG 116 -2.190 0.638 0.638 228 1HB ARG 116 2HB ARG 116 -0.218 -0.968 -0.968 229 2HB ARG 116 1HB ARG 116 0.771 0.269 0.269 230 1HG ARG 116 2HG ARG 116 1.242 0.313 0.313 231 2HG ARG 116 1HG ARG 116 0.446 1.855 1.855 232 1HD ARG 116 2HD ARG 116 -1.718 1.025 1.025 233 2HD ARG 116 1HD ARG 116 -0.909 -0.557 -0.557 234 HE ARG 116 HE ARG 116 0.702 1.559 1.559 235 1HH1 ARG 116 1HH1 ARG 116 -2.531 0.106 0.106 236 2HH1 ARG 116 2HH1 ARG 116 -2.665 0.516 0.516 237 1HH2 ARG 116 1HH2 ARG 116 0.517 2.103 2.103 238 2HH2 ARG 116 2HH2 ARG 116 -0.903 1.665 1.665 239 H PHE 117 H PHE 117 -0.137 1.552 1.552 240 HA PHE 117 HA PHE 117 0.353 4.158 4.158 241 1HB PHE 117 2HB PHE 117 -0.264 2.835 2.835 242 2HB PHE 117 1HB PHE 117 0.468 4.444 4.444 243 HD1 PHE 117 2HD PHE 117 1.916 2.473 2.473 244 HD2 PHE 117 1HD PHE 117 1.522 2.934 2.934 245 HE1 PHE 117 2HE PHE 117 4.167 1.538 1.538 246 HE2 PHE 117 1HE PHE 117 3.766 1.815 1.815 247 HZ PHE 117 HZ PHE 117 5.102 1.180 1.180 248 H LEU 118 H LEU 118 -2.349 2.780 2.780 249 HA LEU 118 HA LEU 118 -3.617 5.108 5.108 250 1HB LEU 118 2HB LEU 118 -4.061 2.467 2.467 251 2HB LEU 118 1HB LEU 118 -5.480 3.033 3.033 252 HG LEU 118 HG LEU 118 -5.043 5.233 5.233 253 1HD1 LEU 118 3HD1 LEU 118 -4.135 2.687 2.687 254 2HD1 LEU 118 2HD1 LEU 118 -4.974 4.008 4.008 255 3HD1 LEU 118 1HD1 LEU 118 -3.442 4.374 4.374 256 1HD2 LEU 118 1HD2 LEU 118 -6.848 2.872 2.872 257 2HD2 LEU 118 3HD2 LEU 118 -7.044 4.617 4.617 258 3HD2 LEU 118 2HD2 LEU 118 -6.944 4.147 4.147 259 H GLU 119 H GLU 119 -3.733 3.054 3.054 260 HA GLU 119 HA GLU 119 -6.228 3.776 3.776 261 1HB GLU 119 2HB GLU 119 -5.057 1.545 1.545 262 2HB GLU 119 1HB GLU 119 -3.877 2.296 2.296 263 1HG GLU 119 2HG GLU 119 -6.916 2.246 2.246 264 2HG GLU 119 1HG GLU 119 -5.841 0.851 0.851 265 H GLU 120 H GLU 120 -2.860 4.807 4.807 266 HA GLU 120 HA GLU 120 -3.258 6.386 6.386 267 1HB GLU 120 2HB GLU 120 -1.349 6.862 6.862 268 2HB GLU 120 1HB GLU 120 -1.247 7.702 7.702 269 1HG GLU 120 2HG GLU 120 -0.511 4.818 4.818 270 2HG GLU 120 1HG GLU 120 0.486 6.104 6.104 271 H GLY 121 H GLY 121 -4.332 6.729 6.729 272 1HA GLY 121 2HA GLY 121 -5.603 8.281 8.281 273 2HA GLY 121 1HA GLY 121 -5.242 9.390 9.390 274 H ASP 122 H ASP 122 -3.343 7.428 7.428 275 HA ASP 122 HA ASP 122 -2.082 9.920 9.920 276 1HB ASP 122 2HB ASP 122 -0.705 7.228 7.228 277 2HB ASP 122 1HB ASP 122 0.009 8.835 8.835 278 H LYS 123 H LYS 123 -1.351 9.561 9.561 279 HA LYS 123 HA LYS 123 -3.239 7.833 7.833 280 1HB LYS 123 2HB LYS 123 -3.450 10.240 10.240 281 2HB LYS 123 1HB LYS 123 -1.656 10.313 10.313 282 1HG LYS 123 2HG LYS 123 -2.996 8.170 8.170 283 2HG LYS 123 1HG LYS 123 -3.513 9.840 9.840 284 1HD LYS 123 2HD LYS 123 -0.624 8.758 8.758 285 2HD LYS 123 1HD LYS 123 -1.689 9.217 9.217 286 1HE LYS 123 2HE LYS 123 -1.918 11.484 11.484 287 2HE LYS 123 1HE LYS 123 -0.404 10.902 10.902 288 1HZ LYS 123 1HZ LYS 123 -0.677 11.183 11.183 289 2HZ LYS 123 3HZ LYS 123 0.149 12.267 12.267 290 3HZ LYS 123 2HZ LYS 123 0.702 10.669 10.669 291 H ALA 124 H ALA 124 -2.264 6.054 6.054 292 HA ALA 124 HA ALA 124 0.607 5.917 5.917 293 1HB ALA 124 3HB ALA 124 -1.738 3.984 3.984 294 2HB ALA 124 2HB ALA 124 0.027 3.512 3.512 295 3HB ALA 124 1HB ALA 124 -0.736 4.032 4.032 296 H LYS 125 H LYS 125 1.844 5.539 5.539 297 HA LYS 125 HA LYS 125 -0.087 5.247 5.247 298 1HB LYS 125 2HB LYS 125 2.905 6.200 6.200 299 2HB LYS 125 1HB LYS 125 1.820 6.194 6.194 300 1HG LYS 125 2HG LYS 125 0.536 8.094 8.094 301 2HG LYS 125 1HG LYS 125 1.514 7.984 7.984 302 1HD LYS 125 2HD LYS 125 2.369 9.840 9.840 303 2HD LYS 125 1HD LYS 125 3.589 8.522 8.522 304 1HE LYS 125 2HE LYS 125 3.435 9.644 9.644 305 2HE LYS 125 1HE LYS 125 2.821 7.949 7.949 306 1HZ LYS 125 1HZ LYS 125 1.173 10.401 10.401 307 2HZ LYS 125 3HZ LYS 125 1.404 9.530 9.530 308 3HZ LYS 125 2HZ LYS 125 0.584 8.814 8.814 309 H ILE 126 H ILE 126 0.320 3.310 3.310 310 HA ILE 126 HA ILE 126 2.534 1.684 1.684 311 HB ILE 126 HB ILE 126 0.765 1.445 1.445 312 1HG1 ILE 126 2HG1 ILE 126 -0.859 1.820 1.820 313 2HG1 ILE 126 1HG1 ILE 126 -0.789 0.058 0.058 314 1HG2 ILE 126 3HG2 ILE 126 2.352 -0.419 -0.419 315 2HG2 ILE 126 2HG2 ILE 126 1.111 -1.010 -1.010 316 3HG2 ILE 126 1HG2 ILE 126 2.599 -0.193 -0.193 317 1HD1 ILE 126 3HD1 ILE 126 0.658 -0.146 -0.146 318 2HD1 ILE 126 2HD1 ILE 126 0.300 1.597 1.597 319 3HD1 ILE 126 1HD1 ILE 126 -1.048 0.392 0.392 320 H THR 127 H THR 127 4.475 1.477 1.477 321 HA THR 127 HA THR 127 4.532 2.756 2.756 322 HB THR 127 HB THR 127 6.835 2.257 2.257 323 HG1 THR 127 1HG THR 127 5.521 4.660 4.660 324 1HG2 THR 127 3HG2 THR 127 6.554 3.643 3.643 325 2HG2 THR 127 2HG2 THR 127 7.982 3.896 3.896 326 3HG2 THR 127 1HG2 THR 127 7.637 2.257 2.257 327 H LEU 128 H LEU 128 4.782 1.288 1.288 328 HA LEU 128 HA LEU 128 5.752 -1.376 -1.376 329 1HB LEU 128 2HB LEU 128 4.239 -0.262 -0.262 330 2HB LEU 128 1HB LEU 128 5.696 -0.955 -0.955 331 HG LEU 128 HG LEU 128 4.087 -2.459 -2.459 332 1HD1 LEU 128 2HD1 LEU 128 2.489 -1.192 -1.192 333 2HD1 LEU 128 1HD1 LEU 128 3.006 -2.027 -2.027 334 3HD1 LEU 128 3HD1 LEU 128 2.291 -2.976 -2.976 335 1HD2 LEU 128 2HD2 LEU 128 5.451 -3.550 -3.550 336 2HD2 LEU 128 1HD2 LEU 128 5.986 -3.715 -3.715 337 3HD2 LEU 128 3HD2 LEU 128 4.457 -4.511 -4.511 338 H ARG 129 H ARG 129 7.527 -2.296 -2.296 339 HA ARG 129 HA ARG 129 9.387 -0.522 -0.522 340 1HB ARG 129 2HB ARG 129 10.007 -0.307 -0.307 341 2HB ARG 129 1HB ARG 129 9.874 -2.087 -2.087 342 1HG ARG 129 2HG ARG 129 11.862 -2.448 -2.448 343 2HG ARG 129 1HG ARG 129 11.700 -0.820 -0.820 344 1HD ARG 129 2HD ARG 129 12.429 0.248 0.248 345 2HD ARG 129 1HD ARG 129 12.499 -1.381 -1.381 346 HE ARG 129 HE ARG 129 14.116 -1.573 -1.573 347 1HH1 ARG 129 1HH1 ARG 129 13.937 0.358 0.358 348 2HH1 ARG 129 2HH1 ARG 129 15.647 0.597 0.597 349 1HH2 ARG 129 1HH2 ARG 129 16.447 -1.247 -1.247 350 2HH2 ARG 129 2HH2 ARG 129 17.093 -0.334 -0.334 351 H PHE 130 H PHE 130 9.214 -1.574 -1.574 352 HA PHE 130 HA PHE 130 8.510 -4.400 -4.400 353 1HB PHE 130 2HB PHE 130 9.347 -2.295 -2.295 354 2HB PHE 130 1HB PHE 130 8.746 -3.986 -3.986 355 HD1 PHE 130 2HD PHE 130 6.656 -4.747 -4.747 356 HD2 PHE 130 1HD PHE 130 7.829 -0.649 -0.649 357 HE1 PHE 130 2HE PHE 130 4.317 -4.000 -4.000 358 HE2 PHE 130 1HE PHE 130 5.470 0.021 0.021 359 HZ PHE 130 HZ PHE 130 3.694 -1.696 -1.696 360 H ARG 131 H ARG 131 10.262 -5.580 -5.580 361 HA ARG 131 HA ARG 131 12.791 -5.238 -5.238 362 1HB ARG 131 2HB ARG 131 12.436 -4.851 -4.851 363 2HB ARG 131 1HB ARG 131 13.405 -6.330 -6.330 364 1HG ARG 131 2HG ARG 131 14.889 -4.429 -4.429 365 2HG ARG 131 1HG ARG 131 15.040 -5.022 -5.022 366 1HD ARG 131 2HD ARG 131 13.656 -3.122 -3.122 367 2HD ARG 131 1HD ARG 131 13.343 -2.593 -2.593 368 HE ARG 131 HE ARG 131 16.202 -2.777 -2.777 369 1HH1 ARG 131 1HH2 ARG 131 13.228 -0.844 -0.844 370 2HH1 ARG 131 2HH2 ARG 131 14.056 0.656 0.656 371 1HH2 ARG 131 1HH1 ARG 131 17.322 -0.725 -0.725 372 2HH2 ARG 131 2HH1 ARG 131 16.411 0.725 0.725 373 H GLY 132 H GLY 132 10.328 -6.729 -6.729 374 1HA GLY 132 2HA GLY 132 11.121 -9.448 -9.448 375 2HA GLY 132 1HA GLY 132 9.567 -8.854 -8.854 376 H ARG 133 H ARG 133 10.326 -7.224 -7.224 377 HA ARG 133 HA ARG 133 12.523 -8.246 -8.246 378 1HB ARG 133 2HB ARG 133 10.180 -8.611 -8.611 379 2HB ARG 133 1HB ARG 133 10.170 -6.818 -6.818 380 1HG ARG 133 2HG ARG 133 12.248 -6.923 -6.923 381 2HG ARG 133 1HG ARG 133 12.413 -8.683 -8.683 382 1HD ARG 133 2HD ARG 133 10.311 -9.160 -9.160 383 2HD ARG 133 1HD ARG 133 10.097 -7.382 -7.382 384 HE ARG 133 HE ARG 133 12.732 -8.236 -8.236 385 1HH1 ARG 133 1HH1 ARG 133 9.260 -8.436 -8.436 386 2HH1 ARG 133 2HH1 ARG 133 9.501 -8.614 -8.614 387 1HH2 ARG 133 1HH2 ARG 133 13.054 -8.499 -8.499 388 2HH2 ARG 133 2HH2 ARG 133 11.686 -8.651 -8.651 389 H GLU 134 H GLU 134 13.707 -6.366 -6.366 390 HA GLU 134 HA GLU 134 14.045 -4.404 -4.404 391 1HB GLU 134 2HB GLU 134 15.718 -5.107 -5.107 392 2HB GLU 134 1HB GLU 134 14.742 -4.254 -4.254 393 1HG GLU 134 2HG GLU 134 15.206 -2.063 -2.063 394 2HG GLU 134 1HG GLU 134 16.034 -2.913 -2.913 395 H MET 135 H MET 135 12.113 -4.347 -4.347 396 HA MET 135 HA MET 135 11.504 -1.663 -1.663 397 1HB MET 135 2HB MET 135 9.565 -2.360 -2.360 398 2HB MET 135 1HB MET 135 11.263 -2.570 -2.570 399 1HG MET 135 2HG MET 135 11.254 -4.951 -4.951 400 2HG MET 135 1HG MET 135 9.553 -4.858 -4.858 401 1HE MET 135 1HE MET 135 7.528 -4.908 -4.908 402 2HE MET 135 3HE MET 135 7.907 -3.228 -3.228 403 3HE MET 135 2HE MET 135 7.448 -4.464 -4.464 404 H ALA 136 H ALA 136 8.605 -3.937 -3.937 405 HA ALA 136 HA ALA 136 7.367 -2.355 -2.355 406 1HB ALA 136 1HB ALA 136 7.588 -1.113 -1.113 407 2HB ALA 136 3HB ALA 136 6.223 -0.763 -0.763 408 3HB ALA 136 2HB ALA 136 7.889 -0.284 -0.284 409 H HIS 137 H HIS 137 5.703 -3.817 -3.817 410 HA HIS 137 HA HIS 137 4.222 -4.382 -4.382 411 1HB HIS 137 2HB HIS 137 4.587 -6.581 -6.581 412 2HB HIS 137 1HB HIS 137 3.615 -6.582 -6.582 413 HD1 HIS 137 1HD HIS 137 4.776 -7.900 -7.900 414 HD2 HIS 137 2HD HIS 137 7.476 -5.772 -5.772 415 HE1 HIS 137 1HE HIS 137 7.130 -8.352 -8.352 416 H GLN 138 H GLN 138 1.950 -4.530 -4.530 417 HA GLN 138 HA GLN 138 1.062 -3.721 -3.721 418 1HB GLN 138 2HB GLN 138 -0.470 -3.565 -3.565 419 2HB GLN 138 1HB GLN 138 -1.107 -3.120 -3.120 420 1HG GLN 138 2HG GLN 138 0.754 -1.400 -1.400 421 2HG GLN 138 1HG GLN 138 1.204 -1.728 -1.728 422 1HE2 GLN 138 1HE2 GLN 138 -0.539 0.296 0.296 423 2HE2 GLN 138 2HE2 GLN 138 -1.766 0.856 0.856 424 H GLN 139 H GLN 139 1.861 -6.329 -6.329 425 HA GLN 139 HA GLN 139 -0.325 -8.018 -8.018 426 1HB GLN 139 2HB GLN 139 2.599 -8.917 -8.917 427 2HB GLN 139 1HB GLN 139 1.127 -9.916 -9.916 428 1HG GLN 139 2HG GLN 139 2.040 -7.730 -7.730 429 2HG GLN 139 1HG GLN 139 2.160 -9.507 -9.507 430 1HE2 GLN 139 1HE2 GLN 139 0.408 -6.852 -6.852 431 2HE2 GLN 139 2HE2 GLN 139 -1.149 -7.553 -7.553 432 H ILE 140 H ILE 140 3.121 -7.209 -7.209 433 HA ILE 140 HA ILE 140 3.418 -8.154 -8.154 434 HB ILE 140 HB ILE 140 4.774 -5.988 -5.988 435 1HG1 ILE 140 2HG1 ILE 140 5.550 -8.859 -8.859 436 2HG1 ILE 140 1HG1 ILE 140 4.869 -8.458 -8.458 437 1HG2 ILE 140 2HG2 ILE 140 5.153 -7.330 -7.330 438 2HG2 ILE 140 1HG2 ILE 140 6.478 -6.452 -6.452 439 3HG2 ILE 140 3HG2 ILE 140 5.035 -5.565 -5.565 440 1HD1 ILE 140 2HD1 ILE 140 6.764 -6.813 -6.813 441 2HD1 ILE 140 1HD1 ILE 140 7.551 -7.466 -7.466 442 3HD1 ILE 140 3HD1 ILE 140 7.272 -8.545 -8.545 443 H GLY 141 H GLY 141 2.210 -4.993 -4.993 444 1HA GLY 141 2HA GLY 141 2.356 -4.242 -4.242 445 2HA GLY 141 1HA GLY 141 1.674 -3.262 -3.262 446 H MET 142 H MET 142 -0.384 -4.695 -4.695 447 HA MET 142 HA MET 142 -2.163 -4.124 -4.124 448 1HB MET 142 2HB MET 142 -2.645 -4.536 -4.536 449 2HB MET 142 1HB MET 142 -3.967 -4.127 -4.127 450 1HG MET 142 2HG MET 142 -2.445 -2.074 -2.074 451 2HG MET 142 1HG MET 142 -1.691 -2.331 -2.331 452 1HE MET 142 2HE MET 142 -4.081 -3.447 -3.447 453 2HE MET 142 1HE MET 142 -4.758 -1.941 -1.941 454 3HE MET 142 3HE MET 142 -2.983 -2.140 -2.140 455 H GLU 143 H GLU 143 -0.691 -7.109 -7.109 456 HA GLU 143 HA GLU 143 -3.053 -8.147 -8.147 457 1HB GLU 143 2HB GLU 143 -0.808 -9.582 -9.582 458 2HB GLU 143 1HB GLU 143 -0.380 -9.226 -9.226 459 1HG GLU 143 2HG GLU 143 -1.444 -11.240 -11.240 460 2HG GLU 143 1HG GLU 143 -2.786 -10.144 -10.144 461 H VAL 144 H VAL 144 0.022 -6.937 -6.937 462 HA VAL 144 HA VAL 144 -0.508 -7.603 -7.603 463 HB VAL 144 HB VAL 144 1.539 -5.663 -5.663 464 1HG1 VAL 144 3HG1 VAL 144 0.960 -7.237 -7.237 465 2HG1 VAL 144 2HG1 VAL 144 2.608 -6.702 -6.702 466 3HG1 VAL 144 1HG1 VAL 144 1.312 -5.474 -5.474 467 1HG2 VAL 144 3HG2 VAL 144 0.994 -8.656 -8.656 468 2HG2 VAL 144 2HG2 VAL 144 1.565 -7.820 -7.820 469 3HG2 VAL 144 1HG2 VAL 144 2.722 -8.044 -8.044 470 H LEU 145 H LEU 145 -0.275 -4.435 -4.435 471 HA LEU 145 HA LEU 145 -1.133 -2.848 -2.848 472 1HB LEU 145 2HB LEU 145 -1.824 -2.673 -2.673 473 2HB LEU 145 1HB LEU 145 -2.194 -1.366 -1.366 474 HG LEU 145 HG LEU 145 0.563 -2.445 -2.445 475 1HD1 LEU 145 1HD1 LEU 145 -0.996 0.100 0.100 476 2HD1 LEU 145 3HD1 LEU 145 0.772 -0.099 -0.099 477 3HD1 LEU 145 2HD1 LEU 145 -0.401 -1.229 -1.229 478 1HD2 LEU 145 2HD2 LEU 145 -0.413 -0.418 -0.418 479 2HD2 LEU 145 1HD2 LEU 145 0.638 -1.835 -1.835 480 3HD2 LEU 145 3HD2 LEU 145 1.296 -0.397 -0.397 481 H ASN 146 H ASN 146 -3.078 -4.158 -4.158 482 HA ASN 146 HA ASN 146 -5.649 -3.371 -3.371 483 1HB ASN 146 2HB ASN 146 -4.229 -4.763 -4.763 484 2HB ASN 146 1HB ASN 146 -5.361 -5.984 -5.984 485 1HD2 ASN 146 1HD2 ASN 146 -6.020 -6.277 -6.277 486 2HD2 ASN 146 2HD2 ASN 146 -7.045 -5.213 -5.213 487 H ARG 147 H ARG 147 -3.837 -6.405 -6.405 488 HA ARG 147 HA ARG 147 -6.152 -7.182 -7.182 489 1HB ARG 147 2HB ARG 147 -4.920 -8.773 -8.773 490 2HB ARG 147 1HB ARG 147 -3.348 -8.041 -8.041 491 1HG ARG 147 2HG ARG 147 -3.382 -9.231 -9.231 492 2HG ARG 147 1HG ARG 147 -5.214 -9.245 -9.245 493 1HD ARG 147 2HD ARG 147 -4.230 -11.562 -11.562 494 2HD ARG 147 1HD ARG 147 -5.037 -11.037 -11.037 495 HE ARG 147 HE ARG 147 -2.358 -10.132 -10.132 496 1HH1 ARG 147 1HH2 ARG 147 -4.068 -13.237 -13.237 497 2HH1 ARG 147 2HH2 ARG 147 -2.793 -14.194 -14.194 498 1HH2 ARG 147 1HH1 ARG 147 -0.639 -11.444 -11.444 499 2HH2 ARG 147 2HH1 ARG 147 -0.826 -13.162 -13.162 500 H VAL 148 H VAL 148 -3.460 -4.932 -4.932 501 HA VAL 148 HA VAL 148 -3.321 -5.672 -5.672 502 HB VAL 148 HB VAL 148 -2.841 -2.910 -2.910 503 1HG1 VAL 148 2HG1 VAL 148 -2.839 -3.756 -3.756 504 2HG1 VAL 148 1HG1 VAL 148 -1.413 -4.754 -4.754 505 3HG1 VAL 148 3HG1 VAL 148 -1.317 -2.949 -2.949 506 1HG2 VAL 148 2HG2 VAL 148 -0.945 -5.256 -5.256 507 2HG2 VAL 148 1HG2 VAL 148 -1.633 -4.166 -4.166 508 3HG2 VAL 148 3HG2 VAL 148 -0.477 -3.503 -3.503 509 H LYS 149 H LYS 149 -4.997 -3.342 -3.342 510 HA LYS 149 HA LYS 149 -6.368 -1.909 -1.909 511 1HB LYS 149 2HB LYS 149 -6.204 -1.435 -1.435 512 2HB LYS 149 1HB LYS 149 -7.397 -2.765 -2.765 513 1HG LYS 149 2HG LYS 149 -8.487 -0.636 -0.636 514 2HG LYS 149 1HG LYS 149 -9.133 -1.578 -1.578 515 1HD LYS 149 2HD LYS 149 -8.876 0.861 0.861 516 2HD LYS 149 1HD LYS 149 -7.982 -0.156 -0.156 517 1HE LYS 149 2HE LYS 149 -6.526 1.083 1.083 518 2HE LYS 149 1HE LYS 149 -6.826 2.021 2.021 519 1HZ LYS 149 2HZ LYS 149 -5.715 0.312 0.312 520 2HZ LYS 149 1HZ LYS 149 -5.425 -0.599 -0.599 521 3HZ LYS 149 3HZ LYS 149 -4.716 0.934 0.934 522 H ASP 150 H ASP 150 -7.495 -4.698 -4.698 523 HA ASP 150 HA ASP 150 -10.008 -4.806 -4.806 524 1HB ASP 150 2HB ASP 150 -7.969 -6.794 -6.794 525 2HB ASP 150 1HB ASP 150 -9.652 -7.214 -7.214 526 H ASP 151 H ASP 151 -6.908 -6.373 -6.373 527 HA ASP 151 HA ASP 151 -8.579 -7.423 -7.423 528 1HB ASP 151 2HB ASP 151 -6.324 -8.270 -8.270 529 2HB ASP 151 1HB ASP 151 -5.590 -6.862 -6.862 530 H LEU 152 H LEU 152 -6.791 -4.251 -4.251 531 HA LEU 152 HA LEU 152 -7.133 -3.827 -3.827 532 1HB LEU 152 2HB LEU 152 -5.911 -2.622 -2.622 533 2HB LEU 152 1HB LEU 152 -6.941 -1.440 -1.440 534 HG LEU 152 HG LEU 152 -5.153 -3.301 -3.301 535 1HD1 LEU 152 2HD1 LEU 152 -3.954 -2.614 -2.614 536 2HD1 LEU 152 1HD1 LEU 152 -4.082 -0.869 -0.869 537 3HD1 LEU 152 3HD1 LEU 152 -3.154 -2.012 -2.012 538 1HD2 LEU 152 3HD2 LEU 152 -6.114 -0.430 -0.430 539 2HD2 LEU 152 2HD2 LEU 152 -6.624 -1.962 -1.962 540 3HD2 LEU 152 1HD2 LEU 152 -4.984 -1.303 -1.303 541 H GLN 153 H GLN 153 -9.040 -2.978 -2.978 542 HA GLN 153 HA GLN 153 -10.440 -1.075 -1.075 543 1HB GLN 153 2HB GLN 153 -10.543 -3.454 -3.454 544 2HB GLN 153 1HB GLN 153 -11.911 -3.694 -3.694 545 1HG GLN 153 2HG GLN 153 -12.918 -1.540 -1.540 546 2HG GLN 153 1HG GLN 153 -11.326 -1.469 -1.469 547 1HE2 GLN 153 1HE2 GLN 153 -11.441 -2.216 -2.216 548 2HE2 GLN 153 2HE2 GLN 153 -12.392 -3.550 -3.550 549 H GLU 154 H GLU 154 -10.713 -3.270 -3.270 550 HA GLU 154 HA GLU 154 -13.113 -2.665 -2.665 551 1HB GLU 154 2HB GLU 154 -10.572 -3.147 -3.147 552 2HB GLU 154 1HB GLU 154 -12.212 -3.776 -3.776 553 1HG GLU 154 2HG GLU 154 -11.804 -5.237 -5.237 554 2HG GLU 154 1HG GLU 154 -10.131 -4.522 -4.522 555 H LEU 155 H LEU 155 -9.899 -1.435 -1.435 556 HA LEU 155 HA LEU 155 -10.813 0.744 0.744 557 1HB LEU 155 2HB LEU 155 -8.415 -0.910 -0.910 558 2HB LEU 155 1HB LEU 155 -7.941 0.767 0.767 559 HG LEU 155 HG LEU 155 -9.639 1.172 1.172 560 1HD1 LEU 155 1HD1 LEU 155 -9.820 -1.274 -1.274 561 2HD1 LEU 155 3HD1 LEU 155 -8.025 -1.394 -1.394 562 3HD1 LEU 155 2HD1 LEU 155 -8.951 -0.423 -0.423 563 1HD2 LEU 155 1HD2 LEU 155 -6.583 0.824 0.824 564 2HD2 LEU 155 3HD2 LEU 155 -7.508 2.319 2.319 565 3HD2 LEU 155 2HD2 LEU 155 -7.560 1.630 1.630 566 H ALA 156 H ALA 156 -8.744 -0.031 -0.031 567 HA ALA 156 HA ALA 156 -8.416 2.871 2.871 568 1HB ALA 156 3HB ALA 156 -6.189 1.584 1.584 569 2HB ALA 156 2HB ALA 156 -6.667 0.643 0.643 570 3HB ALA 156 1HB ALA 156 -6.407 2.421 2.421 571 H VAL 157 H VAL 157 -9.029 3.937 3.937 572 HA VAL 157 HA VAL 157 -8.554 2.187 2.187 573 HB VAL 157 HB VAL 157 -10.470 3.193 3.193 574 1HG1 VAL 157 3HG1 VAL 157 -11.311 2.529 2.529 575 2HG1 VAL 157 2HG1 VAL 157 -12.409 2.601 2.601 576 3HG1 VAL 157 1HG1 VAL 157 -11.064 1.364 1.364 577 1HG2 VAL 157 3HG2 VAL 157 -10.208 5.218 5.218 578 2HG2 VAL 157 2HG2 VAL 157 -10.175 5.527 5.527 579 3HG2 VAL 157 1HG2 VAL 157 -11.747 5.105 5.105 580 H VAL 158 H VAL 158 -8.973 3.444 3.444 581 HA VAL 158 HA VAL 158 -6.390 4.343 4.343 582 HB VAL 158 HB VAL 158 -8.153 4.665 4.665 583 1HG1 VAL 158 2HG1 VAL 158 -5.794 2.788 2.788 584 2HG1 VAL 158 1HG1 VAL 158 -6.395 2.892 2.892 585 3HG1 VAL 158 3HG1 VAL 158 -5.648 4.323 4.323 586 1HG2 VAL 158 3HG2 VAL 158 -9.630 2.922 2.922 587 2HG2 VAL 158 2HG2 VAL 158 -9.009 2.650 2.650 588 3HG2 VAL 158 1HG2 VAL 158 -8.267 1.759 1.759 589 H GLU 159 H GLU 159 -5.808 6.153 6.153 590 HA GLU 159 HA GLU 159 -7.665 8.367 8.367 591 1HB GLU 159 2HB GLU 159 -5.186 8.576 8.576 592 2HB GLU 159 1HB GLU 159 -5.058 7.994 7.994 593 1HG GLU 159 2HG GLU 159 -6.510 10.098 10.098 594 2HG GLU 159 1HG GLU 159 -6.393 10.556 10.556 595 H SER 160 H SER 160 -5.977 5.810 5.810 596 HA SER 160 HA SER 160 -7.824 5.961 5.961 597 1HB SER 160 2HB SER 160 -5.881 7.824 7.824 598 2HB SER 160 1HB SER 160 -5.076 6.347 6.347 599 HG SER 160 HG SER 160 -7.538 7.470 7.470 600 H PHE 161 H PHE 161 -7.371 4.029 4.029 601 HA PHE 161 HA PHE 161 -5.075 2.445 2.445 602 1HB PHE 161 2HB PHE 161 -7.740 1.812 1.812 603 2HB PHE 161 1HB PHE 161 -6.635 1.086 1.086 604 HD1 PHE 161 2HD PHE 161 -7.310 1.558 1.558 605 HD2 PHE 161 1HD PHE 161 -5.213 -0.795 -0.795 606 HE1 PHE 161 2HE PHE 161 -6.094 0.436 0.436 607 HE2 PHE 161 1HE PHE 161 -3.848 -1.724 -1.724 608 HZ PHE 161 HZ PHE 161 -4.311 -1.097 -1.097 609 HA PRO 162 HA PRO 162 -4.924 5.647 5.647 610 1HB PRO 162 2HB PRO 162 -1.886 5.833 5.833 611 2HB PRO 162 1HB PRO 162 -3.112 6.878 6.878 612 1HG PRO 162 2HG PRO 162 -1.562 5.044 5.044 613 2HG PRO 162 1HG PRO 162 -3.244 5.392 5.392 614 1HD PRO 162 2HD PRO 162 -2.272 3.149 3.149 615 2HD PRO 162 1HD PRO 162 -3.294 2.902 2.902 616 H THR 163 H THR 163 -1.700 4.798 4.798 617 HA THR 163 HA THR 163 -3.075 5.696 5.696 618 HB THR 163 HB THR 163 -1.220 6.797 6.797 619 HG1 THR 163 1HG THR 163 -3.380 7.431 7.431 620 1HG2 THR 163 3HG2 THR 163 -0.949 7.133 7.133 621 2HG2 THR 163 2HG2 THR 163 -0.495 8.488 8.488 622 3HG2 THR 163 1HG2 THR 163 0.293 6.861 6.861 623 H LYS 164 H LYS 164 0.364 5.329 5.329 624 HA LYS 164 HA LYS 164 0.440 2.643 2.643 625 1HB LYS 164 2HB LYS 164 1.692 3.205 3.205 626 2HB LYS 164 1HB LYS 164 -0.043 3.647 3.647 627 1HG LYS 164 2HG LYS 164 0.530 6.044 6.044 628 2HG LYS 164 1HG LYS 164 2.275 5.618 5.618 629 1HD LYS 164 2HD LYS 164 1.846 6.562 6.562 630 2HD LYS 164 1HD LYS 164 2.211 4.811 4.811 631 1HE LYS 164 2HE LYS 164 -0.239 4.334 4.334 632 2HE LYS 164 1HE LYS 164 -0.614 6.086 6.086 633 1HZ LYS 164 2HZ LYS 164 1.094 4.978 4.978 634 2HZ LYS 164 1HZ LYS 164 -0.506 5.526 5.526 635 3HZ LYS 164 3HZ LYS 164 0.731 6.617 6.617 636 H ILE 165 H ILE 165 2.893 2.230 2.230 637 HA ILE 165 HA ILE 165 4.124 3.176 3.176 638 HB ILE 165 HB ILE 165 5.363 1.498 1.498 639 1HG1 ILE 165 2HG1 ILE 165 3.260 0.898 0.898 640 2HG1 ILE 165 1HG1 ILE 165 3.103 0.555 0.555 641 1HG2 ILE 165 3HG2 ILE 165 5.703 1.639 1.639 642 2HG2 ILE 165 2HG2 ILE 165 6.597 0.505 0.505 643 3HG2 ILE 165 1HG2 ILE 165 6.880 2.258 2.258 644 1HD1 ILE 165 1HD1 ILE 165 5.182 -0.982 -0.982 645 2HD1 ILE 165 3HD1 ILE 165 3.426 -1.311 -1.311 646 3HD1 ILE 165 2HD1 ILE 165 4.205 -1.469 -1.469 647 H GLU 166 H GLU 166 5.825 4.316 4.316 648 HA GLU 166 HA GLU 166 6.784 5.933 5.933 649 1HB GLU 166 2HB GLU 166 6.059 6.927 6.927 650 2HB GLU 166 1HB GLU 166 6.989 7.886 7.886 651 1HG GLU 166 2HG GLU 166 5.025 7.912 7.912 652 2HG GLU 166 1HG GLU 166 4.091 6.866 6.866 653 H GLY 167 H GLY 167 8.864 5.240 5.240 654 1HA GLY 167 2HA GLY 167 10.963 4.684 4.684 655 2HA GLY 167 1HA GLY 167 10.463 5.019 5.019 656 H ARG 168 H ARG 168 11.330 3.182 3.182 657 HA ARG 168 HA ARG 168 10.313 0.677 0.677 658 1HB ARG 168 2HB ARG 168 12.595 1.259 1.259 659 2HB ARG 168 1HB ARG 168 12.174 -0.376 -0.376 660 1HG ARG 168 2HG ARG 168 12.825 0.273 0.273 661 2HG ARG 168 1HG ARG 168 13.158 1.962 1.962 662 1HD ARG 168 2HD ARG 168 15.010 1.185 1.185 663 2HD ARG 168 1HD ARG 168 14.615 -0.535 -0.535 664 HE ARG 168 HE ARG 168 15.626 -0.306 -0.306 665 1HH1 ARG 168 1HH2 ARG 168 15.277 2.916 2.916 666 2HH1 ARG 168 2HH2 ARG 168 16.331 3.706 3.706 667 1HH2 ARG 168 1HH1 ARG 168 17.046 0.776 0.776 668 2HH2 ARG 168 2HH1 ARG 168 17.349 2.473 2.473 669 H GLN 169 H GLN 169 8.488 2.230 2.230 670 HA GLN 169 HA GLN 169 8.056 0.739 0.739 671 1HB GLN 169 2HB GLN 169 9.199 3.507 3.507 672 2HB GLN 169 1HB GLN 169 8.090 3.029 3.029 673 1HG GLN 169 2HG GLN 169 9.772 1.448 1.448 674 2HG GLN 169 1HG GLN 169 10.846 1.737 1.737 675 1HE2 GLN 169 1HE2 GLN 169 8.998 3.704 3.704 676 2HE2 GLN 169 2HE2 GLN 169 10.279 4.820 4.820 677 H MET 170 H MET 170 5.910 1.286 1.286 678 HA MET 170 HA MET 170 4.537 3.436 3.436 679 1HB MET 170 2HB MET 170 4.005 1.397 1.397 680 2HB MET 170 1HB MET 170 3.367 0.579 0.579 681 1HG MET 170 2HG MET 170 1.543 2.232 2.232 682 2HG MET 170 1HG MET 170 2.323 3.155 3.155 683 1HE MET 170 3HE MET 170 1.280 -0.561 -0.561 684 2HE MET 170 2HE MET 170 -0.262 0.373 0.373 685 3HE MET 170 1HE MET 170 -0.069 -0.794 -0.794 686 H ILE 171 H ILE 171 3.672 4.716 4.716 687 HA ILE 171 HA ILE 171 3.033 3.671 3.671 688 HB ILE 171 HB ILE 171 2.330 6.279 6.279 689 1HG1 ILE 171 2HG1 ILE 171 4.836 5.566 5.566 690 2HG1 ILE 171 1HG1 ILE 171 4.293 7.230 7.230 691 1HG2 ILE 171 2HG2 ILE 171 2.079 5.335 5.335 692 2HG2 ILE 171 1HG2 ILE 171 2.196 7.108 7.108 693 3HG2 ILE 171 3HG2 ILE 171 0.809 6.170 6.170 694 1HD1 ILE 171 1HD1 ILE 171 4.378 4.821 4.821 695 2HD1 ILE 171 3HD1 ILE 171 5.730 6.014 6.014 696 3HD1 ILE 171 2HD1 ILE 171 4.112 6.517 6.517 697 H MET 172 H MET 172 1.060 3.000 3.000 698 HA MET 172 HA MET 172 -1.406 4.052 4.052 699 1HB MET 172 2HB MET 172 -1.915 1.654 1.654 700 2HB MET 172 1HB MET 172 -1.126 1.514 1.514 701 1HG MET 172 2HG MET 172 -3.470 3.428 3.428 702 2HG MET 172 1HG MET 172 -3.876 1.754 1.754 703 1HE MET 172 2HE MET 172 -2.595 -0.131 -0.131 704 2HE MET 172 1HE MET 172 -3.096 -0.272 -0.272 705 3HE MET 172 3HE MET 172 -4.339 0.046 0.046 706 H VAL 173 H VAL 173 -2.344 5.528 5.528 707 HA VAL 173 HA VAL 173 -0.856 6.131 6.131 708 HB VAL 173 HB VAL 173 -3.271 7.541 7.541 709 1HG1 VAL 173 3HG1 VAL 173 -1.210 7.871 7.871 710 2HG1 VAL 173 2HG1 VAL 173 -1.770 9.406 9.406 711 3HG1 VAL 173 1HG1 VAL 173 -2.950 8.342 8.342 712 1HG2 VAL 173 2HG2 VAL 173 -0.290 7.869 7.869 713 2HG2 VAL 173 1HG2 VAL 173 -1.658 7.530 7.530 714 3HG2 VAL 173 3HG2 VAL 173 -1.533 9.128 9.128 715 H LEU 174 H LEU 174 -1.807 5.855 5.855 716 HA LEU 174 HA LEU 174 -4.331 4.430 4.430 717 1HB LEU 174 2HB LEU 174 -1.922 3.325 3.325 718 2HB LEU 174 1HB LEU 174 -2.193 3.823 3.823 719 HG LEU 174 HG LEU 174 -3.326 1.564 1.564 720 1HD1 LEU 174 2HD1 LEU 174 -2.907 2.317 2.317 721 2HD1 LEU 174 1HD1 LEU 174 -4.103 1.053 1.053 722 3HD1 LEU 174 3HD1 LEU 174 -2.385 0.840 0.840 723 1HD2 LEU 174 2HD2 LEU 174 -5.138 3.327 3.327 724 2HD2 LEU 174 1HD2 LEU 174 -5.323 2.933 2.933 725 3HD2 LEU 174 3HD2 LEU 174 -5.562 1.648 1.648 726 H ALA 175 H ALA 175 -5.617 6.458 6.458 727 HA ALA 175 HA ALA 175 -4.805 7.588 7.588 728 1HB ALA 175 3HB ALA 175 -5.821 8.843 8.843 729 2HB ALA 175 2HB ALA 175 -7.350 7.807 7.807 730 3HB ALA 175 1HB ALA 175 -6.834 9.117 9.117 731 HA PRO 176 HA PRO 176 -7.919 5.997 5.997 732 1HB PRO 176 2HB PRO 176 -8.942 8.859 8.859 733 2HB PRO 176 1HB PRO 176 -8.750 7.661 7.661 734 1HG PRO 176 2HG PRO 176 -6.843 9.580 9.580 735 2HG PRO 176 1HG PRO 176 -6.328 7.861 7.861 736 1HD PRO 176 2HD PRO 176 -6.463 9.392 9.392 737 2HD PRO 176 1HD PRO 176 -5.235 8.187 8.187 738 H LYS 177 H LYS 177 -9.832 4.906 4.906 739 HA LYS 177 HA LYS 177 -11.584 5.904 5.904 740 1HB LYS 177 2HB LYS 177 -11.275 3.398 3.398 741 2HB LYS 177 1HB LYS 177 -12.145 3.819 3.819 742 1HG LYS 177 2HG LYS 177 -14.182 4.454 4.454 743 2HG LYS 177 1HG LYS 177 -13.286 4.122 4.122 744 1HD LYS 177 2HD LYS 177 -14.870 2.326 2.326 745 2HD LYS 177 1HD LYS 177 -13.182 1.710 1.710 746 1HE LYS 177 2HE LYS 177 -13.033 1.604 1.604 747 2HE LYS 177 1HE LYS 177 -14.536 2.612 2.612 748 1HZ LYS 177 1HZ LYS 177 -14.411 -0.093 -0.093 749 2HZ LYS 177 3HZ LYS 177 -14.954 0.285 0.285 750 3HZ LYS 177 2HZ LYS 177 -15.805 0.856 0.856 751 H LYS 178 H LYS 178 -13.424 7.058 7.058 752 HA LYS 178 HA LYS 178 -13.989 8.022 8.022 753 1HB LYS 178 2HB LYS 178 -15.207 8.513 8.513 754 2HB LYS 178 1HB LYS 178 -15.817 9.331 9.331 755 1HG LYS 178 2HG LYS 178 -12.937 9.628 9.628 756 2HG LYS 178 1HG LYS 178 -14.319 10.645 10.645 757 1HD LYS 178 2HD LYS 178 -13.127 11.923 11.923 758 2HD LYS 178 1HD LYS 178 -14.660 11.422 11.422 759 1HE LYS 178 2HE LYS 178 -12.628 11.406 11.406 760 2HE LYS 178 1HE LYS 178 -13.401 9.782 9.782 761 1HZ LYS 178 2HZ LYS 178 -11.022 10.697 10.697 762 2HZ LYS 178 1HZ LYS 178 -11.021 9.667 9.667 763 3HZ LYS 178 3HZ LYS 178 -11.746 9.164 9.164 764 H LYS 179 H LYS 179 -15.037 6.563 6.563 765 HA LYS 179 HA LYS 179 -16.767 4.614 4.614 766 1HB LYS 179 2HB LYS 179 -16.388 5.595 5.595 767 2HB LYS 179 1HB LYS 179 -17.471 4.238 4.238 768 1HG LYS 179 2HG LYS 179 -15.543 2.968 2.968 769 2HG LYS 179 1HG LYS 179 -14.425 4.314 4.314 770 1HD LYS 179 2HD LYS 179 -14.959 4.065 4.065 771 2HD LYS 179 1HD LYS 179 -16.131 2.750 2.750 772 1HE LYS 179 2HE LYS 179 -13.103 2.607 2.607 773 2HE LYS 179 1HE LYS 179 -13.905 1.882 1.882 774 1HZ LYS 179 3HZ LYS 179 -15.268 0.565 0.565 775 2HZ LYS 179 2HZ LYS 179 -14.511 1.233 1.233 776 3HZ LYS 179 1HZ LYS 179 -13.615 0.287 0.287 777 H GLN 180 H GLN 180 -18.805 4.917 4.917 778 HA GLN 180 HA GLN 180 -20.047 7.429 7.429 779 1HB GLN 180 2HB GLN 180 -20.371 6.123 6.123 780 2HB GLN 180 1HB GLN 180 -21.189 4.831 4.831 781 1HG GLN 180 2HG GLN 180 -23.043 6.400 6.400 782 2HG GLN 180 1HG GLN 180 -22.155 7.765 7.765 783 1HE2 GLN 180 1HE2 GLN 180 -23.177 4.341 4.341 784 2HE2 GLN 180 2HE2 GLN 180 -23.707 4.662 4.662 Start of MODEL 3 1 HA VAL 90 HA VAL 90 -3.827 16.886 16.886 2 HB VAL 90 HB VAL 90 -3.203 17.373 17.373 3 1HG1 VAL 90 1HG1 VAL 90 -3.204 19.543 19.543 4 2HG1 VAL 90 3HG1 VAL 90 -3.525 19.742 19.742 5 3HG1 VAL 90 2HG1 VAL 90 -4.593 18.668 18.668 6 1HG2 VAL 90 2HG2 VAL 90 -0.673 18.525 18.525 7 2HG2 VAL 90 1HG2 VAL 90 -0.772 17.103 17.103 8 3HG2 VAL 90 3HG2 VAL 90 -1.218 18.746 18.746 9 H ILE 91 H ILE 91 -3.664 15.733 15.733 10 HA ILE 91 HA ILE 91 -2.719 13.066 13.066 11 HB ILE 91 HB ILE 91 -4.487 14.208 14.208 12 1HG1 ILE 91 2HG1 ILE 91 -5.615 14.327 14.327 13 2HG1 ILE 91 1HG1 ILE 91 -6.299 12.954 12.954 14 1HG2 ILE 91 3HG2 ILE 91 -3.620 11.304 11.304 15 2HG2 ILE 91 2HG2 ILE 91 -5.088 11.739 11.739 16 3HG2 ILE 91 1HG2 ILE 91 -3.482 12.265 12.265 17 1HD1 ILE 91 3HD1 ILE 91 -4.743 11.390 11.390 18 2HD1 ILE 91 2HD1 ILE 91 -4.285 12.798 12.798 19 3HD1 ILE 91 1HD1 ILE 91 -5.997 12.226 12.226 20 H GLN 92 H GLN 92 -0.975 12.133 12.133 21 HA GLN 92 HA GLN 92 0.746 13.906 13.906 22 1HB GLN 92 2HB GLN 92 1.482 11.670 11.670 23 2HB GLN 92 1HB GLN 92 2.570 12.988 12.988 24 1HG GLN 92 2HG GLN 92 1.256 14.651 14.651 25 2HG GLN 92 1HG GLN 92 0.043 13.395 13.395 26 1HE2 GLN 92 1HE2 GLN 92 0.031 12.733 12.733 27 2HE2 GLN 92 2HE2 GLN 92 1.403 12.441 12.441 28 H VAL 93 H VAL 93 2.490 12.669 12.669 29 HA VAL 93 HA VAL 93 1.353 10.123 10.123 30 HB VAL 93 HB VAL 93 3.821 11.612 11.612 31 1HG1 VAL 93 1HG1 VAL 93 2.476 8.876 8.876 32 2HG1 VAL 93 3HG1 VAL 93 3.535 9.630 9.630 33 3HG1 VAL 93 2HG1 VAL 93 4.262 9.122 9.122 34 1HG2 VAL 93 1HG2 VAL 93 1.385 12.321 12.321 35 2HG2 VAL 93 3HG2 VAL 93 2.479 11.727 11.727 36 3HG2 VAL 93 2HG2 VAL 93 1.297 10.586 10.586 37 H LYS 94 H LYS 94 1.775 8.435 8.435 38 HA LYS 94 HA LYS 94 4.710 8.086 8.086 39 1HB LYS 94 2HB LYS 94 2.598 6.312 6.312 40 2HB LYS 94 1HB LYS 94 4.336 6.393 6.393 41 1HG LYS 94 2HG LYS 94 2.306 8.662 8.662 42 2HG LYS 94 1HG LYS 94 2.707 7.450 7.450 43 1HD LYS 94 2HD LYS 94 5.080 8.151 8.151 44 2HD LYS 94 1HD LYS 94 4.775 9.345 9.345 45 1HE LYS 94 2HE LYS 94 4.843 10.515 10.515 46 2HE LYS 94 1HE LYS 94 3.151 10.560 10.560 47 1HZ LYS 94 3HZ LYS 94 2.624 8.702 8.702 48 2HZ LYS 94 2HZ LYS 94 4.210 8.669 8.669 49 3HZ LYS 94 1HZ LYS 94 3.219 10.019 10.019 50 H GLU 95 H GLU 95 5.155 5.588 5.588 51 HA GLU 95 HA GLU 95 3.787 4.937 4.937 52 1HB GLU 95 2HB GLU 95 5.908 6.377 6.377 53 2HB GLU 95 1HB GLU 95 6.713 4.906 4.906 54 1HG GLU 95 2HG GLU 95 6.177 3.672 3.672 55 2HG GLU 95 1HG GLU 95 5.389 5.167 5.167 56 H ILE 96 H ILE 96 4.180 2.683 2.683 57 HA ILE 96 HA ILE 96 5.753 1.009 1.009 58 HB ILE 96 HB ILE 96 3.024 0.815 0.815 59 1HG1 ILE 96 2HG1 ILE 96 3.318 -1.659 -1.659 60 2HG1 ILE 96 1HG1 ILE 96 5.000 -1.555 -1.555 61 1HG2 ILE 96 1HG2 ILE 96 2.716 0.511 0.511 62 2HG2 ILE 96 3HG2 ILE 96 3.547 -1.123 -1.123 63 3HG2 ILE 96 2HG2 ILE 96 2.085 -0.851 -0.851 64 1HD1 ILE 96 2HD1 ILE 96 3.783 0.050 0.050 65 2HD1 ILE 96 1HD1 ILE 96 4.856 -1.392 -1.392 66 3HD1 ILE 96 3HD1 ILE 96 5.506 0.143 0.143 67 H LYS 97 H LYS 97 6.525 -0.942 -0.942 68 HA LYS 97 HA LYS 97 5.868 -0.435 -0.435 69 1HB LYS 97 2HB LYS 97 8.518 -1.665 -1.665 70 2HB LYS 97 1HB LYS 97 7.811 -1.446 -1.446 71 1HG LYS 97 2HG LYS 97 7.802 1.043 1.043 72 2HG LYS 97 1HG LYS 97 8.681 0.802 0.802 73 1HD LYS 97 2HD LYS 97 10.602 -0.180 -0.180 74 2HD LYS 97 1HD LYS 97 9.672 -0.176 -0.176 75 1HE LYS 97 2HE LYS 97 11.297 1.720 1.720 76 2HE LYS 97 1HE LYS 97 9.591 2.334 2.334 77 1HZ LYS 97 3HZ LYS 97 9.731 2.618 2.618 78 2HZ LYS 97 2HZ LYS 97 11.333 2.056 2.056 79 3HZ LYS 97 1HZ LYS 97 10.946 3.496 3.496 80 H PHE 98 H PHE 98 5.651 -2.192 -2.192 81 HA PHE 98 HA PHE 98 5.646 -4.840 -4.840 82 1HB PHE 98 2HB PHE 98 3.533 -3.486 -3.486 83 2HB PHE 98 1HB PHE 98 3.624 -5.273 -5.273 84 HD1 PHE 98 1HD PHE 98 3.918 -6.043 -6.043 85 HD2 PHE 98 2HD PHE 98 1.970 -2.667 -2.667 86 HE1 PHE 98 1HE PHE 98 2.683 -5.888 -5.888 87 HE2 PHE 98 2HE PHE 98 0.583 -2.515 -2.515 88 HZ PHE 98 HZ PHE 98 0.834 -4.302 -4.302 89 H ARG 99 H ARG 99 6.826 -6.210 -6.210 90 HA ARG 99 HA ARG 99 7.903 -5.009 -5.009 91 1HB ARG 99 2HB ARG 99 8.901 -7.089 -7.089 92 2HB ARG 99 1HB ARG 99 9.763 -6.567 -6.567 93 1HG ARG 99 2HG ARG 99 10.359 -4.476 -4.476 94 2HG ARG 99 1HG ARG 99 9.045 -4.432 -4.432 95 1HD ARG 99 2HD ARG 99 11.508 -6.270 -6.270 96 2HD ARG 99 1HD ARG 99 11.258 -4.725 -4.725 97 HE ARG 99 HE ARG 99 9.903 -7.322 -7.322 98 1HH1 ARG 99 1HH2 ARG 99 9.842 -3.790 -3.790 99 2HH1 ARG 99 2HH2 ARG 99 8.771 -3.901 -3.901 100 1HH2 ARG 99 1HH1 ARG 99 8.472 -7.439 -7.439 101 2HH2 ARG 99 2HH1 ARG 99 7.985 -5.997 -5.997 102 HA PRO 100 HA PRO 100 6.240 -8.884 -8.884 103 1HB PRO 100 2HB PRO 100 8.384 -9.679 -9.679 104 2HB PRO 100 1HB PRO 100 7.039 -8.588 -8.588 105 1HG PRO 100 2HG PRO 100 9.865 -7.900 -7.900 106 2HG PRO 100 1HG PRO 100 8.768 -7.025 -7.025 107 1HD PRO 100 2HD PRO 100 9.334 -6.256 -6.256 108 2HD PRO 100 1HD PRO 100 7.805 -5.762 -5.762 109 H GLY 101 H GLY 101 6.438 -10.979 -10.979 110 1HA GLY 101 2HA GLY 101 7.517 -12.762 -12.762 111 2HA GLY 101 1HA GLY 101 8.990 -11.715 -11.715 112 H THR 102 H THR 102 6.358 -10.137 -10.137 113 HA THR 102 HA THR 102 6.533 -10.761 -10.761 114 HB THR 102 HB THR 102 5.359 -8.164 -8.164 115 HG1 THR 102 1HG THR 102 7.214 -7.328 -7.328 116 1HG2 THR 102 1HG2 THR 102 5.427 -9.742 -9.742 117 2HG2 THR 102 3HG2 THR 102 5.886 -7.988 -7.988 118 3HG2 THR 102 2HG2 THR 102 4.289 -8.440 -8.440 119 H ASP 103 H ASP 103 5.384 -12.486 -12.486 120 HA ASP 103 HA ASP 103 2.578 -12.072 -12.072 121 1HB ASP 103 2HB ASP 103 3.964 -13.585 -13.585 122 2HB ASP 103 1HB ASP 103 3.943 -14.655 -14.655 123 H GLU 104 H GLU 104 1.886 -14.646 -14.646 124 HA GLU 104 HA GLU 104 0.784 -12.858 -12.858 125 1HB GLU 104 2HB GLU 104 0.887 -15.840 -15.840 126 2HB GLU 104 1HB GLU 104 -0.234 -14.697 -14.697 127 1HG GLU 104 2HG GLU 104 -1.169 -13.993 -13.993 128 2HG GLU 104 1HG GLU 104 -0.120 -15.218 -15.218 129 H GLY 105 H GLY 105 3.459 -14.973 -14.973 130 1HA GLY 105 2HA GLY 105 2.915 -14.088 -14.088 131 2HA GLY 105 1HA GLY 105 4.156 -15.317 -15.317 132 H ASP 106 H ASP 106 4.743 -12.853 -12.853 133 HA ASP 106 HA ASP 106 6.500 -11.396 -11.396 134 1HB ASP 106 2HB ASP 106 7.190 -12.345 -12.345 135 2HB ASP 106 1HB ASP 106 6.056 -11.280 -11.280 136 H TYR 107 H TYR 107 3.660 -11.482 -11.482 137 HA TYR 107 HA TYR 107 3.606 -8.648 -8.648 138 1HB TYR 107 2HB TYR 107 3.128 -10.480 -10.480 139 2HB TYR 107 1HB TYR 107 1.746 -11.043 -11.043 140 HD1 TYR 107 1HD TYR 107 1.781 -7.512 -7.512 141 HD2 TYR 107 2HD TYR 107 0.848 -11.200 -11.200 142 HE1 TYR 107 1HE TYR 107 -0.321 -6.583 -6.583 143 HE2 TYR 107 2HE TYR 107 -0.870 -10.048 -10.048 144 HH TYR 107 HH TYR 107 -2.221 -8.300 -8.300 145 H GLN 108 H GLN 108 0.744 -10.597 -10.597 146 HA GLN 108 HA GLN 108 -0.382 -8.604 -8.604 147 1HB GLN 108 2HB GLN 108 -1.198 -11.135 -11.135 148 2HB GLN 108 1HB GLN 108 -2.090 -9.833 -9.833 149 1HG GLN 108 2HG GLN 108 -0.389 -11.803 -11.803 150 2HG GLN 108 1HG GLN 108 -1.919 -12.224 -12.224 151 1HE2 GLN 108 1HE2 GLN 108 -0.853 -8.927 -8.927 152 2HE2 GLN 108 2HE2 GLN 108 -2.038 -8.825 -8.825 153 H VAL 109 H VAL 109 2.205 -10.159 -10.159 154 HA VAL 109 HA VAL 109 1.886 -9.447 -9.447 155 HB VAL 109 HB VAL 109 4.414 -9.538 -9.538 156 1HG1 VAL 109 1HG1 VAL 109 4.010 -9.355 -9.355 157 2HG1 VAL 109 3HG1 VAL 109 5.550 -9.861 -9.861 158 3HG1 VAL 109 2HG1 VAL 109 4.933 -8.205 -8.205 159 1HG2 VAL 109 1HG2 VAL 109 3.062 -11.613 -11.613 160 2HG2 VAL 109 3HG2 VAL 109 3.236 -11.708 -11.708 161 3HG2 VAL 109 2HG2 VAL 109 4.696 -11.780 -11.780 162 H LYS 110 H LYS 110 3.253 -7.723 -7.723 163 HA LYS 110 HA LYS 110 3.279 -5.252 -5.252 164 1HB LYS 110 2HB LYS 110 4.274 -6.062 -6.062 165 2HB LYS 110 1HB LYS 110 4.366 -4.406 -4.406 166 1HG LYS 110 2HG LYS 110 5.798 -6.925 -6.925 167 2HG LYS 110 1HG LYS 110 6.413 -5.251 -5.251 168 1HD LYS 110 2HD LYS 110 5.697 -4.372 -4.372 169 2HD LYS 110 1HD LYS 110 4.951 -5.947 -5.947 170 1HE LYS 110 2HE LYS 110 7.128 -5.691 -5.691 171 2HE LYS 110 1HE LYS 110 7.221 -7.042 -7.042 172 1HZ LYS 110 2HZ LYS 110 8.258 -5.513 -5.513 173 2HZ LYS 110 1HZ LYS 110 8.172 -4.252 -4.252 174 3HZ LYS 110 3HZ LYS 110 9.134 -5.616 -5.616 175 H LEU 111 H LEU 111 0.891 -6.805 -6.805 176 HA LEU 111 HA LEU 111 -0.381 -4.408 -4.408 177 1HB LEU 111 2HB LEU 111 -0.792 -6.738 -6.738 178 2HB LEU 111 1HB LEU 111 -1.658 -7.119 -7.119 179 HG LEU 111 HG LEU 111 -2.393 -4.735 -4.735 180 1HD1 LEU 111 2HD1 LEU 111 -2.133 -6.759 -6.759 181 2HD1 LEU 111 1HD1 LEU 111 -3.301 -7.654 -7.654 182 3HD1 LEU 111 3HD1 LEU 111 -3.844 -6.208 -6.208 183 1HD2 LEU 111 3HD2 LEU 111 -3.988 -6.601 -6.601 184 2HD2 LEU 111 2HD2 LEU 111 -3.684 -4.834 -4.834 185 3HD2 LEU 111 1HD2 LEU 111 -4.771 -5.425 -5.425 186 H ARG 112 H ARG 112 0.097 -6.586 -6.586 187 HA ARG 112 HA ARG 112 -1.629 -5.220 -5.220 188 1HB ARG 112 2HB ARG 112 -0.604 -7.462 -7.462 189 2HB ARG 112 1HB ARG 112 0.873 -6.594 -6.594 190 1HG ARG 112 2HG ARG 112 -0.489 -5.318 -5.318 191 2HG ARG 112 1HG ARG 112 -1.957 -6.206 -6.206 192 1HD ARG 112 2HD ARG 112 -0.917 -8.370 -8.370 193 2HD ARG 112 1HD ARG 112 0.562 -7.444 -7.444 194 HE ARG 112 HE ARG 112 -1.917 -6.315 -6.315 195 1HH1 ARG 112 1HH2 ARG 112 0.507 -8.910 -8.910 196 2HH1 ARG 112 2HH2 ARG 112 0.261 -9.081 -9.081 197 1HH2 ARG 112 1HH1 ARG 112 -2.240 -6.561 -6.561 198 2HH2 ARG 112 2HH1 ARG 112 -1.323 -7.731 -7.731 199 H SER 113 H SER 113 2.005 -4.647 -4.647 200 HA SER 113 HA SER 113 2.119 -2.579 -2.579 201 1HB SER 113 2HB SER 113 3.733 -2.950 -2.950 202 2HB SER 113 1HB SER 113 3.955 -1.648 -1.648 203 HG SER 113 HG SER 113 5.211 -3.514 -3.514 204 H LEU 114 H LEU 114 0.905 -2.614 -2.614 205 HA LEU 114 HA LEU 114 0.627 0.094 0.094 206 1HB LEU 114 2HB LEU 114 -0.629 -2.347 -2.347 207 2HB LEU 114 1HB LEU 114 -1.641 -0.872 -0.872 208 HG LEU 114 HG LEU 114 1.208 -1.093 -1.093 209 1HD1 LEU 114 3HD1 LEU 114 -0.546 -2.488 -2.488 210 2HD1 LEU 114 2HD1 LEU 114 -1.531 -1.001 -1.001 211 3HD1 LEU 114 1HD1 LEU 114 0.081 -1.204 -1.204 212 1HD2 LEU 114 2HD2 LEU 114 -0.895 1.173 1.173 213 2HD2 LEU 114 1HD2 LEU 114 0.708 1.257 1.257 214 3HD2 LEU 114 3HD2 LEU 114 0.639 1.152 1.152 215 H ILE 115 H ILE 115 -1.630 -2.209 -2.209 216 HA ILE 115 HA ILE 115 -3.782 -0.517 -0.517 217 HB ILE 115 HB ILE 115 -3.181 -1.930 -1.930 218 1HG1 ILE 115 2HG1 ILE 115 -2.670 -3.665 -3.665 219 2HG1 ILE 115 1HG1 ILE 115 -4.148 -4.010 -4.010 220 1HG2 ILE 115 3HG2 ILE 115 -5.550 -1.201 -1.201 221 2HG2 ILE 115 2HG2 ILE 115 -5.715 -2.171 -2.171 222 3HG2 ILE 115 1HG2 ILE 115 -5.077 -0.486 -0.486 223 1HD1 ILE 115 3HD1 ILE 115 -5.538 -3.273 -3.273 224 2HD1 ILE 115 2HD1 ILE 115 -3.968 -3.013 -3.013 225 3HD1 ILE 115 1HD1 ILE 115 -4.462 -4.676 -4.676 226 H ARG 116 H ARG 116 -1.119 -0.971 -0.971 227 HA ARG 116 HA ARG 116 -1.617 0.783 0.783 228 1HB ARG 116 2HB ARG 116 0.455 -0.882 -0.882 229 2HB ARG 116 1HB ARG 116 1.243 0.627 0.627 230 1HG ARG 116 2HG ARG 116 1.827 0.387 0.387 231 2HG ARG 116 1HG ARG 116 0.565 1.666 1.666 232 1HD ARG 116 2HD ARG 116 0.138 0.106 0.106 233 2HD ARG 116 1HD ARG 116 -1.152 -0.160 -0.160 234 HE ARG 116 HE ARG 116 1.280 -1.851 -1.851 235 1HH1 ARG 116 1HH2 ARG 116 -2.001 -1.535 -1.535 236 2HH1 ARG 116 2HH2 ARG 116 -2.242 -3.240 -3.240 237 1HH2 ARG 116 1HH1 ARG 116 0.939 -4.145 -4.145 238 2HH2 ARG 116 2HH1 ARG 116 -0.548 -4.747 -4.747 239 H PHE 117 H PHE 117 0.190 1.512 1.512 240 HA PHE 117 HA PHE 117 0.675 4.268 4.268 241 1HB PHE 117 2HB PHE 117 0.247 2.714 2.714 242 2HB PHE 117 1HB PHE 117 0.559 4.526 4.526 243 HD1 PHE 117 2HD PHE 117 2.325 5.336 5.336 244 HD2 PHE 117 1HD PHE 117 1.894 1.259 1.259 245 HE1 PHE 117 2HE PHE 117 4.758 5.014 5.014 246 HE2 PHE 117 1HE PHE 117 4.266 0.816 0.816 247 HZ PHE 117 HZ PHE 117 5.698 2.732 2.732 248 H LEU 118 H LEU 118 -2.116 2.767 2.767 249 HA LEU 118 HA LEU 118 -3.356 5.127 5.127 250 1HB LEU 118 2HB LEU 118 -3.986 2.475 2.475 251 2HB LEU 118 1HB LEU 118 -5.286 3.203 3.203 252 HG LEU 118 HG LEU 118 -4.937 5.261 5.261 253 1HD1 LEU 118 2HD1 LEU 118 -4.032 2.683 2.683 254 2HD1 LEU 118 1HD1 LEU 118 -4.959 3.954 3.954 255 3HD1 LEU 118 3HD1 LEU 118 -3.378 4.377 4.377 256 1HD2 LEU 118 2HD2 LEU 118 -6.689 2.863 2.863 257 2HD2 LEU 118 1HD2 LEU 118 -6.901 4.609 4.609 258 3HD2 LEU 118 3HD2 LEU 118 -6.924 4.116 4.116 259 H GLU 119 H GLU 119 -3.718 3.060 3.060 260 HA GLU 119 HA GLU 119 -5.878 4.558 4.558 261 1HB GLU 119 2HB GLU 119 -6.188 2.820 2.820 262 2HB GLU 119 1HB GLU 119 -5.628 2.100 2.100 263 1HG GLU 119 2HG GLU 119 -4.523 0.824 0.824 264 2HG GLU 119 1HG GLU 119 -3.284 2.001 2.001 265 H GLU 120 H GLU 120 -2.489 4.857 4.857 266 HA GLU 120 HA GLU 120 -2.507 6.284 6.284 267 1HB GLU 120 2HB GLU 120 -0.586 6.197 6.197 268 2HB GLU 120 1HB GLU 120 -0.283 7.261 7.261 269 1HG GLU 120 2HG GLU 120 -0.687 4.258 4.258 270 2HG GLU 120 1HG GLU 120 0.871 4.869 4.869 271 H GLY 121 H GLY 121 -3.728 6.818 6.818 272 1HA GLY 121 2HA GLY 121 -5.002 8.468 8.468 273 2HA GLY 121 1HA GLY 121 -4.348 9.517 9.517 274 H ASP 122 H ASP 122 -3.077 7.631 7.631 275 HA ASP 122 HA ASP 122 -1.992 10.161 10.161 276 1HB ASP 122 2HB ASP 122 -0.454 7.511 7.511 277 2HB ASP 122 1HB ASP 122 0.143 9.106 9.106 278 H LYS 123 H LYS 123 -1.164 9.555 9.555 279 HA LYS 123 HA LYS 123 -3.179 7.829 7.829 280 1HB LYS 123 2HB LYS 123 -0.762 9.117 9.117 281 2HB LYS 123 1HB LYS 123 -2.269 8.525 8.525 282 1HG LYS 123 2HG LYS 123 -3.467 10.523 10.523 283 2HG LYS 123 1HG LYS 123 -2.223 11.002 11.002 284 1HD LYS 123 2HD LYS 123 -2.110 12.268 12.268 285 2HD LYS 123 1HD LYS 123 -0.601 11.550 11.550 286 1HE LYS 123 2HE LYS 123 -0.508 9.756 9.756 287 2HE LYS 123 1HE LYS 123 -2.222 10.001 10.001 288 1HZ LYS 123 3HZ LYS 123 -1.534 12.116 12.116 289 2HZ LYS 123 2HZ LYS 123 0.071 11.832 11.832 290 3HZ LYS 123 1HZ LYS 123 -0.669 10.809 10.809 291 H ALA 124 H ALA 124 -2.284 5.951 5.951 292 HA ALA 124 HA ALA 124 0.545 5.549 5.549 293 1HB ALA 124 1HB ALA 124 -1.667 3.500 3.500 294 2HB ALA 124 3HB ALA 124 0.154 3.281 3.281 295 3HB ALA 124 2HB ALA 124 -0.931 3.960 3.960 296 H LYS 125 H LYS 125 1.711 5.674 5.674 297 HA LYS 125 HA LYS 125 0.224 5.411 5.411 298 1HB LYS 125 2HB LYS 125 1.388 7.602 7.602 299 2HB LYS 125 1HB LYS 125 2.934 6.738 6.738 300 1HG LYS 125 2HG LYS 125 3.040 6.044 6.044 301 2HG LYS 125 1HG LYS 125 1.404 6.731 6.731 302 1HD LYS 125 2HD LYS 125 3.754 8.423 8.423 303 2HD LYS 125 1HD LYS 125 3.498 8.111 8.111 304 1HE LYS 125 2HE LYS 125 1.289 9.165 9.165 305 2HE LYS 125 1HE LYS 125 1.400 9.456 9.456 306 1HZ LYS 125 1HZ LYS 125 3.243 10.545 10.545 307 2HZ LYS 125 3HZ LYS 125 1.994 11.389 11.389 308 3HZ LYS 125 2HZ LYS 125 3.325 10.820 10.820 309 H ILE 126 H ILE 126 0.378 3.486 3.486 310 HA ILE 126 HA ILE 126 2.496 1.758 1.758 311 HB ILE 126 HB ILE 126 0.593 1.442 1.442 312 1HG1 ILE 126 2HG1 ILE 126 -0.965 2.077 2.077 313 2HG1 ILE 126 1HG1 ILE 126 -0.990 0.285 0.285 314 1HG2 ILE 126 3HG2 ILE 126 2.099 -0.362 -0.362 315 2HG2 ILE 126 2HG2 ILE 126 0.826 -0.980 -0.980 316 3HG2 ILE 126 1HG2 ILE 126 2.350 -0.284 -0.284 317 1HD1 ILE 126 3HD1 ILE 126 0.654 0.391 0.391 318 2HD1 ILE 126 2HD1 ILE 126 0.017 2.064 2.064 319 3HD1 ILE 126 1HD1 ILE 126 -1.122 0.652 0.652 320 H THR 127 H THR 127 4.345 1.399 1.399 321 HA THR 127 HA THR 127 4.402 2.598 2.598 322 HB THR 127 HB THR 127 6.646 2.198 2.198 323 HG1 THR 127 1HG THR 127 5.196 3.795 3.795 324 1HG2 THR 127 3HG2 THR 127 6.439 3.440 3.440 325 2HG2 THR 127 2HG2 THR 127 7.809 3.824 3.824 326 3HG2 THR 127 1HG2 THR 127 7.563 2.133 2.133 327 H LEU 128 H LEU 128 4.588 1.069 1.069 328 HA LEU 128 HA LEU 128 5.413 -1.628 -1.628 329 1HB LEU 128 2HB LEU 128 4.228 -0.340 -0.340 330 2HB LEU 128 1HB LEU 128 5.790 -0.942 -0.942 331 HG LEU 128 HG LEU 128 3.968 -2.511 -2.511 332 1HD1 LEU 128 2HD1 LEU 128 6.030 -3.702 -3.702 333 2HD1 LEU 128 1HD1 LEU 128 5.479 -3.746 -3.746 334 3HD1 LEU 128 3HD1 LEU 128 4.544 -4.615 -4.615 335 1HD2 LEU 128 2HD2 LEU 128 2.434 -1.498 -1.498 336 2HD2 LEU 128 1HD2 LEU 128 2.423 -3.289 -3.289 337 3HD2 LEU 128 3HD2 LEU 128 3.232 -2.168 -2.168 338 H ARG 129 H ARG 129 7.456 -2.546 -2.546 339 HA ARG 129 HA ARG 129 9.270 -0.659 -0.659 340 1HB ARG 129 2HB ARG 129 9.808 -0.552 -0.552 341 2HB ARG 129 1HB ARG 129 9.866 -2.352 -2.352 342 1HG ARG 129 2HG ARG 129 11.842 -2.348 -2.348 343 2HG ARG 129 1HG ARG 129 11.525 -0.655 -0.655 344 1HD ARG 129 2HD ARG 129 13.515 -0.891 -0.891 345 2HD ARG 129 1HD ARG 129 12.172 0.091 0.091 346 HE ARG 129 HE ARG 129 11.816 -2.719 -2.719 347 1HH1 ARG 129 1HH2 ARG 129 13.828 0.133 0.133 348 2HH1 ARG 129 2HH2 ARG 129 14.184 -0.340 -0.340 349 1HH2 ARG 129 1HH1 ARG 129 12.301 -3.358 -3.358 350 2HH2 ARG 129 2HH1 ARG 129 13.304 -2.355 -2.355 351 H PHE 130 H PHE 130 9.067 -1.581 -1.581 352 HA PHE 130 HA PHE 130 8.380 -4.356 -4.356 353 1HB PHE 130 2HB PHE 130 9.214 -2.073 -2.073 354 2HB PHE 130 1HB PHE 130 8.673 -3.763 -3.763 355 HD1 PHE 130 1HD PHE 130 6.574 -4.652 -4.652 356 HD2 PHE 130 2HD PHE 130 7.678 -0.555 -0.555 357 HE1 PHE 130 1HE PHE 130 4.227 -3.947 -3.947 358 HE2 PHE 130 2HE PHE 130 5.427 0.107 0.107 359 HZ PHE 130 HZ PHE 130 3.594 -1.607 -1.607 360 H ARG 131 H ARG 131 9.758 -5.967 -5.967 361 HA ARG 131 HA ARG 131 12.517 -5.152 -5.152 362 1HB ARG 131 2HB ARG 131 11.666 -7.208 -7.208 363 2HB ARG 131 1HB ARG 131 12.051 -8.093 -8.093 364 1HG ARG 131 2HG ARG 131 14.013 -8.074 -8.074 365 2HG ARG 131 1HG ARG 131 14.365 -7.059 -7.059 366 1HD ARG 131 2HD ARG 131 15.211 -6.035 -6.035 367 2HD ARG 131 1HD ARG 131 13.970 -4.978 -4.978 368 HE ARG 131 HE ARG 131 12.674 -6.794 -6.794 369 1HH1 ARG 131 1HH2 ARG 131 14.777 -3.919 -3.919 370 2HH1 ARG 131 2HH2 ARG 131 14.179 -3.227 -3.227 371 1HH2 ARG 131 1HH1 ARG 131 11.868 -5.850 -5.850 372 2HH2 ARG 131 2HH1 ARG 131 12.504 -4.339 -4.339 373 H GLY 132 H GLY 132 10.040 -5.046 -5.046 374 1HA GLY 132 2HA GLY 132 10.776 -6.729 -6.729 375 2HA GLY 132 1HA GLY 132 9.215 -5.836 -5.836 376 H ARG 133 H ARG 133 10.764 -3.792 -3.792 377 HA ARG 133 HA ARG 133 11.561 -1.809 -1.809 378 1HB ARG 133 2HB ARG 133 13.463 -3.088 -3.088 379 2HB ARG 133 1HB ARG 133 13.717 -1.522 -1.522 380 1HG ARG 133 2HG ARG 133 13.642 -2.684 -2.684 381 2HG ARG 133 1HG ARG 133 13.505 -4.268 -4.268 382 1HD ARG 133 2HD ARG 133 15.725 -3.932 -3.932 383 2HD ARG 133 1HD ARG 133 15.879 -2.315 -2.315 384 HE ARG 133 HE ARG 133 15.248 -4.315 -4.315 385 1HH1 ARG 133 1HH2 ARG 133 17.850 -3.321 -3.321 386 2HH1 ARG 133 2HH2 ARG 133 19.134 -3.883 -3.883 387 1HH2 ARG 133 1HH1 ARG 133 17.001 -5.075 -5.075 388 2HH2 ARG 133 2HH1 ARG 133 18.646 -4.893 -4.893 389 H GLU 134 H GLU 134 12.604 -0.228 -0.228 390 HA GLU 134 HA GLU 134 11.455 1.604 1.604 391 1HB GLU 134 2HB GLU 134 13.538 0.938 0.938 392 2HB GLU 134 1HB GLU 134 12.524 0.197 0.197 393 1HG GLU 134 2HG GLU 134 11.551 2.478 2.478 394 2HG GLU 134 1HG GLU 134 12.532 3.190 3.190 395 H MET 135 H MET 135 9.370 1.974 1.974 396 HA MET 135 HA MET 135 7.276 2.033 2.033 397 1HB MET 135 2HB MET 135 7.981 3.246 3.246 398 2HB MET 135 1HB MET 135 7.889 1.701 1.701 399 1HG MET 135 2HG MET 135 5.914 3.160 3.160 400 2HG MET 135 1HG MET 135 5.480 1.563 1.563 401 1HE MET 135 1HE MET 135 6.239 5.279 5.279 402 2HE MET 135 3HE MET 135 5.450 5.629 5.629 403 3HE MET 135 2HE MET 135 6.963 4.664 4.664 404 H ALA 136 H ALA 136 7.200 0.139 0.139 405 HA ALA 136 HA ALA 136 7.544 -2.366 -2.366 406 1HB ALA 136 3HB ALA 136 8.374 -1.573 -1.573 407 2HB ALA 136 2HB ALA 136 6.680 -1.578 -1.578 408 3HB ALA 136 1HB ALA 136 7.492 -3.119 -3.119 409 H HIS 137 H HIS 137 5.850 -3.451 -3.451 410 HA HIS 137 HA HIS 137 3.823 -4.493 -4.493 411 1HB HIS 137 2HB HIS 137 4.990 -5.094 -5.094 412 2HB HIS 137 1HB HIS 137 3.593 -6.063 -6.063 413 HD1 HIS 137 1HD HIS 137 4.348 -7.570 -7.570 414 HD2 HIS 137 2HD HIS 137 7.246 -4.894 -4.894 415 HE1 HIS 137 1HE HIS 137 6.506 -8.083 -8.083 416 H GLN 138 H GLN 138 1.640 -4.809 -4.809 417 HA GLN 138 HA GLN 138 0.577 -3.322 -3.322 418 1HB GLN 138 2HB GLN 138 -0.771 -3.855 -3.855 419 2HB GLN 138 1HB GLN 138 -1.630 -3.205 -3.205 420 1HG GLN 138 2HG GLN 138 -0.265 -1.138 -1.138 421 2HG GLN 138 1HG GLN 138 0.753 -1.800 -1.800 422 1HE2 GLN 138 1HE2 GLN 138 -2.530 -0.655 -0.655 423 2HE2 GLN 138 2HE2 GLN 138 -3.082 -0.353 -0.353 424 H GLN 139 H GLN 139 1.702 -6.019 -6.019 425 HA GLN 139 HA GLN 139 -0.449 -7.787 -7.787 426 1HB GLN 139 2HB GLN 139 2.446 -8.681 -8.681 427 2HB GLN 139 1HB GLN 139 0.940 -9.632 -9.632 428 1HG GLN 139 2HG GLN 139 0.359 -8.159 -8.159 429 2HG GLN 139 1HG GLN 139 2.020 -7.440 -7.440 430 1HE2 GLN 139 1HE2 GLN 139 3.779 -9.271 -9.271 431 2HE2 GLN 139 2HE2 GLN 139 3.754 -10.605 -10.605 432 H ILE 140 H ILE 140 2.973 -6.996 -6.996 433 HA ILE 140 HA ILE 140 3.313 -8.016 -8.016 434 HB ILE 140 HB ILE 140 4.687 -5.985 -5.985 435 1HG1 ILE 140 2HG1 ILE 140 5.257 -8.949 -8.949 436 2HG1 ILE 140 1HG1 ILE 140 4.564 -8.330 -8.330 437 1HG2 ILE 140 3HG2 ILE 140 5.314 -7.327 -7.327 438 2HG2 ILE 140 2HG2 ILE 140 6.581 -6.530 -6.530 439 3HG2 ILE 140 1HG2 ILE 140 5.245 -5.555 -5.555 440 1HD1 ILE 140 1HD1 ILE 140 6.651 -6.894 -6.894 441 2HD1 ILE 140 3HD1 ILE 140 7.397 -7.820 -7.820 442 3HD1 ILE 140 2HD1 ILE 140 6.892 -8.675 -8.675 443 H GLY 141 H GLY 141 2.315 -4.817 -4.817 444 1HA GLY 141 2HA GLY 141 2.279 -3.790 -3.790 445 2HA GLY 141 1HA GLY 141 1.480 -3.119 -3.119 446 H MET 142 H MET 142 -0.472 -4.599 -4.599 447 HA MET 142 HA MET 142 -2.178 -4.074 -4.074 448 1HB MET 142 2HB MET 142 -2.741 -4.244 -4.244 449 2HB MET 142 1HB MET 142 -4.011 -3.887 -3.887 450 1HG MET 142 2HG MET 142 -2.350 -1.973 -1.973 451 2HG MET 142 1HG MET 142 -1.683 -2.138 -2.138 452 1HE MET 142 1HE MET 142 -2.927 -1.912 -1.912 453 2HE MET 142 3HE MET 142 -4.369 -2.914 -2.914 454 3HE MET 142 2HE MET 142 -4.575 -1.245 -1.245 455 H GLU 143 H GLU 143 -0.798 -6.983 -6.983 456 HA GLU 143 HA GLU 143 -3.253 -8.043 -8.043 457 1HB GLU 143 2HB GLU 143 -1.018 -9.495 -9.495 458 2HB GLU 143 1HB GLU 143 -0.621 -9.227 -9.227 459 1HG GLU 143 2HG GLU 143 -1.719 -11.252 -11.252 460 2HG GLU 143 1HG GLU 143 -3.050 -10.145 -10.145 461 H VAL 144 H VAL 144 -0.169 -6.902 -6.902 462 HA VAL 144 HA VAL 144 -0.621 -7.581 -7.581 463 HB VAL 144 HB VAL 144 1.398 -5.678 -5.678 464 1HG1 VAL 144 3HG1 VAL 144 0.853 -7.132 -7.132 465 2HG1 VAL 144 2HG1 VAL 144 2.514 -6.686 -6.686 466 3HG1 VAL 144 1HG1 VAL 144 1.272 -5.392 -5.392 467 1HG2 VAL 144 3HG2 VAL 144 0.829 -8.659 -8.659 468 2HG2 VAL 144 2HG2 VAL 144 1.387 -7.875 -7.875 469 3HG2 VAL 144 1HG2 VAL 144 2.560 -8.085 -8.085 470 H LEU 145 H LEU 145 -0.385 -4.413 -4.413 471 HA LEU 145 HA LEU 145 -1.259 -2.839 -2.839 472 1HB LEU 145 2HB LEU 145 -1.954 -2.627 -2.627 473 2HB LEU 145 1HB LEU 145 -2.278 -1.317 -1.317 474 HG LEU 145 HG LEU 145 0.447 -2.474 -2.474 475 1HD1 LEU 145 3HD1 LEU 145 -0.912 0.195 0.195 476 2HD1 LEU 145 2HD1 LEU 145 0.823 -0.176 -0.176 477 3HD1 LEU 145 1HD1 LEU 145 -0.470 -1.152 -1.152 478 1HD2 LEU 145 3HD2 LEU 145 -0.474 -0.455 -0.455 479 2HD2 LEU 145 2HD2 LEU 145 0.547 -1.905 -1.905 480 3HD2 LEU 145 1HD2 LEU 145 1.237 -0.462 -0.462 481 H ASN 146 H ASN 146 -3.209 -4.220 -4.220 482 HA ASN 146 HA ASN 146 -5.781 -3.405 -3.405 483 1HB ASN 146 2HB ASN 146 -4.436 -4.896 -4.896 484 2HB ASN 146 1HB ASN 146 -5.609 -6.029 -6.029 485 1HD2 ASN 146 2HD2 ASN 146 -5.994 -6.083 -6.083 486 2HD2 ASN 146 1HD2 ASN 146 -7.246 -5.104 -5.104 487 H ARG 147 H ARG 147 -3.981 -6.451 -6.451 488 HA ARG 147 HA ARG 147 -6.299 -7.166 -7.166 489 1HB ARG 147 2HB ARG 147 -5.141 -8.805 -8.805 490 2HB ARG 147 1HB ARG 147 -3.537 -8.110 -8.110 491 1HG ARG 147 2HG ARG 147 -3.552 -9.278 -9.278 492 2HG ARG 147 1HG ARG 147 -5.383 -9.281 -9.281 493 1HD ARG 147 2HD ARG 147 -4.373 -11.602 -11.602 494 2HD ARG 147 1HD ARG 147 -5.226 -11.090 -11.090 495 HE ARG 147 HE ARG 147 -2.593 -10.131 -10.131 496 1HH1 ARG 147 1HH1 ARG 147 -4.102 -13.308 -13.308 497 2HH1 ARG 147 2HH1 ARG 147 -2.814 -14.214 -14.214 498 1HH2 ARG 147 1HH2 ARG 147 -0.876 -11.366 -11.366 499 2HH2 ARG 147 2HH2 ARG 147 -0.952 -13.097 -13.097 500 H VAL 148 H VAL 148 -3.575 -4.955 -4.955 501 HA VAL 148 HA VAL 148 -3.403 -5.707 -5.707 502 HB VAL 148 HB VAL 148 -2.928 -2.938 -2.938 503 1HG1 VAL 148 1HG1 VAL 148 -2.867 -3.766 -3.766 504 2HG1 VAL 148 3HG1 VAL 148 -1.534 -4.878 -4.878 505 3HG1 VAL 148 2HG1 VAL 148 -1.304 -3.091 -3.091 506 1HG2 VAL 148 1HG2 VAL 148 -1.107 -5.322 -5.322 507 2HG2 VAL 148 3HG2 VAL 148 -1.753 -4.131 -4.131 508 3HG2 VAL 148 2HG2 VAL 148 -0.550 -3.593 -3.593 509 H LYS 149 H LYS 149 -5.074 -3.349 -3.349 510 HA LYS 149 HA LYS 149 -6.384 -1.899 -1.899 511 1HB LYS 149 2HB LYS 149 -6.230 -1.402 -1.402 512 2HB LYS 149 1HB LYS 149 -7.427 -2.735 -2.735 513 1HG LYS 149 2HG LYS 149 -8.503 -0.590 -0.590 514 2HG LYS 149 1HG LYS 149 -9.168 -1.575 -1.575 515 1HD LYS 149 2HD LYS 149 -8.931 0.833 0.833 516 2HD LYS 149 1HD LYS 149 -7.995 -0.202 -0.202 517 1HE LYS 149 2HE LYS 149 -6.563 1.098 1.098 518 2HE LYS 149 1HE LYS 149 -6.951 2.049 2.049 519 1HZ LYS 149 2HZ LYS 149 -5.784 0.427 0.427 520 2HZ LYS 149 1HZ LYS 149 -5.419 -0.502 -0.502 521 3HZ LYS 149 3HZ LYS 149 -4.781 1.063 1.063 522 H ASP 150 H ASP 150 -7.586 -4.682 -4.682 523 HA ASP 150 HA ASP 150 -10.087 -4.700 -4.700 524 1HB ASP 150 2HB ASP 150 -8.206 -6.634 -6.634 525 2HB ASP 150 1HB ASP 150 -9.787 -7.140 -7.140 526 H ASP 151 H ASP 151 -6.996 -6.371 -6.371 527 HA ASP 151 HA ASP 151 -8.667 -7.455 -7.455 528 1HB ASP 151 2HB ASP 151 -6.459 -8.349 -8.349 529 2HB ASP 151 1HB ASP 151 -5.661 -7.004 -7.004 530 H LEU 152 H LEU 152 -6.949 -4.241 -4.241 531 HA LEU 152 HA LEU 152 -7.126 -3.920 -3.920 532 1HB LEU 152 2HB LEU 152 -6.170 -2.588 -2.588 533 2HB LEU 152 1HB LEU 152 -7.138 -1.472 -1.472 534 HG LEU 152 HG LEU 152 -5.012 -3.249 -3.249 535 1HD1 LEU 152 3HD1 LEU 152 -4.201 -2.276 -2.276 536 2HD1 LEU 152 2HD1 LEU 152 -4.547 -0.600 -0.600 537 3HD1 LEU 152 1HD1 LEU 152 -3.294 -1.614 -1.614 538 1HD2 LEU 152 3HD2 LEU 152 -6.317 -0.581 -0.581 539 2HD2 LEU 152 2HD2 LEU 152 -6.484 -2.175 -2.175 540 3HD2 LEU 152 1HD2 LEU 152 -4.935 -1.289 -1.289 541 H GLN 153 H GLN 153 -9.115 -3.054 -3.054 542 HA GLN 153 HA GLN 153 -10.458 -1.122 -1.122 543 1HB GLN 153 2HB GLN 153 -10.597 -3.458 -3.458 544 2HB GLN 153 1HB GLN 153 -12.056 -3.641 -3.641 545 1HG GLN 153 2HG GLN 153 -12.846 -1.397 -1.397 546 2HG GLN 153 1HG GLN 153 -11.195 -1.362 -1.362 547 1HE2 GLN 153 1HE2 GLN 153 -12.473 -1.289 -1.289 548 2HE2 GLN 153 2HE2 GLN 153 -12.978 -2.780 -2.780 549 H GLU 154 H GLU 154 -10.846 -3.349 -3.349 550 HA GLU 154 HA GLU 154 -13.247 -2.767 -2.767 551 1HB GLU 154 2HB GLU 154 -10.647 -3.161 -3.161 552 2HB GLU 154 1HB GLU 154 -12.276 -3.765 -3.765 553 1HG GLU 154 2HG GLU 154 -11.960 -5.354 -5.354 554 2HG GLU 154 1HG GLU 154 -10.289 -4.641 -4.641 555 H LEU 155 H LEU 155 -10.063 -1.412 -1.412 556 HA LEU 155 HA LEU 155 -11.036 0.683 0.683 557 1HB LEU 155 2HB LEU 155 -9.349 -1.154 -1.154 558 2HB LEU 155 1HB LEU 155 -8.181 -0.359 -0.359 559 HG LEU 155 HG LEU 155 -9.574 1.408 1.408 560 1HD1 LEU 155 2HD1 LEU 155 -7.624 -0.800 -0.800 561 2HD1 LEU 155 1HD1 LEU 155 -8.093 0.620 0.620 562 3HD1 LEU 155 3HD1 LEU 155 -9.340 -0.589 -0.589 563 1HD2 LEU 155 2HD2 LEU 155 -6.595 1.073 1.073 564 2HD2 LEU 155 1HD2 LEU 155 -7.736 2.328 2.328 565 3HD2 LEU 155 3HD2 LEU 155 -7.282 2.331 2.331 566 H ALA 156 H ALA 156 -8.853 -0.154 -0.154 567 HA ALA 156 HA ALA 156 -8.372 2.757 2.757 568 1HB ALA 156 2HB ALA 156 -6.220 1.424 1.424 569 2HB ALA 156 1HB ALA 156 -6.635 0.675 0.675 570 3HB ALA 156 3HB ALA 156 -6.471 2.450 2.450 571 H VAL 157 H VAL 157 -9.233 3.749 3.749 572 HA VAL 157 HA VAL 157 -8.628 2.129 2.129 573 HB VAL 157 HB VAL 157 -10.649 2.894 2.894 574 1HG1 VAL 157 1HG1 VAL 157 -11.453 2.329 2.329 575 2HG1 VAL 157 3HG1 VAL 157 -12.537 2.226 2.226 576 3HG1 VAL 157 2HG1 VAL 157 -11.098 1.111 1.111 577 1HG2 VAL 157 2HG2 VAL 157 -10.480 5.077 5.077 578 2HG2 VAL 157 1HG2 VAL 157 -10.642 5.238 5.238 579 3HG2 VAL 157 3HG2 VAL 157 -12.081 4.739 4.739 580 H VAL 158 H VAL 158 -9.175 3.280 3.280 581 HA VAL 158 HA VAL 158 -6.646 4.266 4.266 582 HB VAL 158 HB VAL 158 -8.444 4.521 4.521 583 1HG1 VAL 158 2HG1 VAL 158 -5.966 2.755 2.755 584 2HG1 VAL 158 1HG1 VAL 158 -6.631 2.856 2.856 585 3HG1 VAL 158 3HG1 VAL 158 -5.916 4.299 4.299 586 1HG2 VAL 158 3HG2 VAL 158 -9.786 2.685 2.685 587 2HG2 VAL 158 2HG2 VAL 158 -9.213 2.461 2.461 588 3HG2 VAL 158 1HG2 VAL 158 -8.360 1.616 1.616 589 H GLU 159 H GLU 159 -6.037 6.022 6.022 590 HA GLU 159 HA GLU 159 -7.838 8.264 8.264 591 1HB GLU 159 2HB GLU 159 -5.404 8.459 8.459 592 2HB GLU 159 1HB GLU 159 -5.139 7.817 7.817 593 1HG GLU 159 2HG GLU 159 -6.412 9.890 9.890 594 2HG GLU 159 1HG GLU 159 -6.608 10.419 10.419 595 H SER 160 H SER 160 -6.104 5.719 5.719 596 HA SER 160 HA SER 160 -7.959 5.855 5.855 597 1HB SER 160 2HB SER 160 -6.045 7.705 7.705 598 2HB SER 160 1HB SER 160 -5.207 6.213 6.213 599 HG SER 160 HG SER 160 -6.931 5.956 5.956 600 H PHE 161 H PHE 161 -7.625 3.909 3.909 601 HA PHE 161 HA PHE 161 -5.390 2.234 2.234 602 1HB PHE 161 2HB PHE 161 -8.113 1.691 1.691 603 2HB PHE 161 1HB PHE 161 -7.190 0.877 0.877 604 HD1 PHE 161 2HD PHE 161 -7.593 1.353 1.353 605 HD2 PHE 161 1HD PHE 161 -5.685 -0.960 -0.960 606 HE1 PHE 161 2HE PHE 161 -6.152 0.332 0.332 607 HE2 PHE 161 1HE PHE 161 -4.085 -1.786 -1.786 608 HZ PHE 161 HZ PHE 161 -4.325 -1.069 -1.069 609 HA PRO 162 HA PRO 162 -5.008 3.791 3.791 610 1HB PRO 162 2HB PRO 162 -2.960 5.537 5.537 611 2HB PRO 162 1HB PRO 162 -4.511 5.662 5.662 612 1HG PRO 162 2HG PRO 162 -1.870 4.703 4.703 613 2HG PRO 162 1HG PRO 162 -3.318 5.343 5.343 614 1HD PRO 162 2HD PRO 162 -2.558 2.570 2.570 615 2HD PRO 162 1HD PRO 162 -3.709 3.011 3.011 616 H THR 163 H THR 163 -1.724 4.162 4.162 617 HA THR 163 HA THR 163 -1.456 2.417 2.417 618 HB THR 163 HB THR 163 -3.060 4.832 4.832 619 HG1 THR 163 1HG THR 163 -2.528 2.948 2.948 620 1HG2 THR 163 3HG2 THR 163 -0.826 4.598 4.598 621 2HG2 THR 163 2HG2 THR 163 -2.234 5.738 5.738 622 3HG2 THR 163 1HG2 THR 163 -1.130 5.910 5.910 623 H LYS 164 H LYS 164 -0.386 5.234 5.234 624 HA LYS 164 HA LYS 164 1.549 5.743 5.743 625 1HB LYS 164 2HB LYS 164 0.247 7.490 7.490 626 2HB LYS 164 1HB LYS 164 1.322 7.062 7.062 627 1HG LYS 164 2HG LYS 164 3.201 7.573 7.573 628 2HG LYS 164 1HG LYS 164 1.868 8.642 8.642 629 1HD LYS 164 2HD LYS 164 3.152 8.559 8.559 630 2HD LYS 164 1HD LYS 164 3.603 9.716 9.716 631 1HE LYS 164 2HE LYS 164 1.327 10.741 10.741 632 2HE LYS 164 1HE LYS 164 0.827 9.548 9.548 633 1HZ LYS 164 2HZ LYS 164 2.595 10.381 10.381 634 2HZ LYS 164 1HZ LYS 164 3.047 11.512 11.512 635 3HZ LYS 164 3HZ LYS 164 1.521 11.620 11.620 636 H ILE 165 H ILE 165 3.165 4.167 4.167 637 HA ILE 165 HA ILE 165 4.686 3.661 3.661 638 HB ILE 165 HB ILE 165 5.460 3.088 3.088 639 1HG1 ILE 165 2HG1 ILE 165 3.476 1.664 1.664 640 2HG1 ILE 165 1HG1 ILE 165 3.218 2.172 2.172 641 1HG2 ILE 165 2HG2 ILE 165 7.209 2.820 2.820 642 2HG2 ILE 165 1HG2 ILE 165 6.145 1.675 1.675 643 3HG2 ILE 165 3HG2 ILE 165 6.799 1.253 1.253 644 1HD1 ILE 165 1HD1 ILE 165 5.037 -0.184 -0.184 645 2HD1 ILE 165 3HD1 ILE 165 3.363 -0.295 -0.295 646 3HD1 ILE 165 2HD1 ILE 165 4.662 0.347 0.347 647 H GLU 166 H GLU 166 6.277 4.628 4.628 648 HA GLU 166 HA GLU 166 7.237 7.043 7.043 649 1HB GLU 166 2HB GLU 166 7.274 6.338 6.338 650 2HB GLU 166 1HB GLU 166 8.027 7.813 7.813 651 1HG GLU 166 2HG GLU 166 5.762 8.599 8.599 652 2HG GLU 166 1HG GLU 166 5.013 7.097 7.097 653 H GLY 167 H GLY 167 8.929 6.033 6.033 654 1HA GLY 167 2HA GLY 167 11.023 5.079 5.079 655 2HA GLY 167 1HA GLY 167 11.069 4.970 4.970 656 H ARG 168 H ARG 168 11.403 3.106 3.106 657 HA ARG 168 HA ARG 168 9.910 0.903 0.903 658 1HB ARG 168 2HB ARG 168 11.707 -0.590 -0.590 659 2HB ARG 168 1HB ARG 168 12.240 0.475 0.475 660 1HG ARG 168 2HG ARG 168 13.230 2.090 2.090 661 2HG ARG 168 1HG ARG 168 12.730 1.053 1.053 662 1HD ARG 168 2HD ARG 168 14.169 -0.809 -0.809 663 2HD ARG 168 1HD ARG 168 14.632 0.213 0.213 664 HE ARG 168 HE ARG 168 15.146 1.690 1.690 665 1HH1 ARG 168 1HH2 ARG 168 16.258 -1.149 -1.149 666 2HH1 ARG 168 2HH2 ARG 168 17.905 -1.029 -1.029 667 1HH2 ARG 168 1HH1 ARG 168 17.389 1.848 1.848 668 2HH2 ARG 168 2HH1 ARG 168 18.557 0.698 0.698 669 H GLN 169 H GLN 169 8.471 2.473 2.473 670 HA GLN 169 HA GLN 169 8.031 0.701 0.701 671 1HB GLN 169 2HB GLN 169 8.927 3.548 3.548 672 2HB GLN 169 1HB GLN 169 8.042 2.757 2.757 673 1HG GLN 169 2HG GLN 169 10.101 1.103 1.103 674 2HG GLN 169 1HG GLN 169 10.943 2.378 2.378 675 1HE2 GLN 169 1HE2 GLN 169 9.722 4.709 4.709 676 2HE2 GLN 169 2HE2 GLN 169 10.208 4.872 4.872 677 H MET 170 H MET 170 5.781 0.873 0.873 678 HA MET 170 HA MET 170 4.390 3.072 3.072 679 1HB MET 170 2HB MET 170 3.732 0.928 0.928 680 2HB MET 170 1HB MET 170 3.190 0.262 0.262 681 1HG MET 170 2HG MET 170 1.315 1.717 1.717 682 2HG MET 170 1HG MET 170 2.056 2.829 2.829 683 1HE MET 170 1HE MET 170 1.379 -0.936 -0.936 684 2HE MET 170 3HE MET 170 -0.333 -0.382 -0.382 685 3HE MET 170 2HE MET 170 0.374 -1.364 -1.364 686 H ILE 171 H ILE 171 3.450 4.487 4.487 687 HA ILE 171 HA ILE 171 2.786 3.664 3.664 688 HB ILE 171 HB ILE 171 2.148 6.241 6.241 689 1HG1 ILE 171 2HG1 ILE 171 4.656 5.437 5.437 690 2HG1 ILE 171 1HG1 ILE 171 4.182 7.122 7.122 691 1HG2 ILE 171 3HG2 ILE 171 1.980 5.212 5.212 692 2HG2 ILE 171 2HG2 ILE 171 2.116 7.006 7.006 693 3HG2 ILE 171 1HG2 ILE 171 0.692 6.114 6.114 694 1HD1 ILE 171 1HD1 ILE 171 4.288 4.690 4.690 695 2HD1 ILE 171 3HD1 ILE 171 5.636 5.888 5.888 696 3HD1 ILE 171 2HD1 ILE 171 4.040 6.379 6.379 697 H MET 172 H MET 172 0.873 2.904 2.904 698 HA MET 172 HA MET 172 -1.583 4.007 4.007 699 1HB MET 172 2HB MET 172 -2.176 1.654 1.654 700 2HB MET 172 1HB MET 172 -1.334 1.395 1.395 701 1HG MET 172 2HG MET 172 -3.631 3.372 3.372 702 2HG MET 172 1HG MET 172 -4.087 1.712 1.712 703 1HE MET 172 2HE MET 172 -2.722 -0.291 -0.291 704 2HE MET 172 1HE MET 172 -3.127 -0.197 -0.197 705 3HE MET 172 3HE MET 172 -4.443 -0.074 -0.074 706 H VAL 173 H VAL 173 -2.497 5.507 5.507 707 HA VAL 173 HA VAL 173 -0.885 5.976 5.976 708 HB VAL 173 HB VAL 173 -3.263 7.548 7.548 709 1HG1 VAL 173 2HG1 VAL 173 -0.640 7.921 7.921 710 2HG1 VAL 173 1HG1 VAL 173 -1.826 9.278 9.278 711 3HG1 VAL 173 3HG1 VAL 173 -2.256 7.813 7.813 712 1HG2 VAL 173 3HG2 VAL 173 -0.396 7.814 7.814 713 2HG2 VAL 173 2HG2 VAL 173 -1.928 7.551 7.551 714 3HG2 VAL 173 1HG2 VAL 173 -1.645 9.110 9.110 715 H LEU 174 H LEU 174 -2.008 5.524 5.524 716 HA LEU 174 HA LEU 174 -4.845 4.434 4.434 717 1HB LEU 174 2HB LEU 174 -3.897 2.519 2.519 718 2HB LEU 174 1HB LEU 174 -2.366 3.164 3.164 719 HG LEU 174 HG LEU 174 -3.651 3.740 3.740 720 1HD1 LEU 174 2HD1 LEU 174 -5.703 2.887 2.887 721 2HD1 LEU 174 1HD1 LEU 174 -5.680 1.704 1.704 722 3HD1 LEU 174 3HD1 LEU 174 -5.941 3.483 3.483 723 1HD2 LEU 174 3HD2 LEU 174 -3.414 0.818 0.818 724 2HD2 LEU 174 2HD2 LEU 174 -2.167 1.859 1.859 725 3HD2 LEU 174 1HD2 LEU 174 -3.745 1.436 1.436 726 H ALA 175 H ALA 175 -6.087 5.484 5.484 727 HA ALA 175 HA ALA 175 -4.759 7.462 7.462 728 1HB ALA 175 2HB ALA 175 -6.087 8.304 8.304 729 2HB ALA 175 1HB ALA 175 -7.467 7.294 7.294 730 3HB ALA 175 3HB ALA 175 -6.980 8.810 8.810 731 HA PRO 176 HA PRO 176 -7.744 6.070 6.070 732 1HB PRO 176 2HB PRO 176 -8.894 8.890 8.890 733 2HB PRO 176 1HB PRO 176 -8.540 7.871 7.871 734 1HG PRO 176 2HG PRO 176 -6.809 9.868 9.868 735 2HG PRO 176 1HG PRO 176 -6.168 8.252 8.252 736 1HD PRO 176 2HD PRO 176 -6.414 9.356 9.356 737 2HD PRO 176 1HD PRO 176 -5.154 8.274 8.274 738 H LYS 177 H LYS 177 -9.708 4.862 4.862 739 HA LYS 177 HA LYS 177 -11.465 5.840 5.840 740 1HB LYS 177 2HB LYS 177 -11.314 3.376 3.376 741 2HB LYS 177 1HB LYS 177 -12.038 3.871 3.871 742 1HG LYS 177 2HG LYS 177 -14.140 4.564 4.564 743 2HG LYS 177 1HG LYS 177 -13.379 4.305 4.305 744 1HD LYS 177 2HD LYS 177 -14.977 2.540 2.540 745 2HD LYS 177 1HD LYS 177 -13.326 1.853 1.853 746 1HE LYS 177 2HE LYS 177 -13.078 1.587 1.587 747 2HE LYS 177 1HE LYS 177 -14.558 2.592 2.592 748 1HZ LYS 177 1HZ LYS 177 -15.873 0.940 0.940 749 2HZ LYS 177 3HZ LYS 177 -14.496 -0.006 -0.006 750 3HZ LYS 177 2HZ LYS 177 -15.013 0.253 0.253 751 H LYS 178 H LYS 178 -13.360 6.907 6.907 752 HA LYS 178 HA LYS 178 -13.472 8.767 8.767 753 1HB LYS 178 2HB LYS 178 -15.423 7.911 7.911 754 2HB LYS 178 1HB LYS 178 -15.734 9.313 9.313 755 1HG LYS 178 2HG LYS 178 -13.668 10.426 10.426 756 2HG LYS 178 1HG LYS 178 -13.343 9.022 9.022 757 1HD LYS 178 2HD LYS 178 -15.522 9.403 9.403 758 2HD LYS 178 1HD LYS 178 -15.826 10.844 10.844 759 1HE LYS 178 2HE LYS 178 -13.443 10.509 10.509 760 2HE LYS 178 1HE LYS 178 -14.935 11.491 11.491 761 1HZ LYS 178 3HZ LYS 178 -14.374 12.831 12.831 762 2HZ LYS 178 2HZ LYS 178 -12.975 11.912 11.912 763 3HZ LYS 178 1HZ LYS 178 -13.114 12.828 12.828 764 H LYS 179 H LYS 179 -13.873 8.004 8.004 765 HA LYS 179 HA LYS 179 -15.859 5.969 5.969 766 1HB LYS 179 2HB LYS 179 -14.451 7.718 7.718 767 2HB LYS 179 1HB LYS 179 -15.400 6.222 6.222 768 1HG LYS 179 2HG LYS 179 -12.692 6.446 6.446 769 2HG LYS 179 1HG LYS 179 -12.996 5.791 5.791 770 1HD LYS 179 2HD LYS 179 -14.470 3.988 3.988 771 2HD LYS 179 1HD LYS 179 -13.893 4.561 4.561 772 1HE LYS 179 2HE LYS 179 -12.126 3.454 3.454 773 2HE LYS 179 1HE LYS 179 -12.539 2.614 2.614 774 1HZ LYS 179 3HZ LYS 179 -11.048 5.173 5.173 775 2HZ LYS 179 2HZ LYS 179 -10.378 3.645 3.645 776 3HZ LYS 179 1HZ LYS 179 -11.413 4.370 4.370 777 H GLN 180 H GLN 180 -17.999 6.355 6.355 778 HA GLN 180 HA GLN 180 -18.744 8.946 8.946 779 1HB GLN 180 2HB GLN 180 -18.894 9.147 9.147 780 2HB GLN 180 1HB GLN 180 -19.965 7.709 7.709 781 1HG GLN 180 2HG GLN 180 -21.294 9.793 9.793 782 2HG GLN 180 1HG GLN 180 -21.675 8.976 8.976 783 1HE2 GLN 180 1HE2 GLN 180 -19.299 11.371 11.371 784 2HE2 GLN 180 2HE2 GLN 180 -19.314 12.457 12.457 Start of MODEL 4 1 HA VAL 90 HA VAL 90 -5.151 16.817 16.817 2 HB VAL 90 HB VAL 90 -3.714 15.986 15.986 3 1HG1 VAL 90 3HG1 VAL 90 -4.877 18.796 18.796 4 2HG1 VAL 90 2HG1 VAL 90 -4.489 17.800 17.800 5 3HG1 VAL 90 1HG1 VAL 90 -5.680 17.178 17.178 6 1HG2 VAL 90 3HG2 VAL 90 -2.052 18.480 18.480 7 2HG2 VAL 90 2HG2 VAL 90 -1.557 16.731 16.731 8 3HG2 VAL 90 1HG2 VAL 90 -1.964 17.487 17.487 9 H ILE 91 H ILE 91 -4.027 14.664 14.664 10 HA ILE 91 HA ILE 91 -3.005 13.403 13.403 11 HB ILE 91 HB ILE 91 -3.334 11.840 11.840 12 1HG1 ILE 91 2HG1 ILE 91 -5.848 12.003 12.003 13 2HG1 ILE 91 1HG1 ILE 91 -5.712 13.724 13.724 14 1HG2 ILE 91 1HG2 ILE 91 -3.781 11.377 11.377 15 2HG2 ILE 91 3HG2 ILE 91 -5.384 12.166 12.166 16 3HG2 ILE 91 2HG2 ILE 91 -5.032 10.631 10.631 17 1HD1 ILE 91 3HD1 ILE 91 -3.840 12.224 12.224 18 2HD1 ILE 91 2HD1 ILE 91 -5.278 13.189 13.189 19 3HD1 ILE 91 1HD1 ILE 91 -3.862 13.990 13.990 20 H GLN 92 H GLN 92 -0.911 12.088 12.088 21 HA GLN 92 HA GLN 92 0.551 13.738 13.738 22 1HB GLN 92 2HB GLN 92 1.602 11.814 11.814 23 2HB GLN 92 1HB GLN 92 2.546 13.082 13.082 24 1HG GLN 92 2HG GLN 92 0.171 13.671 13.671 25 2HG GLN 92 1HG GLN 92 1.885 13.646 13.646 26 1HE2 GLN 92 1HE2 GLN 92 -0.509 15.233 15.233 27 2HE2 GLN 92 2HE2 GLN 92 0.304 16.755 16.755 28 H VAL 93 H VAL 93 2.356 12.641 12.641 29 HA VAL 93 HA VAL 93 1.239 10.142 10.142 30 HB VAL 93 HB VAL 93 3.552 11.807 11.807 31 1HG1 VAL 93 3HG1 VAL 93 2.353 9.027 9.027 32 2HG1 VAL 93 2HG1 VAL 93 3.311 9.948 9.948 33 3HG1 VAL 93 1HG1 VAL 93 4.130 9.360 9.360 34 1HG2 VAL 93 3HG2 VAL 93 0.982 12.353 12.353 35 2HG2 VAL 93 2HG2 VAL 93 2.017 12.008 12.008 36 3HG2 VAL 93 1HG2 VAL 93 1.011 10.687 10.687 37 H LYS 94 H LYS 94 1.727 8.391 8.391 38 HA LYS 94 HA LYS 94 4.674 8.101 8.101 39 1HB LYS 94 2HB LYS 94 2.528 6.298 6.298 40 2HB LYS 94 1HB LYS 94 4.266 6.350 6.350 41 1HG LYS 94 2HG LYS 94 2.259 8.631 8.631 42 2HG LYS 94 1HG LYS 94 2.667 7.419 7.419 43 1HD LYS 94 2HD LYS 94 5.093 8.121 8.121 44 2HD LYS 94 1HD LYS 94 4.645 9.419 9.419 45 1HE LYS 94 2HE LYS 94 4.850 10.386 10.386 46 2HE LYS 94 1HE LYS 94 3.099 10.405 10.405 47 1HZ LYS 94 2HZ LYS 94 4.439 8.375 8.375 48 2HZ LYS 94 1HZ LYS 94 3.444 9.646 9.646 49 3HZ LYS 94 3HZ LYS 94 2.796 8.401 8.401 50 H GLU 95 H GLU 95 5.135 5.573 5.573 51 HA GLU 95 HA GLU 95 3.834 4.900 4.900 52 1HB GLU 95 2HB GLU 95 5.866 6.460 6.460 53 2HB GLU 95 1HB GLU 95 6.756 5.061 5.061 54 1HG GLU 95 2HG GLU 95 6.350 3.776 3.776 55 2HG GLU 95 1HG GLU 95 5.343 5.151 5.151 56 H ILE 96 H ILE 96 4.329 2.711 2.711 57 HA ILE 96 HA ILE 96 5.865 1.010 1.010 58 HB ILE 96 HB ILE 96 3.116 0.847 0.847 59 1HG1 ILE 96 2HG1 ILE 96 3.404 -1.645 -1.645 60 2HG1 ILE 96 1HG1 ILE 96 5.122 -1.502 -1.502 61 1HG2 ILE 96 2HG2 ILE 96 2.899 0.543 0.543 62 2HG2 ILE 96 1HG2 ILE 96 3.728 -1.089 -1.089 63 3HG2 ILE 96 3HG2 ILE 96 2.230 -0.818 -0.818 64 1HD1 ILE 96 2HD1 ILE 96 3.715 0.064 0.064 65 2HD1 ILE 96 1HD1 ILE 96 4.824 -1.342 -1.342 66 3HD1 ILE 96 3HD1 ILE 96 5.462 0.214 0.214 67 H LYS 97 H LYS 97 6.676 -0.927 -0.927 68 HA LYS 97 HA LYS 97 6.180 -0.360 -0.360 69 1HB LYS 97 2HB LYS 97 8.647 -1.820 -1.820 70 2HB LYS 97 1HB LYS 97 8.048 -1.618 -1.618 71 1HG LYS 97 2HG LYS 97 8.287 0.845 0.845 72 2HG LYS 97 1HG LYS 97 8.988 0.675 0.675 73 1HD LYS 97 2HD LYS 97 10.878 -0.648 -0.648 74 2HD LYS 97 1HD LYS 97 10.156 -0.631 -0.631 75 1HE LYS 97 2HE LYS 97 11.068 1.909 1.909 76 2HE LYS 97 1HE LYS 97 12.036 1.033 1.033 77 1HZ LYS 97 1HZ LYS 97 10.251 1.415 1.415 78 2HZ LYS 97 3HZ LYS 97 9.351 2.248 2.248 79 3HZ LYS 97 2HZ LYS 97 10.837 2.875 2.875 80 H PHE 98 H PHE 98 5.869 -2.117 -2.117 81 HA PHE 98 HA PHE 98 5.701 -4.756 -4.756 82 1HB PHE 98 2HB PHE 98 3.692 -3.351 -3.351 83 2HB PHE 98 1HB PHE 98 3.768 -5.133 -5.133 84 HD1 PHE 98 2HD PHE 98 3.908 -5.963 -5.963 85 HD2 PHE 98 1HD PHE 98 2.118 -2.511 -2.511 86 HE1 PHE 98 2HE PHE 98 2.588 -5.796 -5.796 87 HE2 PHE 98 1HE PHE 98 0.640 -2.356 -2.356 88 HZ PHE 98 HZ PHE 98 0.769 -4.179 -4.179 89 H ARG 99 H ARG 99 7.056 -6.076 -6.076 90 HA ARG 99 HA ARG 99 8.051 -4.921 -4.921 91 1HB ARG 99 2HB ARG 99 9.203 -6.835 -6.835 92 2HB ARG 99 1HB ARG 99 9.953 -6.423 -6.423 93 1HG ARG 99 2HG ARG 99 10.974 -4.637 -4.637 94 2HG ARG 99 1HG ARG 99 9.395 -3.920 -3.920 95 1HD ARG 99 2HD ARG 99 11.051 -5.842 -5.842 96 2HD ARG 99 1HD ARG 99 10.899 -4.039 -4.039 97 HE ARG 99 HE ARG 99 8.275 -5.262 -5.262 98 1HH1 ARG 99 1HH2 ARG 99 11.170 -4.911 -4.911 99 2HH1 ARG 99 2HH2 ARG 99 10.324 -5.174 -5.174 100 1HH2 ARG 99 1HH1 ARG 99 7.135 -5.618 -5.618 101 2HH2 ARG 99 2HH1 ARG 99 7.996 -5.584 -5.584 102 HA PRO 100 HA PRO 100 6.445 -8.803 -8.803 103 1HB PRO 100 2HB PRO 100 8.598 -9.652 -9.652 104 2HB PRO 100 1HB PRO 100 7.244 -8.592 -8.592 105 1HG PRO 100 2HG PRO 100 10.054 -7.863 -7.863 106 2HG PRO 100 1HG PRO 100 8.991 -7.033 -7.033 107 1HD PRO 100 2HD PRO 100 9.492 -6.124 -6.124 108 2HD PRO 100 1HD PRO 100 7.930 -5.741 -5.741 109 H GLY 101 H GLY 101 6.696 -10.974 -10.974 110 1HA GLY 101 2HA GLY 101 7.759 -12.733 -12.733 111 2HA GLY 101 1HA GLY 101 9.231 -11.689 -11.689 112 H THR 102 H THR 102 6.636 -10.085 -10.085 113 HA THR 102 HA THR 102 6.639 -10.871 -10.871 114 HB THR 102 HB THR 102 5.550 -8.163 -8.163 115 HG1 THR 102 1HG THR 102 8.158 -8.834 -8.834 116 1HG2 THR 102 1HG2 THR 102 5.222 -9.750 -9.750 117 2HG2 THR 102 3HG2 THR 102 6.838 -9.110 -9.110 118 3HG2 THR 102 2HG2 THR 102 5.469 -7.949 -7.949 119 H ASP 103 H ASP 103 5.301 -12.455 -12.455 120 HA ASP 103 HA ASP 103 2.612 -11.698 -11.698 121 1HB ASP 103 2HB ASP 103 3.997 -13.194 -13.194 122 2HB ASP 103 1HB ASP 103 3.717 -14.410 -14.410 123 H GLU 104 H GLU 104 1.296 -13.873 -13.873 124 HA GLU 104 HA GLU 104 0.241 -12.797 -12.797 125 1HB GLU 104 2HB GLU 104 0.661 -15.802 -15.802 126 2HB GLU 104 1HB GLU 104 -0.540 -14.962 -14.962 127 1HG GLU 104 2HG GLU 104 -1.638 -13.986 -13.986 128 2HG GLU 104 1HG GLU 104 -0.482 -14.887 -14.887 129 H GLY 105 H GLY 105 2.673 -15.164 -15.164 130 1HA GLY 105 2HA GLY 105 3.303 -15.518 -15.518 131 2HA GLY 105 1HA GLY 105 4.340 -14.875 -14.875 132 H ASP 106 H ASP 106 4.914 -13.065 -13.065 133 HA ASP 106 HA ASP 106 6.071 -11.651 -11.651 134 1HB ASP 106 2HB ASP 106 5.854 -11.557 -11.557 135 2HB ASP 106 1HB ASP 106 6.983 -10.602 -10.602 136 H TYR 107 H TYR 107 3.561 -11.514 -11.514 137 HA TYR 107 HA TYR 107 3.538 -8.673 -8.673 138 1HB TYR 107 2HB TYR 107 2.970 -10.371 -10.371 139 2HB TYR 107 1HB TYR 107 1.581 -10.945 -10.945 140 HD1 TYR 107 2HD TYR 107 1.667 -7.378 -7.378 141 HD2 TYR 107 1HD TYR 107 0.735 -10.952 -10.952 142 HE1 TYR 107 2HE TYR 107 -0.453 -6.387 -6.387 143 HE2 TYR 107 1HE TYR 107 -0.961 -9.730 -9.730 144 HH TYR 107 HH TYR 107 -2.032 -6.552 -6.552 145 H GLN 108 H GLN 108 0.597 -10.540 -10.540 146 HA GLN 108 HA GLN 108 -0.468 -8.510 -8.510 147 1HB GLN 108 2HB GLN 108 -1.421 -11.012 -11.012 148 2HB GLN 108 1HB GLN 108 -2.235 -9.653 -9.653 149 1HG GLN 108 2HG GLN 108 -0.625 -11.618 -11.618 150 2HG GLN 108 1HG GLN 108 -2.127 -12.075 -12.075 151 1HE2 GLN 108 1HE2 GLN 108 -1.006 -8.788 -8.788 152 2HE2 GLN 108 2HE2 GLN 108 -2.241 -8.601 -8.601 153 H VAL 109 H VAL 109 2.019 -10.153 -10.153 154 HA VAL 109 HA VAL 109 1.588 -9.452 -9.452 155 HB VAL 109 HB VAL 109 4.160 -9.760 -9.760 156 1HG1 VAL 109 2HG1 VAL 109 3.747 -9.265 -9.265 157 2HG1 VAL 109 1HG1 VAL 109 5.239 -9.983 -9.983 158 3HG1 VAL 109 3HG1 VAL 109 4.784 -8.311 -8.311 159 1HG2 VAL 109 1HG2 VAL 109 2.654 -11.800 -11.800 160 2HG2 VAL 109 3HG2 VAL 109 4.279 -11.944 -11.944 161 3HG2 VAL 109 2HG2 VAL 109 2.827 -11.572 -11.572 162 H LYS 110 H LYS 110 3.080 -7.750 -7.750 163 HA LYS 110 HA LYS 110 3.223 -5.301 -5.301 164 1HB LYS 110 2HB LYS 110 4.167 -6.135 -6.135 165 2HB LYS 110 1HB LYS 110 4.311 -4.480 -4.480 166 1HG LYS 110 2HG LYS 110 5.696 -7.026 -7.026 167 2HG LYS 110 1HG LYS 110 6.328 -5.358 -5.358 168 1HD LYS 110 2HD LYS 110 5.605 -4.468 -4.468 169 2HD LYS 110 1HD LYS 110 4.903 -6.061 -6.061 170 1HE LYS 110 2HE LYS 110 7.103 -5.742 -5.742 171 2HE LYS 110 1HE LYS 110 7.211 -7.092 -7.092 172 1HZ LYS 110 1HZ LYS 110 8.063 -4.276 -4.276 173 2HZ LYS 110 3HZ LYS 110 9.080 -5.596 -5.596 174 3HZ LYS 110 2HZ LYS 110 8.185 -5.554 -5.554 175 H LEU 111 H LEU 111 0.823 -6.775 -6.775 176 HA LEU 111 HA LEU 111 -0.375 -4.319 -4.319 177 1HB LEU 111 2HB LEU 111 -0.836 -6.592 -6.592 178 2HB LEU 111 1HB LEU 111 -1.702 -7.031 -7.031 179 HG LEU 111 HG LEU 111 -2.452 -4.536 -4.536 180 1HD1 LEU 111 1HD1 LEU 111 -2.181 -6.449 -6.449 181 2HD1 LEU 111 3HD1 LEU 111 -3.364 -7.405 -7.405 182 3HD1 LEU 111 2HD1 LEU 111 -3.888 -5.886 -5.886 183 1HD2 LEU 111 3HD2 LEU 111 -4.003 -6.608 -6.608 184 2HD2 LEU 111 2HD2 LEU 111 -3.674 -4.887 -4.887 185 3HD2 LEU 111 1HD2 LEU 111 -4.803 -5.284 -5.284 186 H ARG 112 H ARG 112 -0.031 -6.578 -6.578 187 HA ARG 112 HA ARG 112 -1.765 -5.206 -5.206 188 1HB ARG 112 2HB ARG 112 -0.743 -7.499 -7.499 189 2HB ARG 112 1HB ARG 112 0.686 -6.609 -6.609 190 1HG ARG 112 2HG ARG 112 -0.764 -5.415 -5.415 191 2HG ARG 112 1HG ARG 112 -2.201 -6.291 -6.291 192 1HD ARG 112 2HD ARG 112 -1.220 -8.467 -8.467 193 2HD ARG 112 1HD ARG 112 0.269 -7.590 -7.590 194 HE ARG 112 HE ARG 112 -2.072 -6.343 -6.343 195 1HH1 ARG 112 1HH1 ARG 112 -0.142 -9.342 -9.342 196 2HH1 ARG 112 2HH1 ARG 112 -0.496 -9.658 -9.658 197 1HH2 ARG 112 1HH2 ARG 112 -2.544 -6.783 -6.783 198 2HH2 ARG 112 2HH2 ARG 112 -1.880 -8.184 -8.184 199 H SER 113 H SER 113 1.903 -4.700 -4.700 200 HA SER 113 HA SER 113 2.044 -2.715 -2.715 201 1HB SER 113 2HB SER 113 3.655 -3.002 -3.002 202 2HB SER 113 1HB SER 113 3.906 -1.774 -1.774 203 HG SER 113 HG SER 113 3.855 -4.586 -4.586 204 H LEU 114 H LEU 114 0.851 -2.580 -2.580 205 HA LEU 114 HA LEU 114 0.625 0.157 0.157 206 1HB LEU 114 2HB LEU 114 -0.680 -2.212 -2.212 207 2HB LEU 114 1HB LEU 114 -1.586 -0.668 -0.668 208 HG LEU 114 HG LEU 114 1.294 -1.048 -1.048 209 1HD1 LEU 114 3HD1 LEU 114 -0.480 -2.351 -2.351 210 2HD1 LEU 114 2HD1 LEU 114 -1.395 -0.829 -0.829 211 3HD1 LEU 114 1HD1 LEU 114 0.227 -1.094 -1.094 212 1HD2 LEU 114 3HD2 LEU 114 -0.671 1.335 1.335 213 2HD2 LEU 114 2HD2 LEU 114 0.962 1.301 1.301 214 3HD2 LEU 114 1HD2 LEU 114 0.802 1.251 1.251 215 H ILE 115 H ILE 115 -1.723 -2.204 -2.204 216 HA ILE 115 HA ILE 115 -3.811 -0.423 -0.423 217 HB ILE 115 HB ILE 115 -3.292 -2.059 -2.059 218 1HG1 ILE 115 2HG1 ILE 115 -2.860 -3.687 -3.687 219 2HG1 ILE 115 1HG1 ILE 115 -4.367 -4.028 -4.028 220 1HG2 ILE 115 2HG2 ILE 115 -5.620 -1.025 -1.025 221 2HG2 ILE 115 1HG2 ILE 115 -5.846 -2.182 -2.182 222 3HG2 ILE 115 3HG2 ILE 115 -5.113 -0.563 -0.563 223 1HD1 ILE 115 3HD1 ILE 115 -5.680 -2.994 -2.994 224 2HD1 ILE 115 2HD1 ILE 115 -4.089 -2.803 -2.803 225 3HD1 ILE 115 1HD1 ILE 115 -4.739 -4.451 -4.451 226 H ARG 116 H ARG 116 -1.180 -1.079 -1.079 227 HA ARG 116 HA ARG 116 -1.699 0.602 0.602 228 1HB ARG 116 2HB ARG 116 0.294 -1.146 -1.146 229 2HB ARG 116 1HB ARG 116 1.199 0.323 0.323 230 1HG ARG 116 2HG ARG 116 1.603 -0.237 -0.237 231 2HG ARG 116 1HG ARG 116 0.744 1.336 1.336 232 1HD ARG 116 2HD ARG 116 -0.090 -0.119 -0.119 233 2HD ARG 116 1HD ARG 116 -1.398 0.246 0.246 234 HE ARG 116 HE ARG 116 0.177 -2.354 -2.354 235 1HH1 ARG 116 1HH1 ARG 116 -2.853 -0.589 -0.589 236 2HH1 ARG 116 2HH1 ARG 116 -3.750 -2.029 -2.029 237 1HH2 ARG 116 1HH2 ARG 116 -1.060 -4.260 -4.260 238 2HH2 ARG 116 2HH2 ARG 116 -2.723 -4.132 -4.132 239 H PHE 117 H PHE 117 0.168 1.413 1.413 240 HA PHE 117 HA PHE 117 0.694 4.158 4.158 241 1HB PHE 117 2HB PHE 117 0.276 2.627 2.627 242 2HB PHE 117 1HB PHE 117 0.534 4.445 4.445 243 HD1 PHE 117 2HD PHE 117 2.274 5.325 5.325 244 HD2 PHE 117 1HD PHE 117 1.961 1.225 1.225 245 HE1 PHE 117 2HE PHE 117 4.693 5.071 5.071 246 HE2 PHE 117 1HE PHE 117 4.307 0.846 0.846 247 HZ PHE 117 HZ PHE 117 5.683 2.809 2.809 248 H LEU 118 H LEU 118 -2.113 2.697 2.697 249 HA LEU 118 HA LEU 118 -3.436 4.977 4.977 250 1HB LEU 118 2HB LEU 118 -3.999 2.301 2.301 251 2HB LEU 118 1HB LEU 118 -5.318 3.091 3.091 252 HG LEU 118 HG LEU 118 -4.883 5.051 5.051 253 1HD1 LEU 118 1HD1 LEU 118 -4.060 2.347 2.347 254 2HD1 LEU 118 3HD1 LEU 118 -4.867 3.619 3.619 255 3HD1 LEU 118 2HD1 LEU 118 -3.308 4.012 4.012 256 1HD2 LEU 118 2HD2 LEU 118 -6.731 2.714 2.714 257 2HD2 LEU 118 1HD2 LEU 118 -6.869 4.442 4.442 258 3HD2 LEU 118 3HD2 LEU 118 -6.850 4.086 4.086 259 H GLU 119 H GLU 119 -3.353 3.013 3.013 260 HA GLU 119 HA GLU 119 -5.624 4.112 4.112 261 1HB GLU 119 2HB GLU 119 -3.461 2.105 2.105 262 2HB GLU 119 1HB GLU 119 -4.583 2.736 2.736 263 1HG GLU 119 2HG GLU 119 -5.694 1.425 1.425 264 2HG GLU 119 1HG GLU 119 -5.137 0.456 0.456 265 H GLU 120 H GLU 120 -2.176 4.811 4.811 266 HA GLU 120 HA GLU 120 -2.252 6.281 6.281 267 1HB GLU 120 2HB GLU 120 -0.409 6.702 6.702 268 2HB GLU 120 1HB GLU 120 -0.206 7.457 7.457 269 1HG GLU 120 2HG GLU 120 0.270 4.538 4.538 270 2HG GLU 120 1HG GLU 120 1.421 5.719 5.719 271 H GLY 121 H GLY 121 -3.567 6.662 6.662 272 1HA GLY 121 2HA GLY 121 -4.924 8.211 8.211 273 2HA GLY 121 1HA GLY 121 -4.384 9.330 9.330 274 H ASP 122 H ASP 122 -3.102 7.490 7.490 275 HA ASP 122 HA ASP 122 -2.079 9.990 9.990 276 1HB ASP 122 2HB ASP 122 -0.411 7.376 7.376 277 2HB ASP 122 1HB ASP 122 0.115 8.882 8.882 278 H LYS 123 H LYS 123 -1.045 9.183 9.183 279 HA LYS 123 HA LYS 123 -3.235 7.744 7.744 280 1HB LYS 123 2HB LYS 123 -3.258 10.282 10.282 281 2HB LYS 123 1HB LYS 123 -1.614 10.260 10.260 282 1HG LYS 123 2HG LYS 123 -4.151 9.007 9.007 283 2HG LYS 123 1HG LYS 123 -3.704 10.693 10.693 284 1HD LYS 123 2HD LYS 123 -1.663 8.466 8.466 285 2HD LYS 123 1HD LYS 123 -2.978 8.855 8.855 286 1HE LYS 123 2HE LYS 123 -0.972 10.759 10.759 287 2HE LYS 123 1HE LYS 123 -0.781 9.993 9.993 288 1HZ LYS 123 3HZ LYS 123 -2.959 11.851 11.851 289 2HZ LYS 123 2HZ LYS 123 -1.622 12.251 12.251 290 3HZ LYS 123 1HZ LYS 123 -2.771 11.130 11.130 291 H ALA 124 H ALA 124 -2.359 5.857 5.857 292 HA ALA 124 HA ALA 124 0.514 5.799 5.799 293 1HB ALA 124 3HB ALA 124 -1.563 3.583 3.583 294 2HB ALA 124 2HB ALA 124 0.250 3.460 3.460 295 3HB ALA 124 1HB ALA 124 -0.922 4.214 4.214 296 H LYS 125 H LYS 125 1.735 5.829 5.829 297 HA LYS 125 HA LYS 125 0.267 5.403 5.403 298 1HB LYS 125 2HB LYS 125 1.369 7.633 7.633 299 2HB LYS 125 1HB LYS 125 2.933 6.834 6.834 300 1HG LYS 125 2HG LYS 125 3.167 6.070 6.070 301 2HG LYS 125 1HG LYS 125 1.543 6.727 6.727 302 1HD LYS 125 2HD LYS 125 3.817 8.458 8.458 303 2HD LYS 125 1HD LYS 125 3.671 8.116 8.116 304 1HE LYS 125 2HE LYS 125 1.442 9.143 9.143 305 2HE LYS 125 1HE LYS 125 1.489 9.509 9.509 306 1HZ LYS 125 1HZ LYS 125 3.399 10.513 10.513 307 2HZ LYS 125 3HZ LYS 125 2.128 11.388 11.388 308 3HZ LYS 125 2HZ LYS 125 3.430 10.859 10.859 309 H ILE 126 H ILE 126 0.536 3.604 3.604 310 HA ILE 126 HA ILE 126 2.601 1.826 1.826 311 HB ILE 126 HB ILE 126 0.809 1.643 1.643 312 1HG1 ILE 126 2HG1 ILE 126 -0.850 2.137 2.137 313 2HG1 ILE 126 1HG1 ILE 126 -0.797 0.354 0.354 314 1HG2 ILE 126 2HG2 ILE 126 2.266 -0.264 -0.264 315 2HG2 ILE 126 1HG2 ILE 126 1.009 -0.830 -0.830 316 3HG2 ILE 126 3HG2 ILE 126 2.539 -0.097 -0.097 317 1HD1 ILE 126 2HD1 ILE 126 0.762 0.406 0.406 318 2HD1 ILE 126 1HD1 ILE 126 0.170 2.081 2.081 319 3HD1 ILE 126 3HD1 ILE 126 -1.015 0.722 0.722 320 H THR 127 H THR 127 4.531 1.480 1.480 321 HA THR 127 HA THR 127 4.728 2.734 2.734 322 HB THR 127 HB THR 127 6.946 2.218 2.218 323 HG1 THR 127 1HG THR 127 6.961 4.423 4.423 324 1HG2 THR 127 1HG2 THR 127 6.737 3.651 3.651 325 2HG2 THR 127 3HG2 THR 127 8.128 3.895 3.895 326 3HG2 THR 127 2HG2 THR 127 7.814 2.266 2.266 327 H LEU 128 H LEU 128 4.779 1.190 1.190 328 HA LEU 128 HA LEU 128 5.659 -1.507 -1.507 329 1HB LEU 128 2HB LEU 128 4.362 -0.234 -0.234 330 2HB LEU 128 1HB LEU 128 5.927 -0.822 -0.822 331 HG LEU 128 HG LEU 128 4.098 -2.399 -2.399 332 1HD1 LEU 128 3HD1 LEU 128 6.193 -3.583 -3.583 333 2HD1 LEU 128 2HD1 LEU 128 5.699 -3.665 -3.665 334 3HD1 LEU 128 1HD1 LEU 128 4.731 -4.520 -4.520 335 1HD2 LEU 128 3HD2 LEU 128 2.625 -1.406 -1.406 336 2HD2 LEU 128 2HD2 LEU 128 2.597 -3.217 -3.217 337 3HD2 LEU 128 1HD2 LEU 128 3.438 -2.166 -2.166 338 H ARG 129 H ARG 129 7.717 -2.370 -2.370 339 HA ARG 129 HA ARG 129 9.470 -0.476 -0.476 340 1HB ARG 129 2HB ARG 129 10.024 -0.221 -0.221 341 2HB ARG 129 1HB ARG 129 10.108 -2.012 -2.012 342 1HG ARG 129 2HG ARG 129 12.082 -2.083 -2.083 343 2HG ARG 129 1HG ARG 129 11.737 -0.431 -0.431 344 1HD ARG 129 2HD ARG 129 12.412 0.522 0.522 345 2HD ARG 129 1HD ARG 129 12.719 -1.165 -1.165 346 HE ARG 129 HE ARG 129 14.163 -0.777 -0.777 347 1HH1 ARG 129 1HH1 ARG 129 14.088 0.310 0.310 348 2HH1 ARG 129 2HH1 ARG 129 15.791 0.612 0.612 349 1HH2 ARG 129 1HH2 ARG 129 16.468 -0.365 -0.365 350 2HH2 ARG 129 2HH2 ARG 129 17.166 0.221 0.221 351 H PHE 130 H PHE 130 9.348 -1.511 -1.511 352 HA PHE 130 HA PHE 130 8.689 -4.274 -4.274 353 1HB PHE 130 2HB PHE 130 9.587 -2.017 -2.017 354 2HB PHE 130 1HB PHE 130 9.100 -3.725 -3.725 355 HD1 PHE 130 2HD PHE 130 7.009 -4.664 -4.664 356 HD2 PHE 130 1HD PHE 130 7.980 -0.508 -0.508 357 HE1 PHE 130 2HE PHE 130 4.640 -4.056 -4.056 358 HE2 PHE 130 1HE PHE 130 5.591 0.044 0.044 359 HZ PHE 130 HZ PHE 130 3.912 -1.760 -1.760 360 H ARG 131 H ARG 131 10.066 -5.925 -5.925 361 HA ARG 131 HA ARG 131 12.910 -5.307 -5.307 362 1HB ARG 131 2HB ARG 131 12.095 -6.795 -6.795 363 2HB ARG 131 1HB ARG 131 11.816 -8.048 -8.048 364 1HG ARG 131 2HG ARG 131 14.347 -7.812 -7.812 365 2HG ARG 131 1HG ARG 131 14.464 -6.679 -6.679 366 1HD ARG 131 2HD ARG 131 15.213 -8.889 -8.889 367 2HD ARG 131 1HD ARG 131 13.614 -8.592 -8.592 368 HE ARG 131 HE ARG 131 14.144 -10.347 -10.347 369 1HH1 ARG 131 1HH1 ARG 131 12.034 -9.438 -9.438 370 2HH1 ARG 131 2HH1 ARG 131 10.999 -10.816 -10.816 371 1HH2 ARG 131 1HH2 ARG 131 12.744 -12.185 -12.185 372 2HH2 ARG 131 2HH2 ARG 131 11.408 -12.393 -12.393 373 H GLY 132 H GLY 132 10.756 -5.189 -5.189 374 1HA GLY 132 2HA GLY 132 11.981 -6.965 -6.965 375 2HA GLY 132 1HA GLY 132 10.175 -6.702 -6.702 376 H ARG 133 H ARG 133 11.363 -4.212 -4.212 377 HA ARG 133 HA ARG 133 10.596 -2.209 -2.209 378 1HB ARG 133 2HB ARG 133 12.589 -0.847 -0.847 379 2HB ARG 133 1HB ARG 133 11.472 -1.656 -1.656 380 1HG ARG 133 2HG ARG 133 13.083 -3.509 -3.509 381 2HG ARG 133 1HG ARG 133 14.246 -2.741 -2.741 382 1HD ARG 133 2HD ARG 133 14.527 -0.809 -0.809 383 2HD ARG 133 1HD ARG 133 13.139 -1.361 -1.361 384 HE ARG 133 HE ARG 133 15.117 -3.456 -3.456 385 1HH1 ARG 133 1HH1 ARG 133 14.505 -0.190 -0.190 386 2HH1 ARG 133 2HH1 ARG 133 15.440 -0.421 -0.421 387 1HH2 ARG 133 1HH2 ARG 133 16.400 -3.759 -3.759 388 2HH2 ARG 133 2HH2 ARG 133 16.537 -2.474 -2.474 389 H GLU 134 H GLU 134 10.552 -1.961 -1.961 390 HA GLU 134 HA GLU 134 12.924 -0.431 -0.431 391 1HB GLU 134 2HB GLU 134 12.492 -2.208 -2.208 392 2HB GLU 134 1HB GLU 134 10.860 -1.528 -1.528 393 1HG GLU 134 2HG GLU 134 11.978 0.690 0.690 394 2HG GLU 134 1HG GLU 134 13.580 -0.117 -0.117 395 H MET 135 H MET 135 10.043 0.192 0.192 396 HA MET 135 HA MET 135 8.748 1.591 1.591 397 1HB MET 135 2HB MET 135 7.857 1.119 1.119 398 2HB MET 135 1HB MET 135 6.893 1.971 1.971 399 1HG MET 135 2HG MET 135 8.722 3.694 3.694 400 2HG MET 135 1HG MET 135 9.653 2.831 2.831 401 1HE MET 135 1HE MET 135 6.763 5.156 5.156 402 2HE MET 135 3HE MET 135 5.759 5.327 5.327 403 3HE MET 135 2HE MET 135 5.750 3.782 3.782 404 H ALA 136 H ALA 136 7.763 0.129 0.129 405 HA ALA 136 HA ALA 136 8.198 -2.499 -2.499 406 1HB ALA 136 2HB ALA 136 8.647 -1.328 -1.328 407 2HB ALA 136 1HB ALA 136 6.885 -1.413 -1.413 408 3HB ALA 136 3HB ALA 136 7.865 -2.931 -2.931 409 H HIS 137 H HIS 137 6.346 -3.537 -3.537 410 HA HIS 137 HA HIS 137 4.465 -4.601 -4.601 411 1HB HIS 137 2HB HIS 137 5.591 -5.514 -5.514 412 2HB HIS 137 1HB HIS 137 4.346 -6.444 -6.444 413 HD1 HIS 137 1HD HIS 137 5.492 -7.613 -7.613 414 HD2 HIS 137 2HD HIS 137 7.939 -4.879 -4.879 415 HE1 HIS 137 1HE HIS 137 7.821 -7.766 -7.766 416 H GLN 138 H GLN 138 2.275 -4.748 -4.748 417 HA GLN 138 HA GLN 138 1.137 -3.573 -3.573 418 1HB GLN 138 2HB GLN 138 -0.128 -3.961 -3.961 419 2HB GLN 138 1HB GLN 138 -1.035 -3.471 -3.471 420 1HG GLN 138 2HG GLN 138 0.294 -1.380 -1.380 421 2HG GLN 138 1HG GLN 138 1.290 -1.857 -1.857 422 1HE2 GLN 138 1HE2 GLN 138 -2.249 -1.735 -1.735 423 2HE2 GLN 138 2HE2 GLN 138 -2.783 -0.986 -0.986 424 H GLN 139 H GLN 139 2.328 -6.224 -6.224 425 HA GLN 139 HA GLN 139 0.199 -8.054 -8.054 426 1HB GLN 139 2HB GLN 139 3.170 -8.825 -8.825 427 2HB GLN 139 1HB GLN 139 1.732 -9.851 -9.851 428 1HG GLN 139 2HG GLN 139 2.787 -7.591 -7.591 429 2HG GLN 139 1HG GLN 139 2.946 -9.360 -9.360 430 1HE2 GLN 139 1HE2 GLN 139 0.681 -10.579 -10.579 431 2HE2 GLN 139 2HE2 GLN 139 -0.620 -9.876 -9.876 432 H ILE 140 H ILE 140 3.539 -7.142 -7.142 433 HA ILE 140 HA ILE 140 3.785 -8.101 -8.101 434 HB ILE 140 HB ILE 140 5.061 -5.955 -5.955 435 1HG1 ILE 140 2HG1 ILE 140 5.736 -8.900 -8.900 436 2HG1 ILE 140 1HG1 ILE 140 5.173 -8.281 -8.281 437 1HG2 ILE 140 3HG2 ILE 140 5.593 -7.289 -7.289 438 2HG2 ILE 140 2HG2 ILE 140 6.886 -6.435 -6.435 439 3HG2 ILE 140 1HG2 ILE 140 5.478 -5.521 -5.521 440 1HD1 ILE 140 2HD1 ILE 140 7.236 -6.795 -6.795 441 2HD1 ILE 140 1HD1 ILE 140 7.871 -7.679 -7.679 442 3HD1 ILE 140 3HD1 ILE 140 7.547 -8.568 -8.568 443 H GLY 141 H GLY 141 2.679 -4.886 -4.886 444 1HA GLY 141 2HA GLY 141 2.534 -4.002 -4.002 445 2HA GLY 141 1HA GLY 141 1.907 -3.193 -3.193 446 H MET 142 H MET 142 -0.066 -4.880 -4.880 447 HA MET 142 HA MET 142 -1.918 -3.888 -3.888 448 1HB MET 142 2HB MET 142 -2.352 -4.900 -4.900 449 2HB MET 142 1HB MET 142 -3.630 -4.101 -4.101 450 1HG MET 142 2HG MET 142 -1.984 -2.096 -2.096 451 2HG MET 142 1HG MET 142 -1.225 -2.741 -2.741 452 1HE MET 142 1HE MET 142 -3.075 -3.874 -3.874 453 2HE MET 142 3HE MET 142 -4.518 -4.112 -4.112 454 3HE MET 142 2HE MET 142 -4.618 -3.040 -3.040 455 H GLU 143 H GLU 143 -0.649 -7.126 -7.126 456 HA GLU 143 HA GLU 143 -2.927 -8.079 -8.079 457 1HB GLU 143 2HB GLU 143 -0.877 -9.551 -9.551 458 2HB GLU 143 1HB GLU 143 -0.072 -8.980 -8.980 459 1HG GLU 143 2HG GLU 143 -2.876 -10.257 -10.257 460 2HG GLU 143 1HG GLU 143 -1.408 -11.320 -11.320 461 H VAL 144 H VAL 144 0.122 -6.949 -6.949 462 HA VAL 144 HA VAL 144 -0.551 -7.384 -7.384 463 HB VAL 144 HB VAL 144 1.573 -5.539 -5.539 464 1HG1 VAL 144 3HG1 VAL 144 0.764 -6.784 -6.784 465 2HG1 VAL 144 2HG1 VAL 144 2.472 -6.484 -6.484 466 3HG1 VAL 144 1HG1 VAL 144 1.304 -5.092 -5.092 467 1HG2 VAL 144 2HG2 VAL 144 0.952 -8.477 -8.477 468 2HG2 VAL 144 1HG2 VAL 144 1.616 -7.790 -7.790 469 3HG2 VAL 144 3HG2 VAL 144 2.692 -7.909 -7.909 470 H LEU 145 H LEU 145 -0.272 -4.279 -4.279 471 HA LEU 145 HA LEU 145 -1.231 -2.610 -2.610 472 1HB LEU 145 2HB LEU 145 -1.700 -2.711 -2.711 473 2HB LEU 145 1HB LEU 145 -2.166 -1.285 -1.285 474 HG LEU 145 HG LEU 145 0.626 -2.442 -2.442 475 1HD1 LEU 145 2HD1 LEU 145 -0.773 0.100 0.100 476 2HD1 LEU 145 1HD1 LEU 145 1.006 -0.191 -0.191 477 3HD1 LEU 145 3HD1 LEU 145 -0.166 -1.290 -1.290 478 1HD2 LEU 145 2HD2 LEU 145 -0.496 -0.424 -0.424 479 2HD2 LEU 145 1HD2 LEU 145 0.658 -1.744 -1.744 480 3HD2 LEU 145 3HD2 LEU 145 1.232 -0.256 -0.256 481 H ASN 146 H ASN 146 -3.178 -4.117 -4.117 482 HA ASN 146 HA ASN 146 -5.782 -3.326 -3.326 483 1HB ASN 146 2HB ASN 146 -4.469 -4.390 -4.390 484 2HB ASN 146 1HB ASN 146 -5.281 -5.886 -5.886 485 1HD2 ASN 146 1HD2 ASN 146 -5.853 -6.159 -6.159 486 2HD2 ASN 146 2HD2 ASN 146 -7.127 -5.360 -5.360 487 H ARG 147 H ARG 147 -3.926 -6.283 -6.283 488 HA ARG 147 HA ARG 147 -6.252 -6.968 -6.968 489 1HB ARG 147 2HB ARG 147 -5.157 -8.737 -8.737 490 2HB ARG 147 1HB ARG 147 -3.540 -8.081 -8.081 491 1HG ARG 147 2HG ARG 147 -3.689 -8.932 -8.932 492 2HG ARG 147 1HG ARG 147 -5.518 -8.768 -8.768 493 1HD ARG 147 2HD ARG 147 -5.039 -11.144 -11.144 494 2HD ARG 147 1HD ARG 147 -5.423 -10.889 -10.889 495 HE ARG 147 HE ARG 147 -2.671 -10.458 -10.458 496 1HH1 ARG 147 1HH2 ARG 147 -4.869 -13.099 -13.099 497 2HH1 ARG 147 2HH2 ARG 147 -3.686 -14.346 -14.346 498 1HH2 ARG 147 1HH1 ARG 147 -1.088 -12.146 -12.146 499 2HH2 ARG 147 2HH1 ARG 147 -1.504 -13.795 -13.795 500 H VAL 148 H VAL 148 -3.560 -4.641 -4.641 501 HA VAL 148 HA VAL 148 -3.518 -5.184 -5.184 502 HB VAL 148 HB VAL 148 -2.854 -2.565 -2.565 503 1HG1 VAL 148 1HG1 VAL 148 -2.865 -3.384 -3.384 504 2HG1 VAL 148 3HG1 VAL 148 -1.540 -4.512 -4.512 505 3HG1 VAL 148 2HG1 VAL 148 -1.295 -2.724 -2.724 506 1HG2 VAL 148 2HG2 VAL 148 -1.148 -5.048 -5.048 507 2HG2 VAL 148 1HG2 VAL 148 -1.707 -3.874 -3.874 508 3HG2 VAL 148 3HG2 VAL 148 -0.500 -3.352 -3.352 509 H LYS 149 H LYS 149 -5.089 -2.772 -2.772 510 HA LYS 149 HA LYS 149 -6.561 -1.339 -1.339 511 1HB LYS 149 2HB LYS 149 -6.543 -1.021 -1.021 512 2HB LYS 149 1HB LYS 149 -7.323 -2.650 -2.650 513 1HG LYS 149 2HG LYS 149 -9.310 -2.089 -2.089 514 2HG LYS 149 1HG LYS 149 -8.814 -0.565 -0.565 515 1HD LYS 149 2HD LYS 149 -9.225 -1.141 -1.141 516 2HD LYS 149 1HD LYS 149 -10.273 -0.148 -0.148 517 1HE LYS 149 2HE LYS 149 -9.013 1.708 1.708 518 2HE LYS 149 1HE LYS 149 -7.614 0.829 0.829 519 1HZ LYS 149 2HZ LYS 149 -10.376 1.264 1.264 520 2HZ LYS 149 1HZ LYS 149 -8.981 2.123 2.123 521 3HZ LYS 149 3HZ LYS 149 -9.108 0.467 0.467 522 H ASP 150 H ASP 150 -7.289 -4.636 -4.636 523 HA ASP 150 HA ASP 150 -9.930 -4.528 -4.528 524 1HB ASP 150 2HB ASP 150 -8.075 -6.391 -6.391 525 2HB ASP 150 1HB ASP 150 -9.408 -7.080 -7.080 526 H ASP 151 H ASP 151 -6.915 -6.126 -6.126 527 HA ASP 151 HA ASP 151 -8.604 -7.040 -7.040 528 1HB ASP 151 2HB ASP 151 -6.406 -8.046 -8.046 529 2HB ASP 151 1HB ASP 151 -5.620 -6.774 -6.774 530 H LEU 152 H LEU 152 -6.906 -3.860 -3.860 531 HA LEU 152 HA LEU 152 -7.049 -3.302 -3.302 532 1HB LEU 152 2HB LEU 152 -6.015 -1.923 -1.923 533 2HB LEU 152 1HB LEU 152 -7.308 -0.959 -0.959 534 HG LEU 152 HG LEU 152 -5.257 -0.141 -0.141 535 1HD1 LEU 152 1HD1 LEU 152 -6.431 -1.973 -1.973 536 2HD1 LEU 152 3HD1 LEU 152 -5.265 -0.664 -0.664 537 3HD1 LEU 152 2HD1 LEU 152 -6.885 -0.284 -0.284 538 1HD2 LEU 152 2HD2 LEU 152 -4.515 -3.057 -3.057 539 2HD2 LEU 152 1HD2 LEU 152 -3.864 -1.901 -1.901 540 3HD2 LEU 152 3HD2 LEU 152 -3.513 -1.615 -1.615 541 H GLN 153 H GLN 153 -9.116 -2.784 -2.784 542 HA GLN 153 HA GLN 153 -10.526 -0.941 -0.941 543 1HB GLN 153 2HB GLN 153 -10.595 -3.334 -3.334 544 2HB GLN 153 1HB GLN 153 -12.024 -3.533 -3.533 545 1HG GLN 153 2HG GLN 153 -12.966 -1.429 -1.429 546 2HG GLN 153 1HG GLN 153 -11.325 -1.339 -1.339 547 1HE2 GLN 153 1HE2 GLN 153 -11.557 -1.911 -1.911 548 2HE2 GLN 153 2HE2 GLN 153 -12.356 -3.329 -3.329 549 H GLU 154 H GLU 154 -10.868 -2.948 -2.948 550 HA GLU 154 HA GLU 154 -13.403 -2.300 -2.300 551 1HB GLU 154 2HB GLU 154 -11.115 -2.858 -2.858 552 2HB GLU 154 1HB GLU 154 -12.774 -3.488 -3.488 553 1HG GLU 154 2HG GLU 154 -12.085 -4.915 -4.915 554 2HG GLU 154 1HG GLU 154 -10.420 -4.208 -4.208 555 H LEU 155 H LEU 155 -10.207 -1.233 -1.233 556 HA LEU 155 HA LEU 155 -11.234 0.798 0.798 557 1HB LEU 155 2HB LEU 155 -9.529 -1.063 -1.063 558 2HB LEU 155 1HB LEU 155 -8.331 -0.147 -0.147 559 HG LEU 155 HG LEU 155 -9.808 1.431 1.431 560 1HD1 LEU 155 2HD1 LEU 155 -9.703 -0.781 -0.781 561 2HD1 LEU 155 1HD1 LEU 155 -7.926 -0.866 -0.866 562 3HD1 LEU 155 3HD1 LEU 155 -8.603 0.403 0.403 563 1HD2 LEU 155 3HD2 LEU 155 -6.797 1.031 1.031 564 2HD2 LEU 155 2HD2 LEU 155 -7.842 2.386 2.386 565 3HD2 LEU 155 1HD2 LEU 155 -7.496 2.219 2.219 566 H ALA 156 H ALA 156 -8.917 0.240 0.240 567 HA ALA 156 HA ALA 156 -8.480 3.167 3.167 568 1HB ALA 156 2HB ALA 156 -6.390 1.820 1.820 569 2HB ALA 156 1HB ALA 156 -7.147 0.949 0.949 570 3HB ALA 156 3HB ALA 156 -6.819 2.702 2.702 571 H VAL 157 H VAL 157 -9.563 4.128 4.128 572 HA VAL 157 HA VAL 157 -8.683 2.093 2.093 573 HB VAL 157 HB VAL 157 -10.182 2.846 2.846 574 1HG1 VAL 157 1HG1 VAL 157 -11.728 2.723 2.723 575 2HG1 VAL 157 3HG1 VAL 157 -12.447 2.537 2.537 576 3HG1 VAL 157 2HG1 VAL 157 -11.232 1.325 1.325 577 1HG2 VAL 157 3HG2 VAL 157 -9.967 5.486 5.486 578 2HG2 VAL 157 2HG2 VAL 157 -11.506 4.819 4.819 579 3HG2 VAL 157 1HG2 VAL 157 -11.262 5.072 5.072 580 H VAL 158 H VAL 158 -8.416 2.725 2.725 581 HA VAL 158 HA VAL 158 -6.181 4.383 4.383 582 HB VAL 158 HB VAL 158 -7.697 3.094 3.094 583 1HG1 VAL 158 1HG1 VAL 158 -5.506 4.122 4.122 584 2HG1 VAL 158 3HG1 VAL 158 -4.700 2.917 2.917 585 3HG1 VAL 158 2HG1 VAL 158 -5.664 2.351 2.351 586 1HG2 VAL 158 1HG2 VAL 158 -6.182 1.665 1.665 587 2HG2 VAL 158 3HG2 VAL 158 -7.840 1.281 1.281 588 3HG2 VAL 158 2HG2 VAL 158 -6.360 0.919 0.919 589 H GLU 159 H GLU 159 -5.781 5.956 5.956 590 HA GLU 159 HA GLU 159 -7.909 7.816 7.816 591 1HB GLU 159 2HB GLU 159 -5.560 8.354 8.354 592 2HB GLU 159 1HB GLU 159 -5.133 7.801 7.801 593 1HG GLU 159 2HG GLU 159 -6.490 9.745 9.745 594 2HG GLU 159 1HG GLU 159 -7.020 10.159 10.159 595 H SER 160 H SER 160 -5.887 5.738 5.738 596 HA SER 160 HA SER 160 -7.815 5.997 5.997 597 1HB SER 160 2HB SER 160 -5.878 7.751 7.751 598 2HB SER 160 1HB SER 160 -4.993 6.253 6.253 599 HG SER 160 HG SER 160 -6.623 5.965 5.965 600 H PHE 161 H PHE 161 -7.635 4.153 4.153 601 HA PHE 161 HA PHE 161 -5.367 2.403 2.403 602 1HB PHE 161 2HB PHE 161 -7.852 1.461 1.461 603 2HB PHE 161 1HB PHE 161 -7.661 1.275 1.275 604 HD1 PHE 161 1HD PHE 161 -5.810 -0.017 -0.017 605 HD2 PHE 161 2HD PHE 161 -6.780 0.047 0.047 606 HE1 PHE 161 1HE PHE 161 -3.890 -1.490 -1.490 607 HE2 PHE 161 2HE PHE 161 -5.141 -1.371 -1.371 608 HZ PHE 161 HZ PHE 161 -3.598 -2.275 -2.275 609 HA PRO 162 HA PRO 162 -5.377 3.842 3.842 610 1HB PRO 162 2HB PRO 162 -2.784 4.853 4.853 611 2HB PRO 162 1HB PRO 162 -4.143 5.741 5.741 612 1HG PRO 162 2HG PRO 162 -1.785 4.656 4.656 613 2HG PRO 162 1HG PRO 162 -3.132 5.703 5.703 614 1HD PRO 162 2HD PRO 162 -2.795 2.729 2.729 615 2HD PRO 162 1HD PRO 162 -3.777 3.742 3.742 616 H THR 163 H THR 163 -2.089 3.173 3.173 617 HA THR 163 HA THR 163 -2.168 0.688 0.688 618 HB THR 163 HB THR 163 -3.525 3.182 3.182 619 HG1 THR 163 1HG THR 163 -4.537 1.586 1.586 620 1HG2 THR 163 2HG2 THR 163 -1.518 1.570 1.570 621 2HG2 THR 163 1HG2 THR 163 -2.830 2.546 2.546 622 3HG2 THR 163 3HG2 THR 163 -1.664 3.392 3.392 623 H LYS 164 H LYS 164 -1.400 4.259 4.259 624 HA LYS 164 HA LYS 164 0.795 3.795 3.795 625 1HB LYS 164 2HB LYS 164 1.056 6.249 6.249 626 2HB LYS 164 1HB LYS 164 -0.613 5.699 5.699 627 1HG LYS 164 2HG LYS 164 -1.145 6.176 6.176 628 2HG LYS 164 1HG LYS 164 0.444 7.015 7.015 629 1HD LYS 164 2HD LYS 164 -1.172 8.706 8.706 630 2HD LYS 164 1HD LYS 164 -0.387 8.461 8.461 631 1HE LYS 164 2HE LYS 164 -2.378 7.086 7.086 632 2HE LYS 164 1HE LYS 164 -3.117 7.291 7.291 633 1HZ LYS 164 2HZ LYS 164 -3.129 9.665 9.665 634 2HZ LYS 164 1HZ LYS 164 -2.442 9.469 9.469 635 3HZ LYS 164 3HZ LYS 164 -3.988 8.846 8.846 636 H ILE 165 H ILE 165 2.673 3.174 3.174 637 HA ILE 165 HA ILE 165 3.756 3.438 3.438 638 HB ILE 165 HB ILE 165 5.149 2.602 2.602 639 1HG1 ILE 165 2HG1 ILE 165 2.901 1.216 1.216 640 2HG1 ILE 165 1HG1 ILE 165 3.129 1.372 1.372 641 1HG2 ILE 165 2HG2 ILE 165 5.436 1.796 1.796 642 2HG2 ILE 165 1HG2 ILE 165 6.392 1.070 1.070 643 3HG2 ILE 165 3HG2 ILE 165 6.579 2.795 2.795 644 1HD1 ILE 165 3HD1 ILE 165 5.187 -0.216 -0.216 645 2HD1 ILE 165 2HD1 ILE 165 4.501 -0.502 -0.502 646 3HD1 ILE 165 1HD1 ILE 165 3.540 -0.930 -0.930 647 H GLU 166 H GLU 166 5.520 4.607 4.607 648 HA GLU 166 HA GLU 166 6.141 6.878 6.878 649 1HB GLU 166 2HB GLU 166 6.446 6.609 6.609 650 2HB GLU 166 1HB GLU 166 7.039 8.003 8.003 651 1HG GLU 166 2HG GLU 166 4.666 8.488 8.488 652 2HG GLU 166 1HG GLU 166 4.089 7.140 7.140 653 H GLY 167 H GLY 167 7.640 5.520 5.520 654 1HA GLY 167 2HA GLY 167 9.814 4.886 4.886 655 2HA GLY 167 1HA GLY 167 10.149 5.312 5.312 656 H ARG 168 H ARG 168 11.010 3.776 3.776 657 HA ARG 168 HA ARG 168 10.389 1.059 1.059 658 1HB ARG 168 2HB ARG 168 12.522 0.628 0.628 659 2HB ARG 168 1HB ARG 168 12.733 1.631 1.631 660 1HG ARG 168 2HG ARG 168 12.854 3.679 3.679 661 2HG ARG 168 1HG ARG 168 12.373 2.814 2.814 662 1HD ARG 168 2HD ARG 168 14.856 3.243 3.243 663 2HD ARG 168 1HD ARG 168 14.457 1.467 1.467 664 HE ARG 168 HE ARG 168 14.704 2.590 2.590 665 1HH1 ARG 168 1HH1 ARG 168 16.437 1.185 1.185 666 2HH1 ARG 168 2HH1 ARG 168 17.739 0.551 0.551 667 1HH2 ARG 168 1HH2 ARG 168 16.467 1.720 1.720 668 2HH2 ARG 168 2HH2 ARG 168 17.755 0.858 0.858 669 H GLN 169 H GLN 169 8.486 2.470 2.470 670 HA GLN 169 HA GLN 169 8.238 0.839 0.839 671 1HB GLN 169 2HB GLN 169 9.392 3.593 3.593 672 2HB GLN 169 1HB GLN 169 8.244 3.120 3.120 673 1HG GLN 169 2HG GLN 169 9.854 1.544 1.544 674 2HG GLN 169 1HG GLN 169 10.935 1.686 1.686 675 1HE2 GLN 169 1HE2 GLN 169 9.253 3.874 3.874 676 2HE2 GLN 169 2HE2 GLN 169 10.601 4.931 4.931 677 H MET 170 H MET 170 6.016 1.004 1.004 678 HA MET 170 HA MET 170 4.579 3.133 3.133 679 1HB MET 170 2HB MET 170 3.772 0.930 0.930 680 2HB MET 170 1HB MET 170 3.399 0.350 0.350 681 1HG MET 170 2HG MET 170 1.652 1.959 1.959 682 2HG MET 170 1HG MET 170 2.180 2.850 2.850 683 1HE MET 170 3HE MET 170 1.576 -1.120 -1.120 684 2HE MET 170 2HE MET 170 0.532 -1.217 -1.217 685 3HE MET 170 1HE MET 170 2.219 -0.629 -0.629 686 H ILE 171 H ILE 171 3.937 4.711 4.711 687 HA ILE 171 HA ILE 171 3.215 3.881 3.881 688 HB ILE 171 HB ILE 171 2.712 6.497 6.497 689 1HG1 ILE 171 2HG1 ILE 171 5.153 5.641 5.641 690 2HG1 ILE 171 1HG1 ILE 171 4.696 7.319 7.319 691 1HG2 ILE 171 3HG2 ILE 171 2.277 5.448 5.448 692 2HG2 ILE 171 2HG2 ILE 171 2.496 7.237 7.237 693 3HG2 ILE 171 1HG2 ILE 171 1.090 6.399 6.399 694 1HD1 ILE 171 1HD1 ILE 171 4.654 4.774 4.774 695 2HD1 ILE 171 3HD1 ILE 171 5.973 6.007 6.007 696 3HD1 ILE 171 2HD1 ILE 171 4.306 6.403 6.403 697 H MET 172 H MET 172 1.323 3.118 3.118 698 HA MET 172 HA MET 172 -1.212 4.104 4.104 699 1HB MET 172 2HB MET 172 -1.345 1.624 1.624 700 2HB MET 172 1HB MET 172 -0.557 1.615 1.615 701 1HG MET 172 2HG MET 172 -2.548 2.547 2.547 702 2HG MET 172 1HG MET 172 -3.247 2.954 2.954 703 1HE MET 172 2HE MET 172 -3.495 1.098 1.098 704 2HE MET 172 1HE MET 172 -4.156 -0.521 -0.521 705 3HE MET 172 3HE MET 172 -2.377 -0.248 -0.248 706 H VAL 173 H VAL 173 -2.331 5.408 5.408 707 HA VAL 173 HA VAL 173 -0.655 5.969 5.969 708 HB VAL 173 HB VAL 173 -3.125 7.427 7.427 709 1HG1 VAL 173 1HG1 VAL 173 -1.898 7.580 7.580 710 2HG1 VAL 173 3HG1 VAL 173 -0.434 8.008 8.008 711 3HG1 VAL 173 2HG1 VAL 173 -1.840 9.158 9.158 712 1HG2 VAL 173 2HG2 VAL 173 -0.281 7.789 7.789 713 2HG2 VAL 173 1HG2 VAL 173 -1.817 7.519 7.519 714 3HG2 VAL 173 3HG2 VAL 173 -1.552 9.063 9.063 715 H LEU 174 H LEU 174 -1.677 5.305 5.305 716 HA LEU 174 HA LEU 174 -4.504 4.253 4.253 717 1HB LEU 174 2HB LEU 174 -3.454 2.278 2.278 718 2HB LEU 174 1HB LEU 174 -2.130 2.930 2.930 719 HG LEU 174 HG LEU 174 -4.072 3.423 3.423 720 1HD1 LEU 174 1HD1 LEU 174 -4.961 1.214 1.214 721 2HD1 LEU 174 3HD1 LEU 174 -5.674 1.454 1.454 722 3HD1 LEU 174 2HD1 LEU 174 -5.767 2.800 2.800 723 1HD2 LEU 174 3HD2 LEU 174 -2.137 1.999 1.999 724 2HD2 LEU 174 2HD2 LEU 174 -3.784 1.413 1.413 725 3HD2 LEU 174 1HD2 LEU 174 -3.014 0.614 0.614 726 H ALA 175 H ALA 175 -5.872 5.172 5.172 727 HA ALA 175 HA ALA 175 -4.522 7.051 7.051 728 1HB ALA 175 2HB ALA 175 -6.967 7.171 7.171 729 2HB ALA 175 1HB ALA 175 -6.517 8.601 8.601 730 3HB ALA 175 3HB ALA 175 -5.378 8.117 8.117 731 HA PRO 176 HA PRO 176 -7.854 5.854 5.854 732 1HB PRO 176 2HB PRO 176 -8.930 8.695 8.695 733 2HB PRO 176 1HB PRO 176 -8.668 7.661 7.661 734 1HG PRO 176 2HG PRO 176 -6.886 9.651 9.651 735 2HG PRO 176 1HG PRO 176 -6.269 8.016 8.016 736 1HD PRO 176 2HD PRO 176 -6.511 9.170 9.170 737 2HD PRO 176 1HD PRO 176 -5.167 8.187 8.187 738 H LYS 177 H LYS 177 -10.086 5.124 5.124 739 HA LYS 177 HA LYS 177 -11.323 5.769 5.769 740 1HB LYS 177 2HB LYS 177 -11.763 3.586 3.586 741 2HB LYS 177 1HB LYS 177 -12.529 4.531 4.531 742 1HG LYS 177 2HG LYS 177 -14.267 5.377 5.377 743 2HG LYS 177 1HG LYS 177 -13.499 4.290 4.290 744 1HD LYS 177 2HD LYS 177 -14.774 3.429 3.429 745 2HD LYS 177 1HD LYS 177 -15.621 3.461 3.461 746 1HE LYS 177 2HE LYS 177 -13.976 1.798 1.798 747 2HE LYS 177 1HE LYS 177 -13.185 1.696 1.696 748 1HZ LYS 177 2HZ LYS 177 -16.032 1.092 1.092 749 2HZ LYS 177 1HZ LYS 177 -14.792 -0.036 -0.036 750 3HZ LYS 177 3HZ LYS 177 -15.295 0.999 0.999 751 H LYS 178 H LYS 178 -12.154 7.673 7.673 752 HA LYS 178 HA LYS 178 -13.264 9.260 9.260 753 1HB LYS 178 2HB LYS 178 -12.396 9.854 9.854 754 2HB LYS 178 1HB LYS 178 -13.240 11.073 11.073 755 1HG LYS 178 2HG LYS 178 -11.395 10.871 10.871 756 2HG LYS 178 1HG LYS 178 -10.499 9.758 9.758 757 1HD LYS 178 2HD LYS 178 -11.271 12.650 12.650 758 2HD LYS 178 1HD LYS 178 -9.752 12.188 12.188 759 1HE LYS 178 2HE LYS 178 -9.158 12.395 12.395 760 2HE LYS 178 1HE LYS 178 -9.221 10.616 10.616 761 1HZ LYS 178 2HZ LYS 178 -11.431 10.602 10.602 762 2HZ LYS 178 1HZ LYS 178 -11.333 12.269 12.269 763 3HZ LYS 178 3HZ LYS 178 -10.269 11.196 11.196 764 H LYS 179 H LYS 179 -15.133 7.763 7.763 765 HA LYS 179 HA LYS 179 -16.823 7.613 7.613 766 1HB LYS 179 2HB LYS 179 -16.793 5.845 5.845 767 2HB LYS 179 1HB LYS 179 -17.484 7.047 7.047 768 1HG LYS 179 2HG LYS 179 -19.543 7.212 7.212 769 2HG LYS 179 1HG LYS 179 -18.798 6.124 6.124 770 1HD LYS 179 2HD LYS 179 -18.702 4.285 4.285 771 2HD LYS 179 1HD LYS 179 -19.471 5.361 5.361 772 1HE LYS 179 2HE LYS 179 -20.757 4.502 4.502 773 2HE LYS 179 1HE LYS 179 -21.138 3.802 3.802 774 1HZ LYS 179 1HZ LYS 179 -21.489 6.641 6.641 775 2HZ LYS 179 3HZ LYS 179 -22.713 5.474 5.474 776 3HZ LYS 179 2HZ LYS 179 -21.849 5.979 5.979 777 H GLN 180 H GLN 180 -18.009 9.274 9.274 778 HA GLN 180 HA GLN 180 -18.270 11.607 11.607 779 1HB GLN 180 2HB GLN 180 -19.519 10.874 10.874 780 2HB GLN 180 1HB GLN 180 -19.584 12.503 12.503 781 1HG GLN 180 2HG GLN 180 -17.096 12.693 12.693 782 2HG GLN 180 1HG GLN 180 -16.992 11.032 11.032 783 1HE2 GLN 180 1HE2 GLN 180 -16.747 11.014 11.014 784 2HE2 GLN 180 2HE2 GLN 180 -17.443 12.122 12.122 Start of MODEL 5 1 HA VAL 90 HA VAL 90 -4.304 16.423 16.423 2 HB VAL 90 HB VAL 90 -2.783 16.927 16.927 3 1HG1 VAL 90 2HG1 VAL 90 -3.346 19.006 19.006 4 2HG1 VAL 90 1HG1 VAL 90 -2.974 19.306 19.306 5 3HG1 VAL 90 3HG1 VAL 90 -4.429 18.333 18.333 6 1HG2 VAL 90 3HG2 VAL 90 -0.801 17.704 17.704 7 2HG2 VAL 90 2HG2 VAL 90 -0.637 16.357 16.357 8 3HG2 VAL 90 1HG2 VAL 90 -0.675 18.065 18.065 9 H ILE 91 H ILE 91 -3.476 15.350 15.350 10 HA ILE 91 HA ILE 91 -3.020 12.582 12.582 11 HB ILE 91 HB ILE 91 -3.779 13.827 13.827 12 1HG1 ILE 91 2HG1 ILE 91 -5.591 14.125 14.125 13 2HG1 ILE 91 1HG1 ILE 91 -6.021 12.801 12.801 14 1HG2 ILE 91 1HG2 ILE 91 -3.516 10.890 10.890 15 2HG2 ILE 91 3HG2 ILE 91 -4.383 11.408 11.408 16 3HG2 ILE 91 2HG2 ILE 91 -2.620 11.698 11.698 17 1HD1 ILE 91 2HD1 ILE 91 -5.310 11.111 11.111 18 2HD1 ILE 91 1HD1 ILE 91 -4.979 12.463 12.463 19 3HD1 ILE 91 3HD1 ILE 91 -6.659 12.177 12.177 20 H GLN 92 H GLN 92 -1.162 11.699 11.699 21 HA GLN 92 HA GLN 92 1.085 13.209 13.209 22 1HB GLN 92 2HB GLN 92 0.889 10.692 10.692 23 2HB GLN 92 1HB GLN 92 2.343 11.728 11.728 24 1HG GLN 92 2HG GLN 92 1.317 13.515 13.515 25 2HG GLN 92 1HG GLN 92 -0.333 12.868 12.868 26 1HE2 GLN 92 1HE2 GLN 92 -1.258 11.864 11.864 27 2HE2 GLN 92 2HE2 GLN 92 -0.489 11.056 11.056 28 H VAL 93 H VAL 93 2.918 11.804 11.804 29 HA VAL 93 HA VAL 93 1.646 9.694 9.694 30 HB VAL 93 HB VAL 93 4.181 11.243 11.243 31 1HG1 VAL 93 1HG1 VAL 93 2.766 8.756 8.756 32 2HG1 VAL 93 3HG1 VAL 93 3.959 9.702 9.702 33 3HG1 VAL 93 2HG1 VAL 93 4.543 8.807 8.807 34 1HG2 VAL 93 3HG2 VAL 93 1.706 12.046 12.046 35 2HG2 VAL 93 2HG2 VAL 93 2.905 11.817 11.817 36 3HG2 VAL 93 1HG2 VAL 93 1.754 10.485 10.485 37 H LYS 94 H LYS 94 1.892 7.637 7.637 38 HA LYS 94 HA LYS 94 4.777 7.185 7.185 39 1HB LYS 94 2HB LYS 94 2.632 5.101 5.101 40 2HB LYS 94 1HB LYS 94 4.264 5.041 5.041 41 1HG LYS 94 2HG LYS 94 2.149 7.091 7.091 42 2HG LYS 94 1HG LYS 94 2.373 5.519 5.519 43 1HD LYS 94 2HD LYS 94 4.701 6.007 6.007 44 2HD LYS 94 1HD LYS 94 4.654 7.567 7.567 45 1HE LYS 94 2HE LYS 94 2.897 6.955 6.955 46 2HE LYS 94 1HE LYS 94 4.474 7.849 7.849 47 1HZ LYS 94 1HZ LYS 94 3.547 9.448 9.448 48 2HZ LYS 94 3HZ LYS 94 2.061 8.625 8.625 49 3HZ LYS 94 2HZ LYS 94 2.613 9.333 9.333 50 H GLU 95 H GLU 95 5.514 4.999 4.999 51 HA GLU 95 HA GLU 95 4.232 4.692 4.692 52 1HB GLU 95 2HB GLU 95 6.188 6.361 6.361 53 2HB GLU 95 1HB GLU 95 7.161 4.913 4.913 54 1HG GLU 95 2HG GLU 95 6.689 3.851 3.851 55 2HG GLU 95 1HG GLU 95 5.521 5.175 5.175 56 H ILE 96 H ILE 96 4.780 2.498 2.498 57 HA ILE 96 HA ILE 96 6.625 0.949 0.949 58 HB ILE 96 HB ILE 96 4.003 0.789 0.789 59 1HG1 ILE 96 2HG1 ILE 96 5.562 -1.824 -1.824 60 2HG1 ILE 96 1HG1 ILE 96 6.265 -0.390 -0.390 61 1HG2 ILE 96 3HG2 ILE 96 3.395 0.202 0.202 62 2HG2 ILE 96 2HG2 ILE 96 4.238 -1.418 -1.418 63 3HG2 ILE 96 1HG2 ILE 96 2.897 -1.015 -1.015 64 1HD1 ILE 96 1HD1 ILE 96 4.125 0.004 0.004 65 2HD1 ILE 96 3HD1 ILE 96 3.489 -1.558 -1.558 66 3HD1 ILE 96 2HD1 ILE 96 4.927 -1.541 -1.541 67 H LYS 97 H LYS 97 7.248 -1.065 -1.065 68 HA LYS 97 HA LYS 97 6.457 -0.537 -0.537 69 1HB LYS 97 2HB LYS 97 8.906 -2.123 -2.123 70 2HB LYS 97 1HB LYS 97 8.188 -1.893 -1.893 71 1HG LYS 97 2HG LYS 97 8.584 0.541 0.541 72 2HG LYS 97 1HG LYS 97 9.316 0.378 0.378 73 1HD LYS 97 2HD LYS 97 11.160 -0.976 -0.976 74 2HD LYS 97 1HD LYS 97 10.366 -1.050 -1.050 75 1HE LYS 97 2HE LYS 97 12.244 0.605 0.605 76 2HE LYS 97 1HE LYS 97 10.655 1.422 1.422 77 1HZ LYS 97 3HZ LYS 97 10.596 2.014 2.014 78 2HZ LYS 97 2HZ LYS 97 12.094 1.257 1.257 79 3HZ LYS 97 1HZ LYS 97 11.996 2.609 2.609 80 H PHE 98 H PHE 98 5.930 -2.301 -2.301 81 HA PHE 98 HA PHE 98 5.673 -4.884 -4.884 82 1HB PHE 98 2HB PHE 98 3.405 -3.261 -3.261 83 2HB PHE 98 1HB PHE 98 3.362 -4.984 -4.984 84 HD1 PHE 98 1HD PHE 98 4.309 -5.724 -5.724 85 HD2 PHE 98 2HD PHE 98 1.616 -3.252 -3.252 86 HE1 PHE 98 1HE PHE 98 3.093 -5.476 -5.476 87 HE2 PHE 98 2HE PHE 98 0.397 -2.800 -2.800 88 HZ PHE 98 HZ PHE 98 1.008 -4.161 -4.161 89 H ARG 99 H ARG 99 7.294 -5.704 -5.704 90 HA ARG 99 HA ARG 99 7.681 -4.908 -4.908 91 1HB ARG 99 2HB ARG 99 9.108 -6.822 -6.822 92 2HB ARG 99 1HB ARG 99 9.689 -6.274 -6.274 93 1HG ARG 99 2HG ARG 99 9.558 -3.876 -3.876 94 2HG ARG 99 1HG ARG 99 9.323 -4.554 -4.554 95 1HD ARG 99 2HD ARG 99 11.544 -5.747 -5.747 96 2HD ARG 99 1HD ARG 99 11.755 -5.033 -5.033 97 HE ARG 99 HE ARG 99 11.161 -2.924 -2.924 98 1HH1 ARG 99 1HH1 ARG 99 13.696 -5.262 -5.262 99 2HH1 ARG 99 2HH1 ARG 99 15.009 -4.283 -4.283 100 1HH2 ARG 99 1HH2 ARG 99 12.943 -1.600 -1.600 101 2HH2 ARG 99 2HH2 ARG 99 14.575 -2.168 -2.168 102 HA PRO 100 HA PRO 100 6.085 -8.790 -8.790 103 1HB PRO 100 2HB PRO 100 8.261 -9.658 -9.658 104 2HB PRO 100 1HB PRO 100 6.877 -8.643 -8.643 105 1HG PRO 100 2HG PRO 100 9.682 -7.819 -7.819 106 2HG PRO 100 1HG PRO 100 8.578 -7.031 -7.031 107 1HD PRO 100 2HD PRO 100 9.090 -6.080 -6.080 108 2HD PRO 100 1HD PRO 100 7.484 -5.769 -5.769 109 H GLY 101 H GLY 101 6.229 -10.879 -10.879 110 1HA GLY 101 2HA GLY 101 7.265 -12.688 -12.688 111 2HA GLY 101 1HA GLY 101 8.789 -11.706 -11.706 112 H THR 102 H THR 102 6.204 -10.069 -10.069 113 HA THR 102 HA THR 102 6.637 -10.691 -10.691 114 HB THR 102 HB THR 102 5.409 -8.034 -8.034 115 HG1 THR 102 1HG THR 102 7.654 -8.169 -8.169 116 1HG2 THR 102 1HG2 THR 102 5.756 -9.795 -9.795 117 2HG2 THR 102 3HG2 THR 102 6.263 -8.061 -8.061 118 3HG2 THR 102 2HG2 THR 102 4.589 -8.449 -8.449 119 H ASP 103 H ASP 103 5.322 -12.493 -12.493 120 HA ASP 103 HA ASP 103 2.618 -12.046 -12.046 121 1HB ASP 103 2HB ASP 103 3.161 -14.622 -14.622 122 2HB ASP 103 1HB ASP 103 3.582 -13.646 -13.646 123 H GLU 104 H GLU 104 1.853 -14.334 -14.334 124 HA GLU 104 HA GLU 104 0.769 -12.507 -12.507 125 1HB GLU 104 2HB GLU 104 0.774 -15.461 -15.461 126 2HB GLU 104 1HB GLU 104 -0.466 -14.248 -14.248 127 1HG GLU 104 2HG GLU 104 0.191 -15.187 -15.187 128 2HG GLU 104 1HG GLU 104 -1.265 -15.628 -15.628 129 H GLY 105 H GLY 105 3.371 -14.670 -14.670 130 1HA GLY 105 2HA GLY 105 2.852 -13.949 -13.949 131 2HA GLY 105 1HA GLY 105 4.178 -15.031 -15.031 132 H ASP 106 H ASP 106 4.881 -12.597 -12.597 133 HA ASP 106 HA ASP 106 6.478 -11.090 -11.090 134 1HB ASP 106 2HB ASP 106 6.087 -11.492 -11.492 135 2HB ASP 106 1HB ASP 106 6.909 -10.097 -10.097 136 H TYR 107 H TYR 107 3.569 -11.232 -11.232 137 HA TYR 107 HA TYR 107 3.682 -8.421 -8.421 138 1HB TYR 107 2HB TYR 107 3.096 -10.205 -10.205 139 2HB TYR 107 1HB TYR 107 1.691 -10.685 -10.685 140 HD1 TYR 107 2HD TYR 107 1.869 -7.113 -7.113 141 HD2 TYR 107 1HD TYR 107 0.842 -10.757 -10.757 142 HE1 TYR 107 2HE TYR 107 -0.286 -6.145 -6.145 143 HE2 TYR 107 1HE TYR 107 -0.945 -9.593 -9.593 144 HH TYR 107 HH TYR 107 -1.988 -6.388 -6.388 145 H GLN 108 H GLN 108 0.776 -10.267 -10.267 146 HA GLN 108 HA GLN 108 -0.329 -8.301 -8.301 147 1HB GLN 108 2HB GLN 108 -1.083 -10.829 -10.829 148 2HB GLN 108 1HB GLN 108 -2.014 -9.522 -9.522 149 1HG GLN 108 2HG GLN 108 -0.400 -11.418 -11.418 150 2HG GLN 108 1HG GLN 108 -1.848 -11.927 -11.927 151 1HE2 GLN 108 1HE2 GLN 108 -0.677 -8.784 -8.784 152 2HE2 GLN 108 2HE2 GLN 108 -2.052 -8.542 -8.542 153 H VAL 109 H VAL 109 2.285 -9.776 -9.776 154 HA VAL 109 HA VAL 109 1.960 -9.049 -9.049 155 HB VAL 109 HB VAL 109 4.481 -9.159 -9.159 156 1HG1 VAL 109 1HG1 VAL 109 4.124 -8.829 -8.829 157 2HG1 VAL 109 3HG1 VAL 109 5.648 -9.386 -9.386 158 3HG1 VAL 109 2HG1 VAL 109 5.043 -7.740 -7.740 159 1HG2 VAL 109 2HG2 VAL 109 3.208 -11.150 -11.150 160 2HG2 VAL 109 1HG2 VAL 109 3.266 -11.325 -11.325 161 3HG2 VAL 109 3HG2 VAL 109 4.791 -11.356 -11.356 162 H LYS 110 H LYS 110 3.264 -7.342 -7.342 163 HA LYS 110 HA LYS 110 3.555 -4.899 -4.899 164 1HB LYS 110 2HB LYS 110 4.078 -5.864 -5.864 165 2HB LYS 110 1HB LYS 110 4.121 -4.127 -4.127 166 1HG LYS 110 2HG LYS 110 5.497 -5.200 -5.200 167 2HG LYS 110 1HG LYS 110 5.868 -6.387 -6.387 168 1HD LYS 110 2HD LYS 110 6.140 -4.254 -4.254 169 2HD LYS 110 1HD LYS 110 5.833 -3.352 -3.352 170 1HE LYS 110 2HE LYS 110 8.327 -5.172 -5.172 171 2HE LYS 110 1HE LYS 110 8.357 -3.359 -3.359 172 1HZ LYS 110 3HZ LYS 110 7.638 -3.365 -3.365 173 2HZ LYS 110 2HZ LYS 110 7.625 -5.064 -5.064 174 3HZ LYS 110 1HZ LYS 110 9.087 -4.228 -4.228 175 H LEU 111 H LEU 111 1.339 -6.226 -6.226 176 HA LEU 111 HA LEU 111 -0.355 -4.022 -4.022 177 1HB LEU 111 2HB LEU 111 -0.609 -6.393 -6.393 178 2HB LEU 111 1HB LEU 111 -1.451 -6.791 -6.791 179 HG LEU 111 HG LEU 111 -2.317 -4.427 -4.427 180 1HD1 LEU 111 2HD1 LEU 111 -2.016 -6.403 -6.403 181 2HD1 LEU 111 1HD1 LEU 111 -3.124 -7.363 -7.363 182 3HD1 LEU 111 3HD1 LEU 111 -3.751 -5.923 -5.923 183 1HD2 LEU 111 2HD2 LEU 111 -3.774 -6.411 -6.411 184 2HD2 LEU 111 1HD2 LEU 111 -3.555 -4.629 -4.629 185 3HD2 LEU 111 3HD2 LEU 111 -4.641 -5.262 -5.262 186 H ARG 112 H ARG 112 0.235 -6.277 -6.277 187 HA ARG 112 HA ARG 112 -1.592 -5.092 -5.092 188 1HB ARG 112 2HB ARG 112 -0.333 -7.248 -7.248 189 2HB ARG 112 1HB ARG 112 0.930 -6.207 -6.207 190 1HG ARG 112 2HG ARG 112 -0.789 -5.241 -5.241 191 2HG ARG 112 1HG ARG 112 -2.049 -6.262 -6.262 192 1HD ARG 112 2HD ARG 112 -0.808 -8.332 -8.332 193 2HD ARG 112 1HD ARG 112 0.406 -7.302 -7.302 194 HE ARG 112 HE ARG 112 -2.460 -7.747 -7.747 195 1HH1 ARG 112 1HH1 ARG 112 0.566 -5.931 -5.931 196 2HH1 ARG 112 2HH1 ARG 112 0.085 -5.397 -5.397 197 1HH2 ARG 112 1HH2 ARG 112 -3.082 -7.003 -7.003 198 2HH2 ARG 112 2HH2 ARG 112 -2.012 -6.007 -6.007 199 H SER 113 H SER 113 1.958 -4.206 -4.206 200 HA SER 113 HA SER 113 2.079 -2.286 -2.286 201 1HB SER 113 2HB SER 113 3.987 -3.078 -3.078 202 2HB SER 113 1HB SER 113 3.443 -2.196 -2.196 203 HG SER 113 HG SER 113 3.993 -1.078 -1.078 204 H LEU 114 H LEU 114 0.813 -2.012 -2.012 205 HA LEU 114 HA LEU 114 0.277 0.768 0.768 206 1HB LEU 114 2HB LEU 114 -1.093 -1.649 -1.649 207 2HB LEU 114 1HB LEU 114 -1.396 0.063 0.063 208 HG LEU 114 HG LEU 114 1.379 -1.239 -1.239 209 1HD1 LEU 114 1HD1 LEU 114 -0.264 -2.433 -2.433 210 2HD1 LEU 114 3HD1 LEU 114 -0.730 -0.878 -0.878 211 3HD1 LEU 114 2HD1 LEU 114 0.940 -1.529 -1.529 212 1HD2 LEU 114 2HD2 LEU 114 1.200 1.266 1.266 213 2HD2 LEU 114 1HD2 LEU 114 1.932 0.805 0.805 214 3HD2 LEU 114 3HD2 LEU 114 0.216 1.315 1.315 215 H ILE 115 H ILE 115 -1.746 -2.033 -2.033 216 HA ILE 115 HA ILE 115 -4.094 -0.582 -0.582 217 HB ILE 115 HB ILE 115 -3.500 -2.019 -2.019 218 1HG1 ILE 115 2HG1 ILE 115 -2.733 -3.636 -3.636 219 2HG1 ILE 115 1HG1 ILE 115 -4.203 -4.182 -4.182 220 1HG2 ILE 115 2HG2 ILE 115 -5.819 -1.467 -1.467 221 2HG2 ILE 115 1HG2 ILE 115 -5.935 -2.527 -2.527 222 3HG2 ILE 115 3HG2 ILE 115 -5.462 -0.800 -0.800 223 1HD1 ILE 115 2HD1 ILE 115 -5.568 -3.398 -3.398 224 2HD1 ILE 115 1HD1 ILE 115 -3.968 -3.031 -3.031 225 3HD1 ILE 115 3HD1 ILE 115 -4.408 -4.737 -4.737 226 H ARG 116 H ARG 116 -1.479 -0.917 -0.917 227 HA ARG 116 HA ARG 116 -2.387 0.653 0.653 228 1HB ARG 116 2HB ARG 116 -0.135 -0.830 -0.830 229 2HB ARG 116 1HB ARG 116 0.561 0.808 0.808 230 1HG ARG 116 2HG ARG 116 -1.036 -0.376 -0.376 231 2HG ARG 116 1HG ARG 116 0.743 -0.133 -0.133 232 1HD ARG 116 2HD ARG 116 0.381 2.377 2.377 233 2HD ARG 116 1HD ARG 116 -1.412 2.080 2.080 234 HE ARG 116 HE ARG 116 0.118 0.670 0.670 235 1HH1 ARG 116 1HH1 ARG 116 -1.284 3.802 3.802 236 2HH1 ARG 116 2HH1 ARG 116 -1.471 4.392 4.392 237 1HH2 ARG 116 1HH2 ARG 116 -0.140 1.486 1.486 238 2HH2 ARG 116 2HH2 ARG 116 -0.811 3.060 3.060 239 H PHE 117 H PHE 117 -0.459 1.667 1.667 240 HA PHE 117 HA PHE 117 -0.109 4.242 4.242 241 1HB PHE 117 2HB PHE 117 -0.579 2.939 2.939 242 2HB PHE 117 1HB PHE 117 0.154 4.556 4.556 243 HD1 PHE 117 1HD PHE 117 1.509 2.649 2.649 244 HD2 PHE 117 2HD PHE 117 1.321 3.035 3.035 245 HE1 PHE 117 1HE PHE 117 3.839 1.868 1.868 246 HE2 PHE 117 2HE PHE 117 3.690 2.171 2.171 247 HZ PHE 117 HZ PHE 117 4.946 1.635 1.635 248 H LEU 118 H LEU 118 -2.747 2.881 2.881 249 HA LEU 118 HA LEU 118 -4.204 5.252 5.252 250 1HB LEU 118 2HB LEU 118 -4.543 2.319 2.319 251 2HB LEU 118 1HB LEU 118 -5.950 3.441 3.441 252 HG LEU 118 HG LEU 118 -3.389 4.537 4.537 253 1HD1 LEU 118 3HD1 LEU 118 -3.675 1.854 1.854 254 2HD1 LEU 118 2HD1 LEU 118 -4.372 2.773 2.773 255 3HD1 LEU 118 1HD1 LEU 118 -2.693 3.171 3.171 256 1HD2 LEU 118 2HD2 LEU 118 -5.783 5.368 5.368 257 2HD2 LEU 118 1HD2 LEU 118 -4.784 5.306 5.306 258 3HD2 LEU 118 3HD2 LEU 118 -6.075 4.062 4.062 259 H GLU 119 H GLU 119 -4.139 3.009 3.009 260 HA GLU 119 HA GLU 119 -6.663 3.579 3.579 261 1HB GLU 119 2HB GLU 119 -5.352 1.451 1.451 262 2HB GLU 119 1HB GLU 119 -4.205 2.345 2.345 263 1HG GLU 119 2HG GLU 119 -7.238 2.100 2.100 264 2HG GLU 119 1HG GLU 119 -6.041 0.854 0.854 265 H GLU 120 H GLU 120 -3.299 4.774 4.774 266 HA GLU 120 HA GLU 120 -3.871 6.606 6.606 267 1HB GLU 120 2HB GLU 120 -1.820 7.055 7.055 268 2HB GLU 120 1HB GLU 120 -1.882 7.871 7.871 269 1HG GLU 120 2HG GLU 120 -1.397 5.565 5.565 270 2HG GLU 120 1HG GLU 120 -1.062 4.976 4.976 271 H GLY 121 H GLY 121 -4.485 6.484 6.484 272 1HA GLY 121 2HA GLY 121 -5.657 7.810 7.810 273 2HA GLY 121 1HA GLY 121 -5.635 9.094 9.094 274 H ASP 122 H ASP 122 -3.403 7.116 7.116 275 HA ASP 122 HA ASP 122 -2.070 9.610 9.610 276 1HB ASP 122 2HB ASP 122 -0.728 6.868 6.868 277 2HB ASP 122 1HB ASP 122 0.039 8.470 8.470 278 H LYS 123 H LYS 123 -1.200 9.147 9.147 279 HA LYS 123 HA LYS 123 -3.013 7.335 7.335 280 1HB LYS 123 2HB LYS 123 -3.295 9.725 9.725 281 2HB LYS 123 1HB LYS 123 -1.505 9.885 9.885 282 1HG LYS 123 2HG LYS 123 -2.362 7.776 7.776 283 2HG LYS 123 1HG LYS 123 -3.136 9.355 9.355 284 1HD LYS 123 2HD LYS 123 -0.112 8.830 8.830 285 2HD LYS 123 1HD LYS 123 -1.084 9.333 9.333 286 1HE LYS 123 2HE LYS 123 -1.786 11.369 11.369 287 2HE LYS 123 1HE LYS 123 -0.231 10.886 10.886 288 1HZ LYS 123 1HZ LYS 123 -0.522 11.506 11.506 289 2HZ LYS 123 3HZ LYS 123 0.115 12.563 12.563 290 3HZ LYS 123 2HZ LYS 123 0.915 11.109 11.109 291 H ALA 124 H ALA 124 -1.891 5.546 5.546 292 HA ALA 124 HA ALA 124 1.005 5.830 5.830 293 1HB ALA 124 1HB ALA 124 -0.108 3.810 3.810 294 2HB ALA 124 3HB ALA 124 -0.698 3.361 3.361 295 3HB ALA 124 2HB ALA 124 1.080 3.401 3.401 296 H LYS 125 H LYS 125 2.250 5.432 5.432 297 HA LYS 125 HA LYS 125 0.336 4.912 4.912 298 1HB LYS 125 2HB LYS 125 3.212 6.119 6.119 299 2HB LYS 125 1HB LYS 125 2.081 5.936 5.936 300 1HG LYS 125 2HG LYS 125 0.517 7.528 7.528 301 2HG LYS 125 1HG LYS 125 1.965 7.910 7.910 302 1HD LYS 125 2HD LYS 125 1.592 8.348 8.348 303 2HD LYS 125 1HD LYS 125 1.613 9.606 9.606 304 1HE LYS 125 2HE LYS 125 4.028 8.984 8.984 305 2HE LYS 125 1HE LYS 125 3.972 7.826 7.826 306 1HZ LYS 125 3HZ LYS 125 3.477 10.752 10.752 307 2HZ LYS 125 2HZ LYS 125 4.893 9.946 9.946 308 3HZ LYS 125 1HZ LYS 125 3.434 9.663 9.663 309 H ILE 126 H ILE 126 0.773 2.885 2.885 310 HA ILE 126 HA ILE 126 3.170 1.501 1.501 311 HB ILE 126 HB ILE 126 1.299 0.852 0.852 312 1HG1 ILE 126 2HG1 ILE 126 -0.238 1.240 1.240 313 2HG1 ILE 126 1HG1 ILE 126 -0.010 -0.537 -0.537 314 1HG2 ILE 126 3HG2 ILE 126 3.504 -0.444 -0.444 315 2HG2 ILE 126 2HG2 ILE 126 2.997 -0.765 -0.765 316 3HG2 ILE 126 1HG2 ILE 126 2.050 -1.431 -1.431 317 1HD1 ILE 126 2HD1 ILE 126 1.449 -0.397 -0.397 318 2HD1 ILE 126 1HD1 ILE 126 1.120 1.379 1.379 319 3HD1 ILE 126 3HD1 ILE 126 -0.238 0.207 0.207 320 H THR 127 H THR 127 5.034 1.590 1.590 321 HA THR 127 HA THR 127 4.912 2.687 2.687 322 HB THR 127 HB THR 127 7.294 2.008 2.008 323 HG1 THR 127 1HG THR 127 6.044 3.563 3.563 324 1HG2 THR 127 2HG2 THR 127 6.858 3.621 3.621 325 2HG2 THR 127 1HG2 THR 127 8.351 3.792 3.792 326 3HG2 THR 127 3HG2 THR 127 7.959 2.204 2.204 327 H LEU 128 H LEU 128 4.861 1.189 1.189 328 HA LEU 128 HA LEU 128 5.683 -1.550 -1.550 329 1HB LEU 128 2HB LEU 128 4.331 -0.156 -0.156 330 2HB LEU 128 1HB LEU 128 5.840 -0.804 -0.804 331 HG LEU 128 HG LEU 128 3.902 -2.309 -2.309 332 1HD1 LEU 128 1HD1 LEU 128 5.783 -3.526 -3.526 333 2HD1 LEU 128 3HD1 LEU 128 4.540 -4.451 -4.451 334 3HD1 LEU 128 2HD1 LEU 128 5.891 -3.616 -3.616 335 1HD2 LEU 128 3HD2 LEU 128 2.584 -1.238 -1.238 336 2HD2 LEU 128 2HD2 LEU 128 2.478 -3.043 -3.043 337 3HD2 LEU 128 1HD2 LEU 128 3.434 -2.010 -2.010 338 H ARG 129 H ARG 129 7.594 -2.420 -2.420 339 HA ARG 129 HA ARG 129 9.364 -0.604 -0.604 340 1HB ARG 129 2HB ARG 129 10.076 -0.290 -0.290 341 2HB ARG 129 1HB ARG 129 9.965 -2.063 -2.063 342 1HG ARG 129 2HG ARG 129 11.927 -2.468 -2.468 343 2HG ARG 129 1HG ARG 129 11.705 -0.927 -0.927 344 1HD ARG 129 2HD ARG 129 12.546 0.383 0.383 345 2HD ARG 129 1HD ARG 129 12.494 -1.076 -1.076 346 HE ARG 129 HE ARG 129 14.172 -1.806 -1.806 347 1HH1 ARG 129 1HH2 ARG 129 14.015 0.739 0.739 348 2HH1 ARG 129 2HH2 ARG 129 15.732 0.905 0.905 349 1HH2 ARG 129 1HH1 ARG 129 16.503 -1.577 -1.577 350 2HH2 ARG 129 2HH1 ARG 129 17.169 -0.434 -0.434 351 H PHE 130 H PHE 130 9.112 -1.645 -1.645 352 HA PHE 130 HA PHE 130 8.315 -4.369 -4.369 353 1HB PHE 130 2HB PHE 130 9.266 -2.194 -2.194 354 2HB PHE 130 1HB PHE 130 8.621 -3.863 -3.863 355 HD1 PHE 130 1HD PHE 130 6.532 -4.671 -4.671 356 HD2 PHE 130 2HD PHE 130 7.770 -0.565 -0.565 357 HE1 PHE 130 1HE PHE 130 4.224 -3.954 -3.954 358 HE2 PHE 130 2HE PHE 130 5.394 0.114 0.114 359 HZ PHE 130 HZ PHE 130 3.590 -1.626 -1.626 360 H ARG 131 H ARG 131 9.566 -5.633 -5.633 361 HA ARG 131 HA ARG 131 12.178 -6.293 -6.293 362 1HB ARG 131 2HB ARG 131 10.696 -7.844 -7.844 363 2HB ARG 131 1HB ARG 131 10.770 -6.748 -6.748 364 1HG ARG 131 2HG ARG 131 12.248 -8.683 -8.683 365 2HG ARG 131 1HG ARG 131 13.256 -7.205 -7.205 366 1HD ARG 131 2HD ARG 131 13.847 -7.757 -7.757 367 2HD ARG 131 1HD ARG 131 12.763 -9.219 -9.219 368 HE ARG 131 HE ARG 131 14.540 -9.416 -9.416 369 1HH1 ARG 131 1HH1 ARG 131 14.690 -9.243 -9.243 370 2HH1 ARG 131 2HH1 ARG 131 16.119 -10.213 -10.213 371 1HH2 ARG 131 1HH2 ARG 131 16.482 -10.734 -10.734 372 2HH2 ARG 131 2HH2 ARG 131 17.146 -11.075 -11.075 373 H GLY 132 H GLY 132 11.226 -5.104 -5.104 374 1HA GLY 132 2HA GLY 132 11.410 -2.553 -2.553 375 2HA GLY 132 1HA GLY 132 13.111 -2.829 -2.829 376 H ARG 133 H ARG 133 10.572 -1.393 -1.393 377 HA ARG 133 HA ARG 133 11.832 -1.829 -1.829 378 1HB ARG 133 2HB ARG 133 9.367 -3.140 -3.140 379 2HB ARG 133 1HB ARG 133 8.932 -1.564 -1.564 380 1HG ARG 133 2HG ARG 133 10.711 -1.968 -1.968 381 2HG ARG 133 1HG ARG 133 10.953 -3.611 -3.611 382 1HD ARG 133 2HD ARG 133 8.304 -2.508 -2.508 383 2HD ARG 133 1HD ARG 133 9.418 -3.712 -3.712 384 HE ARG 133 HE ARG 133 8.637 -4.611 -4.611 385 1HH1 ARG 133 1HH1 ARG 133 7.457 -4.158 -4.158 386 2HH1 ARG 133 2HH1 ARG 133 6.286 -5.430 -5.430 387 1HH2 ARG 133 1HH2 ARG 133 7.045 -6.347 -6.347 388 2HH2 ARG 133 2HH2 ARG 133 6.050 -6.692 -6.692 389 H GLU 134 H GLU 134 10.763 -0.058 -0.058 390 HA GLU 134 HA GLU 134 11.129 2.404 2.404 391 1HB GLU 134 2HB GLU 134 11.695 1.981 1.981 392 2HB GLU 134 1HB GLU 134 9.943 1.881 1.881 393 1HG GLU 134 2HG GLU 134 9.652 4.285 4.285 394 2HG GLU 134 1HG GLU 134 11.398 4.347 4.347 395 H MET 135 H MET 135 8.210 1.044 1.044 396 HA MET 135 HA MET 135 6.669 2.092 2.092 397 1HB MET 135 2HB MET 135 5.737 1.325 1.325 398 2HB MET 135 1HB MET 135 4.624 1.537 1.537 399 1HG MET 135 2HG MET 135 6.438 3.675 3.675 400 2HG MET 135 1HG MET 135 4.668 3.528 3.528 401 1HE MET 135 1HE MET 135 2.880 3.940 3.940 402 2HE MET 135 3HE MET 135 3.561 2.840 2.840 403 3HE MET 135 2HE MET 135 3.122 4.523 4.523 404 H ALA 136 H ALA 136 6.858 0.360 0.360 405 HA ALA 136 HA ALA 136 7.415 -2.185 -2.185 406 1HB ALA 136 3HB ALA 136 6.438 -0.903 -0.903 407 2HB ALA 136 2HB ALA 136 6.815 -2.640 -2.640 408 3HB ALA 136 1HB ALA 136 8.105 -1.425 -1.425 409 H HIS 137 H HIS 137 6.346 -4.045 -4.045 410 HA HIS 137 HA HIS 137 4.031 -5.178 -5.178 411 1HB HIS 137 2HB HIS 137 5.335 -4.878 -4.878 412 2HB HIS 137 1HB HIS 137 4.552 -6.340 -6.340 413 HD1 HIS 137 1HD HIS 137 6.139 -7.426 -7.426 414 HD2 HIS 137 2HD HIS 137 7.879 -4.284 -4.284 415 HE1 HIS 137 1HE HIS 137 8.636 -7.401 -7.401 416 H GLN 138 H GLN 138 1.878 -4.511 -4.511 417 HA GLN 138 HA GLN 138 1.297 -2.944 -2.944 418 1HB GLN 138 2HB GLN 138 -0.403 -3.304 -3.304 419 2HB GLN 138 1HB GLN 138 -0.968 -2.511 -2.511 420 1HG GLN 138 2HG GLN 138 0.794 -0.755 -0.755 421 2HG GLN 138 1HG GLN 138 1.365 -1.515 -1.515 422 1HE2 GLN 138 1HE2 GLN 138 0.611 -0.518 -0.518 423 2HE2 GLN 138 2HE2 GLN 138 -0.952 0.204 0.204 424 H GLN 139 H GLN 139 1.830 -5.859 -5.859 425 HA GLN 139 HA GLN 139 -0.603 -7.108 -7.108 426 1HB GLN 139 2HB GLN 139 2.087 -8.548 -8.548 427 2HB GLN 139 1HB GLN 139 0.447 -9.218 -9.218 428 1HG GLN 139 2HG GLN 139 0.145 -7.708 -7.708 429 2HG GLN 139 1HG GLN 139 1.862 -7.161 -7.161 430 1HE2 GLN 139 1HE2 GLN 139 3.580 -8.798 -8.798 431 2HE2 GLN 139 2HE2 GLN 139 3.436 -10.215 -10.215 432 H ILE 140 H ILE 140 2.902 -6.943 -6.943 433 HA ILE 140 HA ILE 140 3.181 -7.972 -7.972 434 HB ILE 140 HB ILE 140 4.683 -6.078 -6.078 435 1HG1 ILE 140 2HG1 ILE 140 4.943 -9.026 -9.026 436 2HG1 ILE 140 1HG1 ILE 140 4.381 -8.470 -8.470 437 1HG2 ILE 140 3HG2 ILE 140 5.183 -7.287 -7.287 438 2HG2 ILE 140 2HG2 ILE 140 6.484 -6.569 -6.569 439 3HG2 ILE 140 1HG2 ILE 140 5.177 -5.531 -5.531 440 1HD1 ILE 140 1HD1 ILE 140 6.593 -7.351 -7.351 441 2HD1 ILE 140 3HD1 ILE 140 7.208 -8.103 -8.103 442 3HD1 ILE 140 2HD1 ILE 140 6.687 -9.144 -9.144 443 H GLY 141 H GLY 141 2.216 -4.693 -4.693 444 1HA GLY 141 2HA GLY 141 2.251 -3.821 -3.821 445 2HA GLY 141 1HA GLY 141 1.472 -3.008 -3.008 446 H MET 142 H MET 142 -0.543 -4.602 -4.602 447 HA MET 142 HA MET 142 -2.140 -3.715 -3.715 448 1HB MET 142 2HB MET 142 -3.737 -3.326 -3.326 449 2HB MET 142 1HB MET 142 -2.245 -3.215 -3.215 450 1HG MET 142 2HG MET 142 -2.788 -5.724 -5.724 451 2HG MET 142 1HG MET 142 -4.257 -5.423 -5.423 452 1HE MET 142 1HE MET 142 -6.095 -3.766 -3.766 453 2HE MET 142 3HE MET 142 -5.058 -2.324 -2.324 454 3HE MET 142 2HE MET 142 -6.274 -2.810 -2.810 455 H GLU 143 H GLU 143 -1.027 -6.969 -6.969 456 HA GLU 143 HA GLU 143 -3.369 -7.930 -7.930 457 1HB GLU 143 2HB GLU 143 -1.206 -9.415 -9.415 458 2HB GLU 143 1HB GLU 143 -0.650 -9.054 -9.054 459 1HG GLU 143 2HG GLU 143 -1.718 -11.049 -11.049 460 2HG GLU 143 1HG GLU 143 -3.102 -10.000 -10.000 461 H VAL 144 H VAL 144 -0.296 -6.651 -6.651 462 HA VAL 144 HA VAL 144 -0.754 -7.448 -7.448 463 HB VAL 144 HB VAL 144 1.277 -5.469 -5.469 464 1HG1 VAL 144 1HG1 VAL 144 0.816 -7.175 -7.175 465 2HG1 VAL 144 3HG1 VAL 144 2.439 -6.579 -6.579 466 3HG1 VAL 144 2HG1 VAL 144 1.122 -5.399 -5.399 467 1HG2 VAL 144 3HG2 VAL 144 0.729 -8.462 -8.462 468 2HG2 VAL 144 2HG2 VAL 144 1.284 -7.541 -7.541 469 3HG2 VAL 144 1HG2 VAL 144 2.462 -7.863 -7.863 470 H LEU 145 H LEU 145 -0.550 -4.254 -4.254 471 HA LEU 145 HA LEU 145 -1.355 -2.702 -2.702 472 1HB LEU 145 2HB LEU 145 -1.882 -2.560 -2.560 473 2HB LEU 145 1HB LEU 145 -2.173 -1.155 -1.155 474 HG LEU 145 HG LEU 145 0.470 -2.607 -2.607 475 1HD1 LEU 145 2HD1 LEU 145 -0.916 -0.137 -0.137 476 2HD1 LEU 145 1HD1 LEU 145 0.872 -0.034 -0.034 477 3HD1 LEU 145 3HD1 LEU 145 0.156 -1.324 -1.324 478 1HD2 LEU 145 1HD2 LEU 145 -0.230 -0.536 -0.536 479 2HD2 LEU 145 3HD2 LEU 145 0.589 -2.102 -2.102 480 3HD2 LEU 145 2HD2 LEU 145 1.473 -0.743 -0.743 481 H ASN 146 H ASN 146 -3.413 -3.968 -3.968 482 HA ASN 146 HA ASN 146 -5.929 -3.092 -3.092 483 1HB ASN 146 2HB ASN 146 -4.683 -4.246 -4.246 484 2HB ASN 146 1HB ASN 146 -5.613 -5.674 -5.674 485 1HD2 ASN 146 1HD2 ASN 146 -6.386 -5.995 -5.995 486 2HD2 ASN 146 2HD2 ASN 146 -7.430 -4.986 -4.986 487 H ARG 147 H ARG 147 -4.041 -6.126 -6.126 488 HA ARG 147 HA ARG 147 -6.300 -6.963 -6.963 489 1HB ARG 147 2HB ARG 147 -5.014 -8.506 -8.506 490 2HB ARG 147 1HB ARG 147 -3.464 -7.779 -7.779 491 1HG ARG 147 2HG ARG 147 -3.554 -8.948 -8.948 492 2HG ARG 147 1HG ARG 147 -5.388 -8.989 -8.989 493 1HD ARG 147 2HD ARG 147 -4.303 -11.307 -11.307 494 2HD ARG 147 1HD ARG 147 -5.129 -10.770 -10.770 495 HE ARG 147 HE ARG 147 -2.495 -9.732 -9.732 496 1HH1 ARG 147 1HH2 ARG 147 -4.049 -12.937 -12.937 497 2HH1 ARG 147 2HH2 ARG 147 -2.679 -13.797 -13.797 498 1HH2 ARG 147 1HH1 ARG 147 -0.648 -10.904 -10.904 499 2HH2 ARG 147 2HH1 ARG 147 -0.716 -12.626 -12.626 500 H VAL 148 H VAL 148 -3.640 -4.605 -4.605 501 HA VAL 148 HA VAL 148 -3.515 -5.238 -5.238 502 HB VAL 148 HB VAL 148 -2.995 -2.541 -2.541 503 1HG1 VAL 148 2HG1 VAL 148 -2.981 -3.490 -3.490 504 2HG1 VAL 148 1HG1 VAL 148 -1.477 -4.340 -4.340 505 3HG1 VAL 148 3HG1 VAL 148 -1.543 -2.522 -2.522 506 1HG2 VAL 148 2HG2 VAL 148 -1.096 -4.881 -4.881 507 2HG2 VAL 148 1HG2 VAL 148 -1.888 -3.921 -3.921 508 3HG2 VAL 148 3HG2 VAL 148 -0.689 -3.125 -3.125 509 H LYS 149 H LYS 149 -5.193 -2.797 -2.797 510 HA LYS 149 HA LYS 149 -6.606 -1.346 -1.346 511 1HB LYS 149 2HB LYS 149 -6.515 -1.336 -1.336 512 2HB LYS 149 1HB LYS 149 -7.538 -2.794 -2.794 513 1HG LYS 149 2HG LYS 149 -9.382 -1.839 -1.839 514 2HG LYS 149 1HG LYS 149 -8.618 -0.239 -0.239 515 1HD LYS 149 2HD LYS 149 -8.545 -1.341 -1.341 516 2HD LYS 149 1HD LYS 149 -10.184 -0.691 -0.691 517 1HE LYS 149 2HE LYS 149 -8.848 1.546 1.546 518 2HE LYS 149 1HE LYS 149 -7.644 0.669 0.669 519 1HZ LYS 149 2HZ LYS 149 -9.356 0.268 0.268 520 2HZ LYS 149 1HZ LYS 149 -10.516 1.060 1.060 521 3HZ LYS 149 3HZ LYS 149 -9.206 1.930 1.930 522 H ASP 150 H ASP 150 -7.481 -4.555 -4.555 523 HA ASP 150 HA ASP 150 -10.060 -4.494 -4.494 524 1HB ASP 150 2HB ASP 150 -8.258 -6.291 -6.291 525 2HB ASP 150 1HB ASP 150 -9.651 -6.977 -6.977 526 H ASP 151 H ASP 151 -6.975 -6.194 -6.194 527 HA ASP 151 HA ASP 151 -8.602 -7.320 -7.320 528 1HB ASP 151 2HB ASP 151 -6.400 -8.268 -8.268 529 2HB ASP 151 1HB ASP 151 -5.568 -6.900 -6.900 530 H LEU 152 H LEU 152 -6.969 -4.094 -4.094 531 HA LEU 152 HA LEU 152 -7.235 -3.818 -3.818 532 1HB LEU 152 2HB LEU 152 -6.250 -2.382 -2.382 533 2HB LEU 152 1HB LEU 152 -7.266 -1.376 -1.376 534 HG LEU 152 HG LEU 152 -5.178 -3.205 -3.205 535 1HD1 LEU 152 1HD1 LEU 152 -4.226 -2.215 -2.215 536 2HD1 LEU 152 3HD1 LEU 152 -4.495 -0.547 -0.547 537 3HD1 LEU 152 2HD1 LEU 152 -3.347 -1.667 -1.667 538 1HD2 LEU 152 1HD2 LEU 152 -6.361 -0.480 -0.480 539 2HD2 LEU 152 3HD2 LEU 152 -6.636 -2.084 -2.084 540 3HD2 LEU 152 2HD2 LEU 152 -5.035 -1.288 -1.288 541 H GLN 153 H GLN 153 -9.144 -3.000 -3.000 542 HA GLN 153 HA GLN 153 -10.490 -1.107 -1.107 543 1HB GLN 153 2HB GLN 153 -10.614 -3.412 -3.412 544 2HB GLN 153 1HB GLN 153 -12.087 -3.624 -3.624 545 1HG GLN 153 2HG GLN 153 -12.901 -1.393 -1.393 546 2HG GLN 153 1HG GLN 153 -11.213 -1.278 -1.278 547 1HE2 GLN 153 1HE2 GLN 153 -11.740 -1.331 -1.331 548 2HE2 GLN 153 2HE2 GLN 153 -12.385 -2.722 -2.722 549 H GLU 154 H GLU 154 -10.960 -3.201 -3.201 550 HA GLU 154 HA GLU 154 -13.361 -2.414 -2.414 551 1HB GLU 154 2HB GLU 154 -10.819 -2.798 -2.798 552 2HB GLU 154 1HB GLU 154 -12.473 -3.314 -3.314 553 1HG GLU 154 2HG GLU 154 -12.173 -5.028 -5.028 554 2HG GLU 154 1HG GLU 154 -10.460 -4.414 -4.414 555 H LEU 155 H LEU 155 -10.188 -1.163 -1.163 556 HA LEU 155 HA LEU 155 -10.890 0.882 0.882 557 1HB LEU 155 2HB LEU 155 -9.673 -1.176 -1.176 558 2HB LEU 155 1HB LEU 155 -8.496 -0.922 -0.922 559 HG LEU 155 HG LEU 155 -7.583 -0.727 -0.727 560 1HD1 LEU 155 2HD1 LEU 155 -6.532 0.637 0.637 561 2HD1 LEU 155 1HD1 LEU 155 -7.450 2.098 2.098 562 3HD1 LEU 155 3HD1 LEU 155 -6.253 1.310 1.310 563 1HD2 LEU 155 1HD2 LEU 155 -9.366 -0.001 -0.001 564 2HD2 LEU 155 3HD2 LEU 155 -7.735 0.724 0.724 565 3HD2 LEU 155 2HD2 LEU 155 -9.063 1.722 1.722 566 H ALA 156 H ALA 156 -8.783 -0.018 -0.018 567 HA ALA 156 HA ALA 156 -8.075 2.906 2.906 568 1HB ALA 156 1HB ALA 156 -6.571 0.506 0.506 569 2HB ALA 156 3HB ALA 156 -6.208 2.221 2.221 570 3HB ALA 156 2HB ALA 156 -5.983 1.531 1.531 571 H VAL 157 H VAL 157 -8.755 3.712 3.712 572 HA VAL 157 HA VAL 157 -8.207 1.443 1.443 573 HB VAL 157 HB VAL 157 -9.666 2.538 2.538 574 1HG1 VAL 157 2HG1 VAL 157 -10.999 2.169 2.169 575 2HG1 VAL 157 1HG1 VAL 157 -11.896 2.321 2.321 576 3HG1 VAL 157 3HG1 VAL 157 -10.770 0.918 0.918 577 1HG2 VAL 157 3HG2 VAL 157 -9.193 4.991 4.991 578 2HG2 VAL 157 2HG2 VAL 157 -10.905 4.614 4.614 579 3HG2 VAL 157 1HG2 VAL 157 -10.337 4.575 4.575 580 H VAL 158 H VAL 158 -8.006 2.112 2.112 581 HA VAL 158 HA VAL 158 -5.634 3.739 3.739 582 HB VAL 158 HB VAL 158 -7.227 2.672 2.672 583 1HG1 VAL 158 2HG1 VAL 158 -5.360 4.175 4.175 584 2HG1 VAL 158 1HG1 VAL 158 -4.293 3.129 3.129 585 3HG1 VAL 158 3HG1 VAL 158 -5.057 2.483 2.483 586 1HG2 VAL 158 3HG2 VAL 158 -5.048 1.121 1.121 587 2HG2 VAL 158 2HG2 VAL 158 -6.799 0.710 0.710 588 3HG2 VAL 158 1HG2 VAL 158 -5.836 0.531 0.531 589 H GLU 159 H GLU 159 -5.648 5.649 5.649 590 HA GLU 159 HA GLU 159 -8.045 7.175 7.175 591 1HB GLU 159 2HB GLU 159 -5.817 7.984 7.984 592 2HB GLU 159 1HB GLU 159 -5.249 7.664 7.664 593 1HG GLU 159 2HG GLU 159 -5.654 10.132 10.132 594 2HG GLU 159 1HG GLU 159 -6.773 9.541 9.541 595 H SER 160 H SER 160 -5.767 5.649 5.649 596 HA SER 160 HA SER 160 -7.542 6.137 6.137 597 1HB SER 160 2HB SER 160 -5.625 7.949 7.949 598 2HB SER 160 1HB SER 160 -4.741 6.556 6.556 599 HG SER 160 HG SER 160 -7.151 7.754 7.754 600 H PHE 161 H PHE 161 -7.392 4.397 4.397 601 HA PHE 161 HA PHE 161 -5.108 2.575 2.575 602 1HB PHE 161 2HB PHE 161 -7.536 1.629 1.629 603 2HB PHE 161 1HB PHE 161 -7.528 1.528 1.528 604 HD1 PHE 161 1HD PHE 161 -5.659 0.420 0.420 605 HD2 PHE 161 2HD PHE 161 -6.429 0.045 0.045 606 HE1 PHE 161 1HE PHE 161 -3.748 -1.191 -1.191 607 HE2 PHE 161 2HE PHE 161 -4.666 -1.306 -1.306 608 HZ PHE 161 HZ PHE 161 -3.312 -2.143 -2.143 609 HA PRO 162 HA PRO 162 -5.307 3.786 3.786 610 1HB PRO 162 2HB PRO 162 -3.162 5.520 5.520 611 2HB PRO 162 1HB PRO 162 -4.588 5.902 5.902 612 1HG PRO 162 2HG PRO 162 -1.862 5.063 5.063 613 2HG PRO 162 1HG PRO 162 -3.205 5.897 5.897 614 1HD PRO 162 2HD PRO 162 -2.541 2.997 2.997 615 2HD PRO 162 1HD PRO 162 -3.582 3.786 3.786 616 H THR 163 H THR 163 -2.003 4.055 4.055 617 HA THR 163 HA THR 163 -1.801 1.761 1.761 618 HB THR 163 HB THR 163 -3.454 4.163 4.163 619 HG1 THR 163 1HG THR 163 -4.244 2.772 2.772 620 1HG2 THR 163 2HG2 THR 163 -1.315 3.288 3.288 621 2HG2 THR 163 1HG2 THR 163 -2.754 4.304 4.304 622 3HG2 THR 163 3HG2 THR 163 -1.614 4.943 4.943 623 H LYS 164 H LYS 164 -0.941 5.183 5.183 624 HA LYS 164 HA LYS 164 1.139 5.051 5.051 625 1HB LYS 164 2HB LYS 164 -0.191 7.120 7.120 626 2HB LYS 164 1HB LYS 164 0.510 7.268 7.268 627 1HG LYS 164 2HG LYS 164 2.788 7.580 7.580 628 2HG LYS 164 1HG LYS 164 2.162 7.197 7.197 629 1HD LYS 164 2HD LYS 164 0.782 9.262 9.262 630 2HD LYS 164 1HD LYS 164 1.325 9.616 9.616 631 1HE LYS 164 2HE LYS 164 3.696 9.822 9.822 632 2HE LYS 164 1HE LYS 164 3.169 9.450 9.450 633 1HZ LYS 164 2HZ LYS 164 2.258 11.749 11.749 634 2HZ LYS 164 1HZ LYS 164 3.398 11.797 11.797 635 3HZ LYS 164 3HZ LYS 164 1.779 11.404 11.404 636 H ILE 165 H ILE 165 2.788 3.800 3.800 637 HA ILE 165 HA ILE 165 4.198 3.862 3.862 638 HB ILE 165 HB ILE 165 5.156 2.879 2.879 639 1HG1 ILE 165 2HG1 ILE 165 2.970 1.765 1.765 640 2HG1 ILE 165 1HG1 ILE 165 2.941 1.956 1.956 641 1HG2 ILE 165 3HG2 ILE 165 6.746 2.867 2.867 642 2HG2 ILE 165 2HG2 ILE 165 5.575 1.855 1.855 643 3HG2 ILE 165 1HG2 ILE 165 6.384 1.215 1.215 644 1HD1 ILE 165 1HD1 ILE 165 4.629 0.094 0.094 645 2HD1 ILE 165 3HD1 ILE 165 4.485 -0.158 -0.158 646 3HD1 ILE 165 2HD1 ILE 165 3.055 -0.420 -0.420 647 H GLU 166 H GLU 166 6.125 4.865 4.865 648 HA GLU 166 HA GLU 166 6.919 6.833 6.833 649 1HB GLU 166 2HB GLU 166 7.011 7.188 7.188 650 2HB GLU 166 1HB GLU 166 7.807 8.280 8.280 651 1HG GLU 166 2HG GLU 166 5.549 8.818 8.818 652 2HG GLU 166 1HG GLU 166 4.764 7.804 7.804 653 H GLY 167 H GLY 167 8.585 5.666 5.666 654 1HA GLY 167 2HA GLY 167 10.664 4.732 4.732 655 2HA GLY 167 1HA GLY 167 10.743 4.973 4.973 656 H ARG 168 H ARG 168 11.431 3.034 3.034 657 HA ARG 168 HA ARG 168 9.983 0.694 0.694 658 1HB ARG 168 2HB ARG 168 11.912 -0.562 -0.562 659 2HB ARG 168 1HB ARG 168 12.374 0.482 0.482 660 1HG ARG 168 2HG ARG 168 13.248 2.224 2.224 661 2HG ARG 168 1HG ARG 168 12.625 1.363 1.363 662 1HD ARG 168 2HD ARG 168 14.168 -0.614 -0.614 663 2HD ARG 168 1HD ARG 168 14.877 0.434 0.434 664 HE ARG 168 HE ARG 168 15.919 1.753 1.753 665 1HH1 ARG 168 1HH2 ARG 168 13.538 -0.462 -0.462 666 2HH1 ARG 168 2HH2 ARG 168 14.068 -0.166 -0.166 667 1HH2 ARG 168 1HH1 ARG 168 16.613 2.144 2.144 668 2HH2 ARG 168 2HH1 ARG 168 15.831 1.333 1.333 669 H GLN 169 H GLN 169 8.566 2.376 2.376 670 HA GLN 169 HA GLN 169 8.130 0.706 0.706 671 1HB GLN 169 2HB GLN 169 9.363 3.437 3.437 672 2HB GLN 169 1HB GLN 169 8.286 2.919 2.919 673 1HG GLN 169 2HG GLN 169 9.944 1.256 1.256 674 2HG GLN 169 1HG GLN 169 10.962 1.564 1.564 675 1HE2 GLN 169 1HE2 GLN 169 9.176 3.911 3.911 676 2HE2 GLN 169 2HE2 GLN 169 10.555 4.786 4.786 677 H MET 170 H MET 170 5.978 1.093 1.093 678 HA MET 170 HA MET 170 4.621 3.365 3.365 679 1HB MET 170 2HB MET 170 3.778 1.196 1.196 680 2HB MET 170 1HB MET 170 3.364 0.581 0.581 681 1HG MET 170 2HG MET 170 1.600 2.116 2.116 682 2HG MET 170 1HG MET 170 2.208 3.170 3.170 683 1HE MET 170 3HE MET 170 1.396 -0.685 -0.685 684 2HE MET 170 2HE MET 170 -0.276 -0.049 -0.049 685 3HE MET 170 1HE MET 170 0.128 -0.910 -0.910 686 H ILE 171 H ILE 171 3.911 4.838 4.838 687 HA ILE 171 HA ILE 171 3.313 3.827 3.827 688 HB ILE 171 HB ILE 171 2.674 6.549 6.549 689 1HG1 ILE 171 2HG1 ILE 171 5.163 5.722 5.722 690 2HG1 ILE 171 1HG1 ILE 171 4.697 7.342 7.342 691 1HG2 ILE 171 3HG2 ILE 171 2.421 5.248 5.248 692 2HG2 ILE 171 2HG2 ILE 171 2.606 7.059 7.059 693 3HG2 ILE 171 1HG2 ILE 171 1.178 6.273 6.273 694 1HD1 ILE 171 2HD1 ILE 171 4.732 4.696 4.696 695 2HD1 ILE 171 1HD1 ILE 171 6.089 5.889 5.889 696 3HD1 ILE 171 3HD1 ILE 171 4.459 6.282 6.282 697 H MET 172 H MET 172 1.482 2.978 2.978 698 HA MET 172 HA MET 172 -1.160 3.898 3.898 699 1HB MET 172 2HB MET 172 -1.105 1.454 1.454 700 2HB MET 172 1HB MET 172 -0.199 1.443 1.443 701 1HG MET 172 2HG MET 172 -2.864 2.776 2.776 702 2HG MET 172 1HG MET 172 -2.955 1.032 1.032 703 1HE MET 172 3HE MET 172 -3.424 -0.349 -0.349 704 2HE MET 172 2HE MET 172 -1.683 -0.658 -0.658 705 3HE MET 172 1HE MET 172 -2.805 -0.335 -0.335 706 H VAL 173 H VAL 173 -2.064 5.339 5.339 707 HA VAL 173 HA VAL 173 -0.609 5.960 5.960 708 HB VAL 173 HB VAL 173 -3.041 7.337 7.337 709 1HG1 VAL 173 2HG1 VAL 173 -1.294 7.506 7.506 710 2HG1 VAL 173 1HG1 VAL 173 -1.748 9.094 9.094 711 3HG1 VAL 173 3HG1 VAL 173 -3.033 7.988 7.988 712 1HG2 VAL 173 3HG2 VAL 173 0.004 7.811 7.811 713 2HG2 VAL 173 2HG2 VAL 173 -1.102 7.430 7.430 714 3HG2 VAL 173 1HG2 VAL 173 -1.237 9.014 9.014 715 H LEU 174 H LEU 174 -1.410 5.278 5.278 716 HA LEU 174 HA LEU 174 -3.915 3.822 3.822 717 1HB LEU 174 2HB LEU 174 -1.445 2.937 2.937 718 2HB LEU 174 1HB LEU 174 -1.566 3.337 3.337 719 HG LEU 174 HG LEU 174 -2.147 0.946 0.946 720 1HD1 LEU 174 3HD1 LEU 174 -1.867 1.576 1.576 721 2HD1 LEU 174 2HD1 LEU 174 -3.685 1.444 1.444 722 3HD1 LEU 174 1HD1 LEU 174 -2.665 0.051 0.051 723 1HD2 LEU 174 2HD2 LEU 174 -4.227 1.947 1.947 724 2HD2 LEU 174 1HD2 LEU 174 -4.623 0.583 0.583 725 3HD2 LEU 174 3HD2 LEU 174 -4.689 2.323 2.323 726 H ALA 175 H ALA 175 -5.097 5.969 5.969 727 HA ALA 175 HA ALA 175 -4.541 7.117 7.117 728 1HB ALA 175 1HB ALA 175 -5.241 8.322 8.322 729 2HB ALA 175 3HB ALA 175 -6.846 7.437 7.437 730 3HB ALA 175 2HB ALA 175 -6.328 8.796 8.796 731 HA PRO 176 HA PRO 176 -7.749 5.859 5.859 732 1HB PRO 176 2HB PRO 176 -8.774 8.730 8.730 733 2HB PRO 176 1HB PRO 176 -8.505 7.536 7.536 734 1HG PRO 176 2HG PRO 176 -6.641 9.483 9.483 735 2HG PRO 176 1HG PRO 176 -6.103 7.776 7.776 736 1HD PRO 176 2HD PRO 176 -6.316 9.252 9.252 737 2HD PRO 176 1HD PRO 176 -5.087 8.039 8.039 738 H LYS 177 H LYS 177 -9.731 4.890 4.890 739 HA LYS 177 HA LYS 177 -11.330 5.711 5.711 740 1HB LYS 177 2HB LYS 177 -11.088 3.288 3.288 741 2HB LYS 177 1HB LYS 177 -12.042 3.798 3.798 742 1HG LYS 177 2HG LYS 177 -13.983 4.373 4.373 743 2HG LYS 177 1HG LYS 177 -12.959 3.899 3.899 744 1HD LYS 177 2HD LYS 177 -14.580 2.140 2.140 745 2HD LYS 177 1HD LYS 177 -12.890 1.569 1.569 746 1HE LYS 177 2HE LYS 177 -14.434 0.824 0.824 747 2HE LYS 177 1HE LYS 177 -13.087 1.859 1.859 748 1HZ LYS 177 3HZ LYS 177 -15.861 2.760 2.760 749 2HZ LYS 177 2HZ LYS 177 -15.208 2.462 2.462 750 3HZ LYS 177 1HZ LYS 177 -14.600 3.732 3.732 751 H LYS 178 H LYS 178 -13.147 6.834 6.834 752 HA LYS 178 HA LYS 178 -13.744 8.500 8.500 753 1HB LYS 178 2HB LYS 178 -15.029 8.033 8.033 754 2HB LYS 178 1HB LYS 178 -15.765 9.118 9.118 755 1HG LYS 178 2HG LYS 178 -14.603 10.550 10.550 756 2HG LYS 178 1HG LYS 178 -13.604 10.464 10.464 757 1HD LYS 178 2HD LYS 178 -12.028 8.885 8.885 758 2HD LYS 178 1HD LYS 178 -13.110 8.892 8.892 759 1HE LYS 178 2HE LYS 178 -11.167 10.385 10.385 760 2HE LYS 178 1HE LYS 178 -12.672 11.388 11.388 761 1HZ LYS 178 1HZ LYS 178 -12.120 11.823 11.823 762 2HZ LYS 178 3HZ LYS 178 -10.710 10.885 10.885 763 3HZ LYS 178 2HZ LYS 178 -10.865 12.308 12.308 764 H LYS 179 H LYS 179 -14.953 7.911 7.911 765 HA LYS 179 HA LYS 179 -16.293 5.443 5.443 766 1HB LYS 179 2HB LYS 179 -16.575 7.775 7.775 767 2HB LYS 179 1HB LYS 179 -17.065 6.072 6.072 768 1HG LYS 179 2HG LYS 179 -14.188 7.119 7.119 769 2HG LYS 179 1HG LYS 179 -14.953 6.640 6.640 770 1HD LYS 179 2HD LYS 179 -15.242 4.292 4.292 771 2HD LYS 179 1HD LYS 179 -14.317 4.771 4.771 772 1HE LYS 179 2HE LYS 179 -13.247 4.864 4.864 773 2HE LYS 179 1HE LYS 179 -12.848 3.604 3.604 774 1HZ LYS 179 2HZ LYS 179 -12.293 6.516 6.516 775 2HZ LYS 179 1HZ LYS 179 -11.168 5.304 5.304 776 3HZ LYS 179 3HZ LYS 179 -11.899 5.331 5.331 777 H GLN 180 H GLN 180 -18.404 4.923 4.923 778 HA GLN 180 HA GLN 180 -19.994 6.755 6.755 779 1HB GLN 180 2HB GLN 180 -20.782 4.127 4.127 780 2HB GLN 180 1HB GLN 180 -21.788 5.017 5.017 781 1HG GLN 180 2HG GLN 180 -20.033 4.647 4.647 782 2HG GLN 180 1HG GLN 180 -19.022 3.742 3.742 783 1HE2 GLN 180 1HE2 GLN 180 -21.388 3.455 3.455 784 2HE2 GLN 180 2HE2 GLN 180 -22.025 1.894 1.894 Start of MODEL 6 1 HA VAL 90 HA VAL 90 -1.824 17.341 17.341 2 HB VAL 90 HB VAL 90 -3.113 17.347 17.347 3 1HG1 VAL 90 3HG1 VAL 90 -4.322 18.941 18.941 4 2HG1 VAL 90 2HG1 VAL 90 -5.387 17.554 17.554 5 3HG1 VAL 90 1HG1 VAL 90 -5.435 18.156 18.156 6 1HG2 VAL 90 2HG2 VAL 90 -4.906 15.170 15.170 7 2HG2 VAL 90 1HG2 VAL 90 -3.642 14.909 14.909 8 3HG2 VAL 90 3HG2 VAL 90 -5.110 15.856 15.856 9 H ILE 91 H ILE 91 -3.400 15.822 15.822 10 HA ILE 91 HA ILE 91 -2.646 13.049 13.049 11 HB ILE 91 HB ILE 91 -4.214 14.382 14.382 12 1HG1 ILE 91 2HG1 ILE 91 -5.453 14.492 14.492 13 2HG1 ILE 91 1HG1 ILE 91 -6.164 13.203 13.203 14 1HG2 ILE 91 3HG2 ILE 91 -3.539 11.415 11.415 15 2HG2 ILE 91 2HG2 ILE 91 -4.907 11.961 11.961 16 3HG2 ILE 91 1HG2 ILE 91 -3.232 12.410 12.410 17 1HD1 ILE 91 2HD1 ILE 91 -4.830 11.481 11.481 18 2HD1 ILE 91 1HD1 ILE 91 -4.281 12.801 12.801 19 3HD1 ILE 91 3HD1 ILE 91 -6.034 12.397 12.397 20 H GLN 92 H GLN 92 -0.933 12.061 12.061 21 HA GLN 92 HA GLN 92 0.957 13.781 13.781 22 1HB GLN 92 2HB GLN 92 1.455 11.418 11.418 23 2HB GLN 92 1HB GLN 92 2.665 12.649 12.649 24 1HG GLN 92 2HG GLN 92 1.466 14.397 14.397 25 2HG GLN 92 1HG GLN 92 0.120 13.276 13.276 26 1HE2 GLN 92 1HE2 GLN 92 -0.054 12.721 12.721 27 2HE2 GLN 92 2HE2 GLN 92 1.220 12.262 12.262 28 H VAL 93 H VAL 93 2.674 12.474 12.474 29 HA VAL 93 HA VAL 93 1.486 9.953 9.953 30 HB VAL 93 HB VAL 93 3.999 11.409 11.409 31 1HG1 VAL 93 3HG1 VAL 93 2.746 8.622 8.622 32 2HG1 VAL 93 2HG1 VAL 93 3.873 9.333 9.333 33 3HG1 VAL 93 1HG1 VAL 93 4.508 8.926 8.926 34 1HG2 VAL 93 3HG2 VAL 93 1.525 11.931 11.931 35 2HG2 VAL 93 2HG2 VAL 93 2.779 11.447 11.447 36 3HG2 VAL 93 1HG2 VAL 93 1.648 10.199 10.199 37 H LYS 94 H LYS 94 1.848 8.280 8.280 38 HA LYS 94 HA LYS 94 4.791 8.038 8.038 39 1HB LYS 94 2HB LYS 94 2.854 6.069 6.069 40 2HB LYS 94 1HB LYS 94 4.513 6.405 6.405 41 1HG LYS 94 2HG LYS 94 2.136 8.341 8.341 42 2HG LYS 94 1HG LYS 94 2.625 7.217 7.217 43 1HD LYS 94 2HD LYS 94 4.445 9.444 9.444 44 2HD LYS 94 1HD LYS 94 3.404 9.558 9.558 45 1HE LYS 94 2HE LYS 94 4.646 7.669 7.669 46 2HE LYS 94 1HE LYS 94 5.733 7.557 7.557 47 1HZ LYS 94 3HZ LYS 94 5.369 9.940 9.940 48 2HZ LYS 94 2HZ LYS 94 6.686 8.869 8.869 49 3HZ LYS 94 1HZ LYS 94 6.390 9.832 9.832 50 H GLU 95 H GLU 95 5.479 5.647 5.647 51 HA GLU 95 HA GLU 95 4.090 5.012 5.012 52 1HB GLU 95 2HB GLU 95 6.192 6.512 6.512 53 2HB GLU 95 1HB GLU 95 7.019 4.976 4.976 54 1HG GLU 95 2HG GLU 95 6.351 3.994 3.994 55 2HG GLU 95 1HG GLU 95 5.474 5.530 5.530 56 H ILE 96 H ILE 96 4.421 2.815 2.815 57 HA ILE 96 HA ILE 96 6.134 1.100 1.100 58 HB ILE 96 HB ILE 96 3.377 0.914 0.914 59 1HG1 ILE 96 2HG1 ILE 96 3.721 -1.574 -1.574 60 2HG1 ILE 96 1HG1 ILE 96 5.429 -1.387 -1.387 61 1HG2 ILE 96 3HG2 ILE 96 3.065 0.573 0.573 62 2HG2 ILE 96 2HG2 ILE 96 3.924 -1.046 -1.046 63 3HG2 ILE 96 1HG2 ILE 96 2.455 -0.786 -0.786 64 1HD1 ILE 96 1HD1 ILE 96 4.008 0.152 0.152 65 2HD1 ILE 96 3HD1 ILE 96 5.147 -1.226 -1.226 66 3HD1 ILE 96 2HD1 ILE 96 5.745 0.342 0.342 67 H LYS 97 H LYS 97 6.891 -0.714 -0.714 68 HA LYS 97 HA LYS 97 6.216 0.105 0.105 69 1HB LYS 97 2HB LYS 97 8.622 -1.590 -1.590 70 2HB LYS 97 1HB LYS 97 8.000 -1.122 -1.122 71 1HG LYS 97 2HG LYS 97 8.319 1.323 1.323 72 2HG LYS 97 1HG LYS 97 9.222 0.754 0.754 73 1HD LYS 97 2HD LYS 97 9.908 0.191 0.191 74 2HD LYS 97 1HD LYS 97 10.706 1.417 1.417 75 1HE LYS 97 2HE LYS 97 10.805 -1.648 -1.648 76 2HE LYS 97 1HE LYS 97 12.125 -0.610 -0.610 77 1HZ LYS 97 1HZ LYS 97 12.139 0.615 0.615 78 2HZ LYS 97 3HZ LYS 97 10.913 -0.373 -0.373 79 3HZ LYS 97 2HZ LYS 97 12.428 -1.039 -1.039 80 H PHE 98 H PHE 98 5.830 -1.690 -1.690 81 HA PHE 98 HA PHE 98 5.537 -4.247 -4.247 82 1HB PHE 98 2HB PHE 98 3.434 -2.955 -2.955 83 2HB PHE 98 1HB PHE 98 3.674 -4.737 -4.737 84 HD1 PHE 98 2HD PHE 98 3.929 -5.641 -5.641 85 HD2 PHE 98 1HD PHE 98 1.606 -2.437 -2.437 86 HE1 PHE 98 2HE PHE 98 2.765 -5.624 -5.624 87 HE2 PHE 98 1HE PHE 98 0.319 -2.462 -2.462 88 HZ PHE 98 HZ PHE 98 0.794 -4.181 -4.181 89 H ARG 99 H ARG 99 6.496 -5.852 -5.852 90 HA ARG 99 HA ARG 99 8.266 -4.829 -4.829 91 1HB ARG 99 2HB ARG 99 8.320 -7.258 -7.258 92 2HB ARG 99 1HB ARG 99 9.609 -6.770 -6.770 93 1HG ARG 99 2HG ARG 99 10.596 -5.552 -5.552 94 2HG ARG 99 1HG ARG 99 9.169 -4.469 -4.469 95 1HD ARG 99 2HD ARG 99 9.574 -7.028 -7.028 96 2HD ARG 99 1HD ARG 99 9.786 -5.312 -5.312 97 HE ARG 99 HE ARG 99 7.154 -5.648 -5.648 98 1HH1 ARG 99 1HH1 ARG 99 9.133 -6.534 -6.534 99 2HH1 ARG 99 2HH1 ARG 99 7.779 -6.706 -6.706 100 1HH2 ARG 99 1HH2 ARG 99 5.334 -5.868 -5.868 101 2HH2 ARG 99 2HH2 ARG 99 5.591 -6.317 -6.317 102 HA PRO 100 HA PRO 100 6.843 -7.768 -7.768 103 1HB PRO 100 2HB PRO 100 9.803 -8.605 -8.605 104 2HB PRO 100 1HB PRO 100 8.831 -8.506 -8.506 105 1HG PRO 100 2HG PRO 100 10.521 -6.461 -6.461 106 2HG PRO 100 1HG PRO 100 8.928 -6.103 -6.103 107 1HD PRO 100 2HD PRO 100 9.682 -5.662 -5.662 108 2HD PRO 100 1HD PRO 100 8.242 -5.081 -5.081 109 H GLY 101 H GLY 101 6.021 -9.757 -9.757 110 1HA GLY 101 2HA GLY 101 5.387 -11.763 -11.763 111 2HA GLY 101 1HA GLY 101 6.974 -11.875 -11.875 112 H THR 102 H THR 102 6.810 -12.030 -12.030 113 HA THR 102 HA THR 102 6.357 -12.048 -12.048 114 HB THR 102 HB THR 102 5.494 -9.168 -9.168 115 HG1 THR 102 1HG THR 102 7.736 -8.826 -8.826 116 1HG2 THR 102 3HG2 THR 102 6.604 -11.064 -11.064 117 2HG2 THR 102 2HG2 THR 102 6.816 -9.263 -9.263 118 3HG2 THR 102 1HG2 THR 102 5.174 -9.989 -9.989 119 H ASP 103 H ASP 103 4.845 -13.404 -13.404 120 HA ASP 103 HA ASP 103 2.324 -12.237 -12.237 121 1HB ASP 103 2HB ASP 103 2.567 -13.759 -13.759 122 2HB ASP 103 1HB ASP 103 2.855 -15.064 -15.064 123 H GLU 104 H GLU 104 3.285 -15.562 -15.562 124 HA GLU 104 HA GLU 104 0.839 -14.083 -14.083 125 1HB GLU 104 2HB GLU 104 0.808 -16.576 -16.576 126 2HB GLU 104 1HB GLU 104 1.529 -16.562 -16.562 127 1HG GLU 104 2HG GLU 104 -0.506 -15.387 -15.387 128 2HG GLU 104 1HG GLU 104 -1.177 -15.271 -15.271 129 H GLY 105 H GLY 105 2.836 -15.368 -15.368 130 1HA GLY 105 2HA GLY 105 2.142 -12.861 -12.861 131 2HA GLY 105 1HA GLY 105 2.614 -14.424 -14.424 132 H ASP 106 H ASP 106 4.130 -12.814 -12.814 133 HA ASP 106 HA ASP 106 5.937 -11.459 -11.459 134 1HB ASP 106 2HB ASP 106 6.901 -12.688 -12.688 135 2HB ASP 106 1HB ASP 106 6.087 -11.517 -11.517 136 H TYR 107 H TYR 107 3.594 -11.391 -11.391 137 HA TYR 107 HA TYR 107 3.653 -8.595 -8.595 138 1HB TYR 107 2HB TYR 107 3.135 -10.385 -10.385 139 2HB TYR 107 1HB TYR 107 1.757 -10.941 -10.941 140 HD1 TYR 107 2HD TYR 107 1.922 -7.280 -7.280 141 HD2 TYR 107 1HD TYR 107 0.753 -10.972 -10.972 142 HE1 TYR 107 2HE TYR 107 -0.213 -6.272 -6.272 143 HE2 TYR 107 1HE TYR 107 -0.986 -9.828 -9.828 144 HH TYR 107 HH TYR 107 -1.935 -6.524 -6.524 145 H GLN 108 H GLN 108 0.693 -10.517 -10.517 146 HA GLN 108 HA GLN 108 -0.460 -8.531 -8.531 147 1HB GLN 108 2HB GLN 108 -1.340 -11.110 -11.110 148 2HB GLN 108 1HB GLN 108 -2.199 -9.751 -9.751 149 1HG GLN 108 2HG GLN 108 -0.510 -11.561 -11.561 150 2HG GLN 108 1HG GLN 108 -1.980 -12.133 -12.133 151 1HE2 GLN 108 1HE2 GLN 108 -0.943 -8.791 -8.791 152 2HE2 GLN 108 2HE2 GLN 108 -2.224 -8.558 -8.558 153 H VAL 109 H VAL 109 2.040 -10.169 -10.169 154 HA VAL 109 HA VAL 109 1.443 -9.467 -9.467 155 HB VAL 109 HB VAL 109 4.078 -9.933 -9.933 156 1HG1 VAL 109 1HG1 VAL 109 3.566 -9.113 -9.113 157 2HG1 VAL 109 3HG1 VAL 109 5.061 -9.938 -9.938 158 3HG1 VAL 109 2HG1 VAL 109 4.682 -8.308 -8.308 159 1HG2 VAL 109 1HG2 VAL 109 2.524 -11.878 -11.878 160 2HG2 VAL 109 3HG2 VAL 109 4.060 -11.958 -11.958 161 3HG2 VAL 109 2HG2 VAL 109 2.532 -11.427 -11.427 162 H LYS 110 H LYS 110 3.017 -7.776 -7.776 163 HA LYS 110 HA LYS 110 3.069 -5.345 -5.345 164 1HB LYS 110 2HB LYS 110 4.195 -6.099 -6.099 165 2HB LYS 110 1HB LYS 110 4.266 -4.456 -4.456 166 1HG LYS 110 2HG LYS 110 5.640 -7.002 -7.002 167 2HG LYS 110 1HG LYS 110 6.275 -5.330 -5.330 168 1HD LYS 110 2HD LYS 110 5.441 -4.454 -4.454 169 2HD LYS 110 1HD LYS 110 4.700 -6.043 -6.043 170 1HE LYS 110 2HE LYS 110 6.837 -5.742 -5.742 171 2HE LYS 110 1HE LYS 110 6.997 -7.092 -7.092 172 1HZ LYS 110 1HZ LYS 110 7.910 -4.287 -4.287 173 2HZ LYS 110 3HZ LYS 110 8.887 -5.624 -5.624 174 3HZ LYS 110 2HZ LYS 110 8.073 -5.557 -5.557 175 H LEU 111 H LEU 111 0.721 -6.818 -6.818 176 HA LEU 111 HA LEU 111 -0.459 -4.363 -4.363 177 1HB LEU 111 2HB LEU 111 -0.887 -6.633 -6.633 178 2HB LEU 111 1HB LEU 111 -1.791 -7.087 -7.087 179 HG LEU 111 HG LEU 111 -2.462 -4.594 -4.594 180 1HD1 LEU 111 1HD1 LEU 111 -2.257 -6.523 -6.523 181 2HD1 LEU 111 3HD1 LEU 111 -3.418 -7.470 -7.470 182 3HD1 LEU 111 2HD1 LEU 111 -3.968 -5.971 -5.971 183 1HD2 LEU 111 3HD2 LEU 111 -4.064 -6.528 -6.528 184 2HD2 LEU 111 2HD2 LEU 111 -3.768 -4.767 -4.767 185 3HD2 LEU 111 1HD2 LEU 111 -4.862 -5.314 -5.314 186 H ARG 112 H ARG 112 -0.126 -6.656 -6.656 187 HA ARG 112 HA ARG 112 -1.904 -5.355 -5.355 188 1HB ARG 112 2HB ARG 112 -0.783 -7.635 -7.635 189 2HB ARG 112 1HB ARG 112 0.509 -6.694 -6.694 190 1HG ARG 112 2HG ARG 112 -1.155 -5.762 -5.762 191 2HG ARG 112 1HG ARG 112 -2.497 -6.525 -6.525 192 1HD ARG 112 2HD ARG 112 -1.599 -8.802 -8.802 193 2HD ARG 112 1HD ARG 112 -0.289 -8.040 -8.040 194 HE ARG 112 HE ARG 112 -2.696 -6.913 -6.913 195 1HH1 ARG 112 1HH1 ARG 112 -1.348 -10.194 -10.194 196 2HH1 ARG 112 2HH1 ARG 112 -2.233 -10.878 -10.878 197 1HH2 ARG 112 1HH2 ARG 112 -3.895 -7.859 -7.859 198 2HH2 ARG 112 2HH2 ARG 112 -3.699 -9.538 -9.538 199 H SER 113 H SER 113 1.739 -4.773 -4.773 200 HA SER 113 HA SER 113 1.974 -2.785 -2.785 201 1HB SER 113 2HB SER 113 3.821 -3.763 -3.763 202 2HB SER 113 1HB SER 113 3.310 -3.003 -3.003 203 HG SER 113 HG SER 113 3.519 -0.998 -0.998 204 H LEU 114 H LEU 114 0.722 -2.670 -2.670 205 HA LEU 114 HA LEU 114 0.430 0.067 0.067 206 1HB LEU 114 2HB LEU 114 -0.892 -2.291 -2.291 207 2HB LEU 114 1HB LEU 114 -1.618 -0.668 -0.668 208 HG LEU 114 HG LEU 114 1.303 -1.333 -1.333 209 1HD1 LEU 114 3HD1 LEU 114 -0.427 -2.543 -2.543 210 2HD1 LEU 114 2HD1 LEU 114 -1.188 -0.962 -0.962 211 3HD1 LEU 114 1HD1 LEU 114 0.493 -1.339 -1.339 212 1HD2 LEU 114 2HD2 LEU 114 -0.520 1.134 1.134 213 2HD2 LEU 114 1HD2 LEU 114 1.065 1.048 1.048 214 3HD2 LEU 114 3HD2 LEU 114 1.015 0.954 0.954 215 H ILE 115 H ILE 115 -1.869 -2.341 -2.341 216 HA ILE 115 HA ILE 115 -4.026 -0.638 -0.638 217 HB ILE 115 HB ILE 115 -3.472 -2.181 -2.181 218 1HG1 ILE 115 2HG1 ILE 115 -2.968 -3.831 -3.831 219 2HG1 ILE 115 1HG1 ILE 115 -4.466 -4.211 -4.211 220 1HG2 ILE 115 3HG2 ILE 115 -5.848 -1.322 -1.322 221 2HG2 ILE 115 2HG2 ILE 115 -6.008 -2.385 -2.385 222 3HG2 ILE 115 1HG2 ILE 115 -5.347 -0.719 -0.719 223 1HD1 ILE 115 2HD1 ILE 115 -5.799 -3.303 -3.303 224 2HD1 ILE 115 1HD1 ILE 115 -4.195 -3.080 -3.080 225 3HD1 ILE 115 3HD1 ILE 115 -4.780 -4.738 -4.738 226 H ARG 116 H ARG 116 -1.400 -1.164 -1.164 227 HA ARG 116 HA ARG 116 -2.024 0.574 0.574 228 1HB ARG 116 2HB ARG 116 -0.062 -1.107 -1.107 229 2HB ARG 116 1HB ARG 116 0.887 0.157 0.157 230 1HG ARG 116 2HG ARG 116 1.438 0.228 0.228 231 2HG ARG 116 1HG ARG 116 0.557 1.728 1.728 232 1HD ARG 116 2HD ARG 116 -1.599 0.472 0.472 233 2HD ARG 116 1HD ARG 116 -0.395 -0.671 -0.671 234 HE ARG 116 HE ARG 116 0.439 1.091 1.091 235 1HH1 ARG 116 1HH1 ARG 116 -2.106 2.267 2.267 236 2HH1 ARG 116 2HH1 ARG 116 -2.350 3.755 3.755 237 1HH2 ARG 116 1HH2 ARG 116 0.083 3.108 3.108 238 2HH2 ARG 116 2HH2 ARG 116 -1.096 4.235 4.235 239 H PHE 117 H PHE 117 -0.041 1.332 1.332 240 HA PHE 117 HA PHE 117 0.421 4.074 4.074 241 1HB PHE 117 2HB PHE 117 0.239 2.542 2.542 242 2HB PHE 117 1HB PHE 117 0.507 4.362 4.362 243 HD1 PHE 117 2HD PHE 117 2.125 5.213 5.213 244 HD2 PHE 117 1HD PHE 117 1.859 1.123 1.123 245 HE1 PHE 117 2HE PHE 117 4.478 4.962 4.962 246 HE2 PHE 117 1HE PHE 117 4.178 0.765 0.765 247 HZ PHE 117 HZ PHE 117 5.481 2.704 2.704 248 H LEU 118 H LEU 118 -2.285 2.606 2.606 249 HA LEU 118 HA LEU 118 -3.490 4.963 4.963 250 1HB LEU 118 2HB LEU 118 -4.054 2.263 2.263 251 2HB LEU 118 1HB LEU 118 -5.437 3.067 3.067 252 HG LEU 118 HG LEU 118 -4.852 5.009 5.009 253 1HD1 LEU 118 1HD1 LEU 118 -3.862 2.344 2.344 254 2HD1 LEU 118 3HD1 LEU 118 -4.676 3.558 3.558 255 3HD1 LEU 118 2HD1 LEU 118 -3.213 4.044 4.044 256 1HD2 LEU 118 2HD2 LEU 118 -6.712 2.702 2.702 257 2HD2 LEU 118 1HD2 LEU 118 -6.848 4.489 4.489 258 3HD2 LEU 118 3HD2 LEU 118 -6.754 3.913 3.913 259 H GLU 119 H GLU 119 -3.651 2.970 2.970 260 HA GLU 119 HA GLU 119 -5.958 4.134 4.134 261 1HB GLU 119 2HB GLU 119 -3.843 2.159 2.159 262 2HB GLU 119 1HB GLU 119 -4.990 2.915 2.915 263 1HG GLU 119 2HG GLU 119 -6.934 1.991 1.991 264 2HG GLU 119 1HG GLU 119 -5.773 1.141 1.141 265 H GLU 120 H GLU 120 -2.515 4.808 4.808 266 HA GLU 120 HA GLU 120 -2.520 6.341 6.341 267 1HB GLU 120 2HB GLU 120 -0.799 6.537 6.537 268 2HB GLU 120 1HB GLU 120 -0.533 7.535 7.535 269 1HG GLU 120 2HG GLU 120 -0.110 5.415 5.415 270 2HG GLU 120 1HG GLU 120 -0.199 4.476 4.476 271 H GLY 121 H GLY 121 -3.837 6.693 6.693 272 1HA GLY 121 2HA GLY 121 -5.227 8.197 8.197 273 2HA GLY 121 1HA GLY 121 -4.793 9.305 9.305 274 H ASP 122 H ASP 122 -3.166 7.531 7.531 275 HA ASP 122 HA ASP 122 -2.132 10.127 10.127 276 1HB ASP 122 2HB ASP 122 -0.453 7.561 7.561 277 2HB ASP 122 1HB ASP 122 0.068 9.172 9.172 278 H LYS 123 H LYS 123 -1.169 9.514 9.514 279 HA LYS 123 HA LYS 123 -3.063 7.627 7.627 280 1HB LYS 123 2HB LYS 123 -0.733 9.068 9.068 281 2HB LYS 123 1HB LYS 123 -2.111 8.275 8.275 282 1HG LYS 123 2HG LYS 123 -3.474 10.168 10.168 283 2HG LYS 123 1HG LYS 123 -2.675 10.714 10.714 284 1HD LYS 123 2HD LYS 123 -2.079 12.164 12.164 285 2HD LYS 123 1HD LYS 123 -0.670 11.395 11.395 286 1HE LYS 123 2HE LYS 123 -0.258 9.816 9.816 287 2HE LYS 123 1HE LYS 123 -1.897 10.014 10.014 288 1HZ LYS 123 1HZ LYS 123 0.259 12.059 12.059 289 2HZ LYS 123 3HZ LYS 123 -0.174 11.062 11.062 290 3HZ LYS 123 2HZ LYS 123 -1.273 12.215 12.215 291 H ALA 124 H ALA 124 -2.152 5.701 5.701 292 HA ALA 124 HA ALA 124 0.742 5.476 5.476 293 1HB ALA 124 2HB ALA 124 -1.601 3.639 3.639 294 2HB ALA 124 1HB ALA 124 0.144 3.149 3.149 295 3HB ALA 124 3HB ALA 124 -0.493 3.546 3.546 296 H LYS 125 H LYS 125 2.061 5.251 5.251 297 HA LYS 125 HA LYS 125 0.280 5.214 5.214 298 1HB LYS 125 2HB LYS 125 1.177 7.552 7.552 299 2HB LYS 125 1HB LYS 125 2.792 6.901 6.901 300 1HG LYS 125 2HG LYS 125 3.213 6.224 6.224 301 2HG LYS 125 1HG LYS 125 1.568 6.770 6.770 302 1HD LYS 125 2HD LYS 125 3.636 8.614 8.614 303 2HD LYS 125 1HD LYS 125 3.578 8.378 8.378 304 1HE LYS 125 2HE LYS 125 1.275 9.233 9.233 305 2HE LYS 125 1HE LYS 125 1.232 9.469 9.469 306 1HZ LYS 125 3HZ LYS 125 3.090 10.982 10.982 307 2HZ LYS 125 2HZ LYS 125 3.094 10.777 10.777 308 3HZ LYS 125 1HZ LYS 125 1.755 11.486 11.486 309 H ILE 126 H ILE 126 0.816 3.349 3.349 310 HA ILE 126 HA ILE 126 3.145 1.922 1.922 311 HB ILE 126 HB ILE 126 1.447 1.355 1.355 312 1HG1 ILE 126 2HG1 ILE 126 -0.312 1.693 1.693 313 2HG1 ILE 126 1HG1 ILE 126 -0.029 -0.073 -0.073 314 1HG2 ILE 126 2HG2 ILE 126 3.748 0.196 0.196 315 2HG2 ILE 126 1HG2 ILE 126 2.626 -0.572 -0.572 316 3HG2 ILE 126 3HG2 ILE 126 2.408 -0.798 -0.798 317 1HD1 ILE 126 1HD1 ILE 126 1.227 0.023 0.023 318 2HD1 ILE 126 3HD1 ILE 126 0.787 1.759 1.759 319 3HD1 ILE 126 2HD1 ILE 126 -0.489 0.490 0.490 320 H THR 127 H THR 127 5.110 2.313 2.313 321 HA THR 127 HA THR 127 5.057 3.333 3.333 322 HB THR 127 HB THR 127 7.407 2.644 2.644 323 HG1 THR 127 1HG THR 127 6.160 4.237 4.237 324 1HG2 THR 127 3HG2 THR 127 6.955 4.240 4.240 325 2HG2 THR 127 2HG2 THR 127 8.486 4.342 4.342 326 3HG2 THR 127 1HG2 THR 127 7.994 2.769 2.769 327 H LEU 128 H LEU 128 4.904 1.807 1.807 328 HA LEU 128 HA LEU 128 5.832 -0.880 -0.880 329 1HB LEU 128 2HB LEU 128 4.098 0.268 0.268 330 2HB LEU 128 1HB LEU 128 5.473 -0.321 -0.321 331 HG LEU 128 HG LEU 128 3.942 -1.851 -1.851 332 1HD1 LEU 128 3HD1 LEU 128 2.541 -0.788 -0.788 333 2HD1 LEU 128 2HD1 LEU 128 3.229 -2.022 -2.022 334 3HD1 LEU 128 1HD1 LEU 128 2.303 -2.553 -2.553 335 1HD2 LEU 128 3HD2 LEU 128 5.587 -3.106 -3.106 336 2HD2 LEU 128 2HD2 LEU 128 6.011 -3.085 -3.085 337 3HD2 LEU 128 1HD2 LEU 128 4.546 -3.989 -3.989 338 H ARG 129 H ARG 129 7.636 -1.808 -1.808 339 HA ARG 129 HA ARG 129 9.388 0.045 0.045 340 1HB ARG 129 2HB ARG 129 9.968 0.391 0.391 341 2HB ARG 129 1HB ARG 129 9.996 -1.387 -1.387 342 1HG ARG 129 2HG ARG 129 11.973 -1.625 -1.625 343 2HG ARG 129 1HG ARG 129 11.646 -0.053 -0.053 344 1HD ARG 129 2HD ARG 129 12.608 -0.387 -0.387 345 2HD ARG 129 1HD ARG 129 13.698 -0.059 -0.059 346 HE ARG 129 HE ARG 129 11.522 1.877 1.877 347 1HH1 ARG 129 1HH1 ARG 129 14.639 0.915 0.915 348 2HH1 ARG 129 2HH1 ARG 129 15.085 2.521 2.521 349 1HH2 ARG 129 1HH2 ARG 129 12.141 4.058 4.058 350 2HH2 ARG 129 2HH2 ARG 129 13.646 4.331 4.331 351 H PHE 130 H PHE 130 9.121 -1.089 -1.089 352 HA PHE 130 HA PHE 130 8.711 -3.949 -3.949 353 1HB PHE 130 2HB PHE 130 9.287 -1.961 -1.961 354 2HB PHE 130 1HB PHE 130 8.698 -3.721 -3.721 355 HD1 PHE 130 1HD PHE 130 6.699 -4.428 -4.428 356 HD2 PHE 130 2HD PHE 130 7.798 -0.316 -0.316 357 HE1 PHE 130 1HE PHE 130 4.354 -3.710 -3.710 358 HE2 PHE 130 2HE PHE 130 5.355 0.318 0.318 359 HZ PHE 130 HZ PHE 130 3.657 -1.462 -1.462 360 H ARG 131 H ARG 131 10.393 -5.439 -5.439 361 HA ARG 131 HA ARG 131 12.985 -4.214 -4.214 362 1HB ARG 131 2HB ARG 131 12.025 -7.124 -7.124 363 2HB ARG 131 1HB ARG 131 13.620 -6.605 -6.605 364 1HG ARG 131 2HG ARG 131 14.290 -5.674 -5.674 365 2HG ARG 131 1HG ARG 131 12.693 -6.074 -6.074 366 1HD ARG 131 2HD ARG 131 14.660 -8.196 -8.196 367 2HD ARG 131 1HD ARG 131 14.488 -7.708 -7.708 368 HE ARG 131 HE ARG 131 11.901 -8.389 -8.389 369 1HH1 ARG 131 1HH1 ARG 131 14.970 -9.755 -9.755 370 2HH1 ARG 131 2HH1 ARG 131 14.269 -11.253 -11.253 371 1HH2 ARG 131 1HH2 ARG 131 10.960 -10.430 -10.430 372 2HH2 ARG 131 2HH2 ARG 131 11.962 -11.643 -11.643 373 H GLY 132 H GLY 132 12.159 -2.853 -2.853 374 1HA GLY 132 2HA GLY 132 10.044 -4.140 -4.140 375 2HA GLY 132 1HA GLY 132 10.196 -2.427 -2.427 376 H ARG 133 H ARG 133 9.713 -1.487 -1.487 377 HA ARG 133 HA ARG 133 11.647 -1.760 -1.760 378 1HB ARG 133 2HB ARG 133 9.133 -3.081 -3.081 379 2HB ARG 133 1HB ARG 133 8.870 -1.656 -1.656 380 1HG ARG 133 2HG ARG 133 11.208 -3.665 -3.665 381 2HG ARG 133 1HG ARG 133 9.613 -3.872 -3.872 382 1HD ARG 133 2HD ARG 133 11.481 -1.463 -1.463 383 2HD ARG 133 1HD ARG 133 11.290 -2.925 -2.925 384 HE ARG 133 HE ARG 133 8.704 -1.729 -1.729 385 1HH1 ARG 133 1HH2 ARG 133 11.654 -1.362 -1.362 386 2HH1 ARG 133 2HH2 ARG 133 10.864 -0.511 -0.511 387 1HH2 ARG 133 1HH1 ARG 133 7.640 -0.582 -0.582 388 2HH2 ARG 133 2HH1 ARG 133 8.549 -0.060 -0.060 389 H GLU 134 H GLU 134 10.343 -0.080 -0.080 390 HA GLU 134 HA GLU 134 10.744 2.433 2.433 391 1HB GLU 134 2HB GLU 134 9.353 1.731 1.731 392 2HB GLU 134 1HB GLU 134 9.874 3.375 3.375 393 1HG GLU 134 2HG GLU 134 11.734 0.952 0.952 394 2HG GLU 134 1HG GLU 134 11.495 2.361 2.361 395 H MET 135 H MET 135 7.698 0.909 0.909 396 HA MET 135 HA MET 135 6.505 2.010 2.010 397 1HB MET 135 2HB MET 135 5.078 1.278 1.278 398 2HB MET 135 1HB MET 135 4.261 1.344 1.344 399 1HG MET 135 2HG MET 135 5.088 3.740 3.740 400 2HG MET 135 1HG MET 135 5.589 3.684 3.684 401 1HE MET 135 2HE MET 135 4.156 5.886 5.886 402 2HE MET 135 1HE MET 135 2.400 6.003 6.003 403 3HE MET 135 3HE MET 135 3.572 5.688 5.688 404 H ALA 136 H ALA 136 6.658 0.373 0.373 405 HA ALA 136 HA ALA 136 7.415 -2.130 -2.130 406 1HB ALA 136 2HB ALA 136 8.220 -0.987 -0.987 407 2HB ALA 136 1HB ALA 136 6.611 -1.376 -1.376 408 3HB ALA 136 3HB ALA 136 7.723 -2.699 -2.699 409 H HIS 137 H HIS 137 6.554 -4.020 -4.020 410 HA HIS 137 HA HIS 137 4.888 -5.604 -5.604 411 1HB HIS 137 2HB HIS 137 5.014 -4.626 -4.626 412 2HB HIS 137 1HB HIS 137 4.260 -6.182 -6.182 413 HD1 HIS 137 1HD HIS 137 5.835 -7.851 -7.851 414 HD2 HIS 137 2HD HIS 137 7.792 -4.532 -4.532 415 HE1 HIS 137 1HE HIS 137 8.350 -8.239 -8.239 416 H GLN 138 H GLN 138 3.123 -3.980 -3.980 417 HA GLN 138 HA GLN 138 1.046 -3.635 -3.635 418 1HB GLN 138 2HB GLN 138 0.312 -3.865 -3.865 419 2HB GLN 138 1HB GLN 138 -0.755 -3.285 -3.285 420 1HG GLN 138 2HG GLN 138 0.539 -1.251 -1.251 421 2HG GLN 138 1HG GLN 138 1.865 -1.848 -1.848 422 1HE2 GLN 138 1HE2 GLN 138 1.434 0.248 0.248 423 2HE2 GLN 138 2HE2 GLN 138 0.243 0.295 0.295 424 H GLN 139 H GLN 139 2.493 -6.228 -6.228 425 HA GLN 139 HA GLN 139 0.199 -8.031 -8.031 426 1HB GLN 139 2HB GLN 139 3.146 -8.900 -8.900 427 2HB GLN 139 1HB GLN 139 1.668 -9.853 -9.853 428 1HG GLN 139 2HG GLN 139 1.242 -8.306 -8.306 429 2HG GLN 139 1HG GLN 139 2.832 -7.515 -7.515 430 1HE2 GLN 139 1HE2 GLN 139 4.773 -8.914 -8.914 431 2HE2 GLN 139 2HE2 GLN 139 4.900 -10.288 -10.288 432 H ILE 140 H ILE 140 3.586 -7.293 -7.293 433 HA ILE 140 HA ILE 140 3.664 -8.045 -8.045 434 HB ILE 140 HB ILE 140 5.211 -6.213 -6.213 435 1HG1 ILE 140 2HG1 ILE 140 5.626 -8.962 -8.962 436 2HG1 ILE 140 1HG1 ILE 140 5.203 -8.710 -8.710 437 1HG2 ILE 140 2HG2 ILE 140 5.339 -6.980 -6.980 438 2HG2 ILE 140 1HG2 ILE 140 6.749 -6.299 -6.299 439 3HG2 ILE 140 3HG2 ILE 140 5.288 -5.308 -5.308 440 1HD1 ILE 140 2HD1 ILE 140 7.283 -7.315 -7.315 441 2HD1 ILE 140 1HD1 ILE 140 7.806 -7.851 -7.851 442 3HD1 ILE 140 3HD1 ILE 140 7.581 -9.069 -9.069 443 H GLY 141 H GLY 141 2.488 -5.061 -5.061 444 1HA GLY 141 2HA GLY 141 2.376 -3.984 -3.984 445 2HA GLY 141 1HA GLY 141 1.707 -3.235 -3.235 446 H MET 142 H MET 142 -0.153 -4.873 -4.873 447 HA MET 142 HA MET 142 -2.113 -4.037 -4.037 448 1HB MET 142 2HB MET 142 -2.348 -5.383 -5.383 449 2HB MET 142 1HB MET 142 -3.793 -4.775 -4.775 450 1HG MET 142 2HG MET 142 -2.641 -2.459 -2.459 451 2HG MET 142 1HG MET 142 -1.725 -3.081 -3.081 452 1HE MET 142 3HE MET 142 -2.792 -4.074 -4.074 453 2HE MET 142 2HE MET 142 -3.806 -5.245 -5.245 454 3HE MET 142 1HE MET 142 -4.551 -4.191 -4.191 455 H GLU 143 H GLU 143 -0.566 -7.192 -7.192 456 HA GLU 143 HA GLU 143 -2.948 -8.243 -8.243 457 1HB GLU 143 2HB GLU 143 -0.572 -9.614 -9.614 458 2HB GLU 143 1HB GLU 143 -0.339 -9.281 -9.281 459 1HG GLU 143 2HG GLU 143 -1.375 -11.354 -11.354 460 2HG GLU 143 1HG GLU 143 -2.777 -10.287 -10.287 461 H VAL 144 H VAL 144 -0.009 -6.620 -6.620 462 HA VAL 144 HA VAL 144 -0.440 -7.419 -7.419 463 HB VAL 144 HB VAL 144 1.373 -5.227 -5.227 464 1HG1 VAL 144 2HG1 VAL 144 0.826 -6.757 -6.757 465 2HG1 VAL 144 1HG1 VAL 144 2.471 -6.196 -6.196 466 3HG1 VAL 144 3HG1 VAL 144 1.125 -4.988 -4.988 467 1HG2 VAL 144 3HG2 VAL 144 1.227 -8.264 -8.264 468 2HG2 VAL 144 2HG2 VAL 144 1.600 -7.486 -7.486 469 3HG2 VAL 144 1HG2 VAL 144 2.852 -7.429 -7.429 470 H LEU 145 H LEU 145 -0.439 -4.329 -4.329 471 HA LEU 145 HA LEU 145 -1.368 -2.715 -2.715 472 1HB LEU 145 2HB LEU 145 -1.415 -2.748 -2.748 473 2HB LEU 145 1HB LEU 145 -2.332 -1.486 -1.486 474 HG LEU 145 HG LEU 145 -0.503 -0.482 -0.482 475 1HD1 LEU 145 2HD1 LEU 145 1.148 -2.961 -2.961 476 2HD1 LEU 145 1HD1 LEU 145 1.823 -1.326 -1.326 477 3HD1 LEU 145 3HD1 LEU 145 0.630 -2.110 -2.110 478 1HD2 LEU 145 1HD2 LEU 145 -0.981 -0.229 -0.229 479 2HD2 LEU 145 3HD2 LEU 145 0.758 0.099 0.099 480 3HD2 LEU 145 2HD2 LEU 145 0.250 -1.473 -1.473 481 H ASN 146 H ASN 146 -3.259 -4.215 -4.215 482 HA ASN 146 HA ASN 146 -5.834 -3.377 -3.377 483 1HB ASN 146 2HB ASN 146 -4.512 -4.511 -4.511 484 2HB ASN 146 1HB ASN 146 -5.307 -5.982 -5.982 485 1HD2 ASN 146 2HD2 ASN 146 -5.759 -6.235 -6.235 486 2HD2 ASN 146 1HD2 ASN 146 -7.137 -5.580 -5.580 487 H ARG 147 H ARG 147 -3.926 -6.341 -6.341 488 HA ARG 147 HA ARG 147 -6.230 -7.138 -7.138 489 1HB ARG 147 2HB ARG 147 -4.928 -8.721 -8.721 490 2HB ARG 147 1HB ARG 147 -3.394 -7.993 -7.993 491 1HG ARG 147 2HG ARG 147 -3.577 -9.079 -9.079 492 2HG ARG 147 1HG ARG 147 -5.408 -9.074 -9.074 493 1HD ARG 147 2HD ARG 147 -4.397 -11.431 -11.431 494 2HD ARG 147 1HD ARG 147 -5.190 -10.963 -10.963 495 HE ARG 147 HE ARG 147 -2.515 -10.054 -10.054 496 1HH1 ARG 147 1HH2 ARG 147 -4.209 -13.157 -13.157 497 2HH1 ARG 147 2HH2 ARG 147 -2.911 -14.125 -14.125 498 1HH2 ARG 147 1HH1 ARG 147 -0.765 -11.372 -11.372 499 2HH2 ARG 147 2HH1 ARG 147 -0.924 -13.096 -13.096 500 H VAL 148 H VAL 148 -3.628 -4.723 -4.723 501 HA VAL 148 HA VAL 148 -3.568 -5.400 -5.400 502 HB VAL 148 HB VAL 148 -3.002 -2.685 -2.685 503 1HG1 VAL 148 1HG1 VAL 148 -3.017 -3.716 -3.716 504 2HG1 VAL 148 3HG1 VAL 148 -1.512 -4.575 -4.575 505 3HG1 VAL 148 2HG1 VAL 148 -1.575 -2.760 -2.760 506 1HG2 VAL 148 1HG2 VAL 148 -1.157 -5.055 -5.055 507 2HG2 VAL 148 3HG2 VAL 148 -1.906 -3.998 -3.998 508 3HG2 VAL 148 2HG2 VAL 148 -0.695 -3.303 -3.303 509 H LYS 149 H LYS 149 -5.195 -2.844 -2.844 510 HA LYS 149 HA LYS 149 -6.730 -1.545 -1.545 511 1HB LYS 149 2HB LYS 149 -6.437 -1.225 -1.225 512 2HB LYS 149 1HB LYS 149 -7.253 -2.806 -2.806 513 1HG LYS 149 2HG LYS 149 -9.298 -2.153 -2.153 514 2HG LYS 149 1HG LYS 149 -8.860 -0.594 -0.594 515 1HD LYS 149 2HD LYS 149 -8.214 -1.093 -1.093 516 2HD LYS 149 1HD LYS 149 -9.973 -0.705 -0.705 517 1HE LYS 149 2HE LYS 149 -8.583 1.398 1.398 518 2HE LYS 149 1HE LYS 149 -7.551 0.965 0.965 519 1HZ LYS 149 2HZ LYS 149 -9.485 1.085 1.085 520 2HZ LYS 149 1HZ LYS 149 -10.486 1.461 1.461 521 3HZ LYS 149 3HZ LYS 149 -9.268 2.544 2.544 522 H ASP 150 H ASP 150 -7.362 -4.760 -4.760 523 HA ASP 150 HA ASP 150 -10.035 -4.746 -4.746 524 1HB ASP 150 2HB ASP 150 -8.106 -6.506 -6.506 525 2HB ASP 150 1HB ASP 150 -9.510 -7.227 -7.227 526 H ASP 151 H ASP 151 -6.992 -6.345 -6.345 527 HA ASP 151 HA ASP 151 -8.719 -7.438 -7.438 528 1HB ASP 151 2HB ASP 151 -6.468 -8.380 -8.380 529 2HB ASP 151 1HB ASP 151 -5.718 -6.993 -6.993 530 H LEU 152 H LEU 152 -6.889 -4.274 -4.274 531 HA LEU 152 HA LEU 152 -7.357 -3.873 -3.873 532 1HB LEU 152 2HB LEU 152 -6.095 -2.597 -2.597 533 2HB LEU 152 1HB LEU 152 -7.192 -1.478 -1.478 534 HG LEU 152 HG LEU 152 -5.315 -3.260 -3.260 535 1HD1 LEU 152 3HD1 LEU 152 -4.170 -2.414 -2.414 536 2HD1 LEU 152 2HD1 LEU 152 -4.475 -0.700 -0.700 537 3HD1 LEU 152 1HD1 LEU 152 -3.423 -1.782 -1.782 538 1HD2 LEU 152 3HD2 LEU 152 -6.477 -0.467 -0.467 539 2HD2 LEU 152 2HD2 LEU 152 -6.912 -2.043 -2.043 540 3HD2 LEU 152 1HD2 LEU 152 -5.310 -1.300 -1.300 541 H GLN 153 H GLN 153 -9.154 -3.106 -3.106 542 HA GLN 153 HA GLN 153 -10.670 -1.333 -1.333 543 1HB GLN 153 2HB GLN 153 -10.668 -3.778 -3.778 544 2HB GLN 153 1HB GLN 153 -12.029 -4.005 -4.005 545 1HG GLN 153 2HG GLN 153 -13.155 -2.028 -2.028 546 2HG GLN 153 1HG GLN 153 -11.538 -1.874 -1.874 547 1HE2 GLN 153 1HE2 GLN 153 -13.614 -4.738 -4.738 548 2HE2 GLN 153 2HE2 GLN 153 -13.690 -5.416 -5.416 549 H GLU 154 H GLU 154 -10.873 -3.311 -3.311 550 HA GLU 154 HA GLU 154 -13.324 -2.683 -2.683 551 1HB GLU 154 2HB GLU 154 -10.781 -2.931 -2.931 552 2HB GLU 154 1HB GLU 154 -12.417 -3.548 -3.548 553 1HG GLU 154 2HG GLU 154 -11.985 -5.255 -5.255 554 2HG GLU 154 1HG GLU 154 -10.327 -4.518 -4.518 555 H LEU 155 H LEU 155 -10.157 -1.311 -1.311 556 HA LEU 155 HA LEU 155 -11.175 0.810 0.810 557 1HB LEU 155 2HB LEU 155 -9.607 -1.110 -1.110 558 2HB LEU 155 1HB LEU 155 -8.335 -0.335 -0.335 559 HG LEU 155 HG LEU 155 -9.780 1.445 1.445 560 1HD1 LEU 155 3HD1 LEU 155 -9.772 -0.664 -0.664 561 2HD1 LEU 155 2HD1 LEU 155 -8.008 -0.878 -0.878 562 3HD1 LEU 155 1HD1 LEU 155 -8.590 0.500 0.500 563 1HD2 LEU 155 3HD2 LEU 155 -6.781 0.932 0.932 564 2HD2 LEU 155 2HD2 LEU 155 -7.780 2.289 2.289 565 3HD2 LEU 155 1HD2 LEU 155 -7.448 2.190 2.190 566 H ALA 156 H ALA 156 -8.879 -0.072 -0.072 567 HA ALA 156 HA ALA 156 -8.445 2.827 2.827 568 1HB ALA 156 1HB ALA 156 -6.152 1.553 1.553 569 2HB ALA 156 3HB ALA 156 -6.706 0.537 0.537 570 3HB ALA 156 2HB ALA 156 -6.453 2.300 2.300 571 H VAL 157 H VAL 157 -9.235 3.522 3.522 572 HA VAL 157 HA VAL 157 -8.210 1.480 1.480 573 HB VAL 157 HB VAL 157 -9.632 2.389 2.389 574 1HG1 VAL 157 1HG1 VAL 157 -11.208 1.845 1.845 575 2HG1 VAL 157 3HG1 VAL 157 -11.900 1.804 1.804 576 3HG1 VAL 157 2HG1 VAL 157 -10.629 0.610 0.610 577 1HG2 VAL 157 2HG2 VAL 157 -9.602 4.894 4.894 578 2HG2 VAL 157 1HG2 VAL 157 -11.141 4.288 4.288 579 3HG2 VAL 157 3HG2 VAL 157 -10.893 4.264 4.264 580 H VAL 158 H VAL 158 -7.774 2.086 2.086 581 HA VAL 158 HA VAL 158 -5.634 3.952 3.952 582 HB VAL 158 HB VAL 158 -6.906 2.753 2.753 583 1HG1 VAL 158 1HG1 VAL 158 -4.940 4.321 4.321 584 2HG1 VAL 158 3HG1 VAL 158 -3.968 3.174 3.174 585 3HG1 VAL 158 2HG1 VAL 158 -4.665 2.670 2.670 586 1HG2 VAL 158 2HG2 VAL 158 -6.621 0.808 0.808 587 2HG2 VAL 158 1HG2 VAL 158 -5.773 0.614 0.614 588 3HG2 VAL 158 3HG2 VAL 158 -4.843 1.119 1.119 589 H GLU 159 H GLU 159 -5.604 5.783 5.783 590 HA GLU 159 HA GLU 159 -8.017 7.235 7.235 591 1HB GLU 159 2HB GLU 159 -5.799 8.011 8.011 592 2HB GLU 159 1HB GLU 159 -5.199 7.703 7.703 593 1HG GLU 159 2HG GLU 159 -6.668 9.579 9.579 594 2HG GLU 159 1HG GLU 159 -7.387 9.764 9.764 595 H SER 160 H SER 160 -5.664 5.652 5.652 596 HA SER 160 HA SER 160 -7.363 6.276 6.276 597 1HB SER 160 2HB SER 160 -5.181 7.455 7.455 598 2HB SER 160 1HB SER 160 -4.397 5.833 5.833 599 HG SER 160 HG SER 160 -6.388 7.115 7.115 600 H PHE 161 H PHE 161 -6.879 4.384 4.384 601 HA PHE 161 HA PHE 161 -5.197 2.569 2.569 602 1HB PHE 161 2HB PHE 161 -7.496 1.526 1.526 603 2HB PHE 161 1HB PHE 161 -7.188 1.391 1.391 604 HD1 PHE 161 1HD PHE 161 -5.820 0.665 0.665 605 HD2 PHE 161 2HD PHE 161 -6.307 -0.759 -0.759 606 HE1 PHE 161 1HE PHE 161 -4.267 -1.054 -1.054 607 HE2 PHE 161 2HE PHE 161 -4.709 -2.507 -2.507 608 HZ PHE 161 HZ PHE 161 -3.488 -2.568 -2.568 609 HA PRO 162 HA PRO 162 -3.875 5.352 5.352 610 1HB PRO 162 2HB PRO 162 -1.077 4.238 4.238 611 2HB PRO 162 1HB PRO 162 -1.587 5.869 5.869 612 1HG PRO 162 2HG PRO 162 -0.805 3.684 3.684 613 2HG PRO 162 1HG PRO 162 -1.894 5.033 5.033 614 1HD PRO 162 2HD PRO 162 -2.560 2.197 2.197 615 2HD PRO 162 1HD PRO 162 -3.464 3.428 3.428 616 H THR 163 H THR 163 -2.627 2.065 2.065 617 HA THR 163 HA THR 163 -1.095 1.428 1.428 618 HB THR 163 HB THR 163 -3.637 1.749 1.749 619 HG1 THR 163 1HG THR 163 -3.038 0.253 0.253 620 1HG2 THR 163 2HG2 THR 163 -1.820 0.004 0.004 621 2HG2 THR 163 1HG2 THR 163 -1.826 -0.632 -0.632 622 3HG2 THR 163 3HG2 THR 163 -3.274 -0.864 -0.864 623 H LYS 164 H LYS 164 -0.800 4.000 4.000 624 HA LYS 164 HA LYS 164 0.360 4.031 4.031 625 1HB LYS 164 2HB LYS 164 -0.335 6.466 6.466 626 2HB LYS 164 1HB LYS 164 0.673 6.547 6.547 627 1HG LYS 164 2HG LYS 164 -1.256 5.713 5.713 628 2HG LYS 164 1HG LYS 164 -2.271 5.638 5.638 629 1HD LYS 164 2HD LYS 164 -1.977 8.104 8.104 630 2HD LYS 164 1HD LYS 164 -0.987 8.182 8.182 631 1HE LYS 164 2HE LYS 164 -2.963 7.385 7.385 632 2HE LYS 164 1HE LYS 164 -3.956 7.319 7.319 633 1HZ LYS 164 1HZ LYS 164 -3.562 9.674 9.674 634 2HZ LYS 164 3HZ LYS 164 -2.640 9.731 9.731 635 3HZ LYS 164 2HZ LYS 164 -4.293 9.349 9.349 636 H ILE 165 H ILE 165 2.271 2.938 2.938 637 HA ILE 165 HA ILE 165 3.588 3.427 3.427 638 HB ILE 165 HB ILE 165 4.738 2.224 2.224 639 1HG1 ILE 165 2HG1 ILE 165 2.330 1.228 1.228 640 2HG1 ILE 165 1HG1 ILE 165 3.404 0.460 0.460 641 1HG2 ILE 165 3HG2 ILE 165 6.414 2.595 2.595 642 2HG2 ILE 165 2HG2 ILE 165 5.471 1.726 1.726 643 3HG2 ILE 165 1HG2 ILE 165 6.144 0.850 0.850 644 1HD1 ILE 165 3HD1 ILE 165 4.649 -0.671 -0.671 645 2HD1 ILE 165 2HD1 ILE 165 3.583 0.194 0.194 646 3HD1 ILE 165 1HD1 ILE 165 2.896 -1.036 -1.036 647 H GLU 166 H GLU 166 5.415 4.489 4.489 648 HA GLU 166 HA GLU 166 6.070 6.601 6.601 649 1HB GLU 166 2HB GLU 166 6.216 6.632 6.632 650 2HB GLU 166 1HB GLU 166 6.775 7.969 7.969 651 1HG GLU 166 2HG GLU 166 4.432 8.307 8.307 652 2HG GLU 166 1HG GLU 166 3.861 6.940 6.940 653 H GLY 167 H GLY 167 7.737 5.214 5.214 654 1HA GLY 167 2HA GLY 167 9.970 4.684 4.684 655 2HA GLY 167 1HA GLY 167 10.123 5.174 5.174 656 H ARG 168 H ARG 168 11.146 3.494 3.494 657 HA ARG 168 HA ARG 168 10.234 0.836 0.836 658 1HB ARG 168 2HB ARG 168 12.729 1.756 1.756 659 2HB ARG 168 1HB ARG 168 12.522 1.700 1.700 660 1HG ARG 168 2HG ARG 168 11.988 -0.875 -0.875 661 2HG ARG 168 1HG ARG 168 12.540 -0.600 -0.600 662 1HD ARG 168 2HD ARG 168 14.378 -1.525 -1.525 663 2HD ARG 168 1HD ARG 168 14.786 0.174 0.174 664 HE ARG 168 HE ARG 168 13.965 0.916 0.916 665 1HH1 ARG 168 1HH1 ARG 168 14.776 -2.555 -2.555 666 2HH1 ARG 168 2HH1 ARG 168 14.987 -2.809 -2.809 667 1HH2 ARG 168 1HH2 ARG 168 14.250 0.538 0.538 668 2HH2 ARG 168 2HH2 ARG 168 14.687 -1.036 -1.036 669 H GLN 169 H GLN 169 8.491 2.495 2.495 670 HA GLN 169 HA GLN 169 8.229 1.057 1.057 671 1HB GLN 169 2HB GLN 169 9.099 3.934 3.934 672 2HB GLN 169 1HB GLN 169 8.372 3.195 3.195 673 1HG GLN 169 2HG GLN 169 10.412 1.670 1.670 674 2HG GLN 169 1HG GLN 169 11.150 2.595 2.595 675 1HE2 GLN 169 1HE2 GLN 169 9.395 3.277 3.277 676 2HE2 GLN 169 2HE2 GLN 169 10.415 4.578 4.578 677 H MET 170 H MET 170 6.166 1.846 1.846 678 HA MET 170 HA MET 170 4.881 4.031 4.031 679 1HB MET 170 2HB MET 170 4.088 2.000 2.000 680 2HB MET 170 1HB MET 170 3.641 1.223 1.223 681 1HG MET 170 2HG MET 170 1.861 2.896 2.896 682 2HG MET 170 1HG MET 170 2.481 3.801 3.801 683 1HE MET 170 2HE MET 170 1.810 -0.073 -0.073 684 2HE MET 170 1HE MET 170 0.359 0.815 0.815 685 3HE MET 170 3HE MET 170 0.232 -0.275 -0.275 686 H ILE 171 H ILE 171 4.199 5.443 5.443 687 HA ILE 171 HA ILE 171 3.612 4.388 4.388 688 HB ILE 171 HB ILE 171 3.025 7.065 7.065 689 1HG1 ILE 171 2HG1 ILE 171 5.462 6.293 6.293 690 2HG1 ILE 171 1HG1 ILE 171 4.929 7.918 7.918 691 1HG2 ILE 171 2HG2 ILE 171 2.472 5.981 5.981 692 2HG2 ILE 171 1HG2 ILE 171 2.704 7.769 7.769 693 3HG2 ILE 171 3HG2 ILE 171 1.328 6.945 6.945 694 1HD1 ILE 171 3HD1 ILE 171 4.857 5.282 5.282 695 2HD1 ILE 171 2HD1 ILE 171 6.155 6.522 6.522 696 3HD1 ILE 171 1HD1 ILE 171 4.443 6.847 6.847 697 H MET 172 H MET 172 1.803 3.571 3.571 698 HA MET 172 HA MET 172 -0.841 4.328 4.328 699 1HB MET 172 2HB MET 172 -0.601 1.877 1.877 700 2HB MET 172 1HB MET 172 0.213 1.888 1.888 701 1HG MET 172 2HG MET 172 -1.831 2.493 2.493 702 2HG MET 172 1HG MET 172 -2.526 3.084 3.084 703 1HE MET 172 1HE MET 172 -2.387 0.720 0.720 704 2HE MET 172 3HE MET 172 -3.244 -0.725 -0.725 705 3HE MET 172 2HE MET 172 -1.461 -0.574 -0.574 706 H VAL 173 H VAL 173 -2.133 5.509 5.509 707 HA VAL 173 HA VAL 173 -0.558 6.256 6.256 708 HB VAL 173 HB VAL 173 -3.034 7.603 7.603 709 1HG1 VAL 173 2HG1 VAL 173 -1.025 7.870 7.870 710 2HG1 VAL 173 1HG1 VAL 173 -1.602 9.425 9.425 711 3HG1 VAL 173 3HG1 VAL 173 -2.779 8.297 8.297 712 1HG2 VAL 173 1HG2 VAL 173 -0.045 8.057 8.057 713 2HG2 VAL 173 3HG2 VAL 173 -1.347 7.651 7.651 714 3HG2 VAL 173 2HG2 VAL 173 -1.337 9.263 9.263 715 H LEU 174 H LEU 174 -1.436 5.682 5.682 716 HA LEU 174 HA LEU 174 -3.975 4.271 4.271 717 1HB LEU 174 2HB LEU 174 -1.581 3.182 3.182 718 2HB LEU 174 1HB LEU 174 -1.616 3.508 3.508 719 HG LEU 174 HG LEU 174 -2.336 1.226 1.226 720 1HD1 LEU 174 3HD1 LEU 174 -2.100 1.647 1.647 721 2HD1 LEU 174 2HD1 LEU 174 -3.911 1.826 1.826 722 3HD1 LEU 174 1HD1 LEU 174 -3.132 0.305 0.305 723 1HD2 LEU 174 1HD2 LEU 174 -4.215 2.366 2.366 724 2HD2 LEU 174 3HD2 LEU 174 -4.818 0.980 0.980 725 3HD2 LEU 174 2HD2 LEU 174 -4.904 2.703 2.703 726 H ALA 175 H ALA 175 -5.341 5.974 5.974 727 HA ALA 175 HA ALA 175 -4.653 7.347 7.347 728 1HB ALA 175 3HB ALA 175 -5.862 8.297 8.297 729 2HB ALA 175 2HB ALA 175 -7.240 7.177 7.177 730 3HB ALA 175 1HB ALA 175 -6.875 8.600 8.600 731 HA PRO 176 HA PRO 176 -7.920 5.700 5.700 732 1HB PRO 176 2HB PRO 176 -8.826 8.597 8.597 733 2HB PRO 176 1HB PRO 176 -8.629 7.416 7.416 734 1HG PRO 176 2HG PRO 176 -6.744 9.365 9.365 735 2HG PRO 176 1HG PRO 176 -6.224 7.664 7.664 736 1HD PRO 176 2HD PRO 176 -6.320 9.055 9.055 737 2HD PRO 176 1HD PRO 176 -5.072 7.931 7.931 738 H LYS 177 H LYS 177 -9.964 4.877 4.877 739 HA LYS 177 HA LYS 177 -10.889 5.712 5.712 740 1HB LYS 177 2HB LYS 177 -12.499 3.979 3.979 741 2HB LYS 177 1HB LYS 177 -11.126 3.409 3.409 742 1HG LYS 177 2HG LYS 177 -12.394 4.364 4.364 743 2HG LYS 177 1HG LYS 177 -13.823 4.552 4.552 744 1HD LYS 177 2HD LYS 177 -12.461 1.988 1.988 745 2HD LYS 177 1HD LYS 177 -14.142 2.547 2.547 746 1HE LYS 177 2HE LYS 177 -12.903 1.586 1.586 747 2HE LYS 177 1HE LYS 177 -14.136 0.742 0.742 748 1HZ LYS 177 2HZ LYS 177 -14.514 3.362 3.362 749 2HZ LYS 177 1HZ LYS 177 -15.123 1.864 1.864 750 3HZ LYS 177 3HZ LYS 177 -15.664 2.542 2.542 751 H LYS 178 H LYS 178 -12.937 6.569 6.569 752 HA LYS 178 HA LYS 178 -13.962 8.637 8.637 753 1HB LYS 178 2HB LYS 178 -14.058 8.749 8.749 754 2HB LYS 178 1HB LYS 178 -15.080 7.276 7.276 755 1HG LYS 178 2HG LYS 178 -16.414 9.288 9.288 756 2HG LYS 178 1HG LYS 178 -16.933 8.524 8.524 757 1HD LYS 178 2HD LYS 178 -15.615 10.245 10.245 758 2HD LYS 178 1HD LYS 178 -15.040 10.951 10.951 759 1HE LYS 178 2HE LYS 178 -16.914 12.293 12.293 760 2HE LYS 178 1HE LYS 178 -17.436 11.511 11.511 761 1HZ LYS 178 1HZ LYS 178 -17.991 10.508 10.508 762 2HZ LYS 178 3HZ LYS 178 -19.082 11.317 11.317 763 3HZ LYS 178 2HZ LYS 178 -18.489 9.785 9.785 764 H LYS 179 H LYS 179 -15.183 8.290 8.290 765 HA LYS 179 HA LYS 179 -16.401 5.755 5.755 766 1HB LYS 179 2HB LYS 179 -16.737 8.363 8.363 767 2HB LYS 179 1HB LYS 179 -17.192 6.715 6.715 768 1HG LYS 179 2HG LYS 179 -14.331 7.729 7.729 769 2HG LYS 179 1HG LYS 179 -15.078 7.568 7.568 770 1HD LYS 179 2HD LYS 179 -15.242 5.103 5.103 771 2HD LYS 179 1HD LYS 179 -14.546 5.231 5.231 772 1HE LYS 179 2HE LYS 179 -12.419 6.164 6.164 773 2HE LYS 179 1HE LYS 179 -13.099 6.011 6.011 774 1HZ LYS 179 2HZ LYS 179 -12.682 3.793 3.793 775 2HZ LYS 179 1HZ LYS 179 -11.711 4.158 4.158 776 3HZ LYS 179 3HZ LYS 179 -13.315 3.646 3.646 777 H GLN 180 H GLN 180 -18.143 5.237 5.237 778 HA GLN 180 HA GLN 180 -19.852 7.335 7.335 779 1HB GLN 180 2HB GLN 180 -21.139 5.575 5.575 780 2HB GLN 180 1HB GLN 180 -19.412 5.591 5.591 781 1HG GLN 180 2HG GLN 180 -20.568 3.602 3.602 782 2HG GLN 180 1HG GLN 180 -20.505 3.295 3.295 783 1HE2 GLN 180 1HE2 GLN 180 -18.888 2.731 2.731 784 2HE2 GLN 180 2HE2 GLN 180 -17.277 2.499 2.499 Start of MODEL 7 1 HA VAL 90 HA VAL 90 -3.762 17.396 17.396 2 HB VAL 90 HB VAL 90 -5.700 17.518 17.518 3 1HG1 VAL 90 2HG1 VAL 90 -6.344 18.600 18.600 4 2HG1 VAL 90 1HG1 VAL 90 -7.014 16.993 16.993 5 3HG1 VAL 90 3HG1 VAL 90 -7.753 17.868 17.868 6 1HG2 VAL 90 3HG2 VAL 90 -6.668 14.887 14.887 7 2HG2 VAL 90 2HG2 VAL 90 -5.973 15.063 15.063 8 3HG2 VAL 90 1HG2 VAL 90 -7.543 15.807 15.807 9 H ILE 91 H ILE 91 -4.354 15.317 15.317 10 HA ILE 91 HA ILE 91 -3.447 12.855 12.855 11 HB ILE 91 HB ILE 91 -4.323 13.471 13.471 12 1HG1 ILE 91 2HG1 ILE 91 -6.215 13.692 13.692 13 2HG1 ILE 91 1HG1 ILE 91 -6.363 12.150 12.150 14 1HG2 ILE 91 1HG2 ILE 91 -3.554 10.830 10.830 15 2HG2 ILE 91 3HG2 ILE 91 -4.522 10.914 10.914 16 3HG2 ILE 91 2HG2 ILE 91 -2.843 11.539 11.539 17 1HD1 ILE 91 2HD1 ILE 91 -5.352 10.938 10.938 18 2HD1 ILE 91 1HD1 ILE 91 -5.413 12.503 12.503 19 3HD1 ILE 91 3HD1 ILE 91 -6.943 11.734 11.734 20 H GLN 92 H GLN 92 -1.372 11.998 11.998 21 HA GLN 92 HA GLN 92 0.586 13.712 13.712 22 1HB GLN 92 2HB GLN 92 0.796 11.025 11.025 23 2HB GLN 92 1HB GLN 92 2.151 12.132 12.132 24 1HG GLN 92 2HG GLN 92 1.517 12.161 12.161 25 2HG GLN 92 1HG GLN 92 1.302 13.795 13.795 26 1HE2 GLN 92 1HE2 GLN 92 -0.278 14.823 14.823 27 2HE2 GLN 92 2HE2 GLN 92 -1.845 14.171 14.171 28 H VAL 93 H VAL 93 2.365 12.632 12.632 29 HA VAL 93 HA VAL 93 1.367 10.200 10.200 30 HB VAL 93 HB VAL 93 3.681 12.007 12.007 31 1HG1 VAL 93 3HG1 VAL 93 2.721 9.177 9.177 32 2HG1 VAL 93 2HG1 VAL 93 3.779 10.142 10.142 33 3HG1 VAL 93 1HG1 VAL 93 4.446 9.585 9.585 34 1HG2 VAL 93 3HG2 VAL 93 1.208 12.405 12.405 35 2HG2 VAL 93 2HG2 VAL 93 2.404 12.025 12.025 36 3HG2 VAL 93 1HG2 VAL 93 1.361 10.703 10.703 37 H LYS 94 H LYS 94 1.815 8.528 8.528 38 HA LYS 94 HA LYS 94 4.764 8.304 8.304 39 1HB LYS 94 2HB LYS 94 2.771 6.239 6.239 40 2HB LYS 94 1HB LYS 94 4.459 6.452 6.452 41 1HG LYS 94 2HG LYS 94 2.190 8.471 8.471 42 2HG LYS 94 1HG LYS 94 2.670 7.193 7.193 43 1HD LYS 94 2HD LYS 94 4.980 8.131 8.131 44 2HD LYS 94 1HD LYS 94 4.493 9.477 9.477 45 1HE LYS 94 2HE LYS 94 4.413 10.230 10.230 46 2HE LYS 94 1HE LYS 94 2.727 10.161 10.161 47 1HZ LYS 94 2HZ LYS 94 4.043 8.077 8.077 48 2HZ LYS 94 1HZ LYS 94 2.896 9.214 9.214 49 3HZ LYS 94 3HZ LYS 94 2.457 8.027 8.027 50 H GLU 95 H GLU 95 5.462 5.892 5.892 51 HA GLU 95 HA GLU 95 4.187 5.303 5.303 52 1HB GLU 95 2HB GLU 95 6.335 6.721 6.721 53 2HB GLU 95 1HB GLU 95 7.103 5.194 5.194 54 1HG GLU 95 2HG GLU 95 6.505 4.091 4.091 55 2HG GLU 95 1HG GLU 95 5.665 5.601 5.601 56 H ILE 96 H ILE 96 4.472 3.085 3.085 57 HA ILE 96 HA ILE 96 6.062 1.350 1.350 58 HB ILE 96 HB ILE 96 3.302 1.159 1.159 59 1HG1 ILE 96 2HG1 ILE 96 3.640 -1.334 -1.334 60 2HG1 ILE 96 1HG1 ILE 96 5.348 -1.164 -1.164 61 1HG2 ILE 96 1HG2 ILE 96 3.029 0.911 0.911 62 2HG2 ILE 96 3HG2 ILE 96 3.861 -0.722 -0.722 63 3HG2 ILE 96 2HG2 ILE 96 2.396 -0.474 -0.474 64 1HD1 ILE 96 1HD1 ILE 96 3.988 0.357 0.357 65 2HD1 ILE 96 3HD1 ILE 96 5.111 -1.044 -1.044 66 3HD1 ILE 96 2HD1 ILE 96 5.720 0.525 0.525 67 H LYS 97 H LYS 97 6.837 -0.503 -0.503 68 HA LYS 97 HA LYS 97 6.178 0.195 0.195 69 1HB LYS 97 2HB LYS 97 8.627 -1.410 -1.410 70 2HB LYS 97 1HB LYS 97 8.000 -1.038 -1.038 71 1HG LYS 97 2HG LYS 97 8.278 1.430 1.430 72 2HG LYS 97 1HG LYS 97 9.082 1.002 1.002 73 1HD LYS 97 2HD LYS 97 10.878 -0.195 -0.195 74 2HD LYS 97 1HD LYS 97 10.037 0.163 0.163 75 1HE LYS 97 2HE LYS 97 10.339 2.626 2.626 76 2HE LYS 97 1HE LYS 97 11.197 2.274 2.274 77 1HZ LYS 97 2HZ LYS 97 12.038 1.362 1.362 78 2HZ LYS 97 1HZ LYS 97 12.707 2.650 2.650 79 3HZ LYS 97 3HZ LYS 97 12.846 1.060 1.060 80 H PHE 98 H PHE 98 5.850 -1.709 -1.709 81 HA PHE 98 HA PHE 98 5.574 -4.168 -4.168 82 1HB PHE 98 2HB PHE 98 3.457 -2.988 -2.988 83 2HB PHE 98 1HB PHE 98 3.719 -4.772 -4.772 84 HD1 PHE 98 1HD PHE 98 4.035 -5.618 -5.618 85 HD2 PHE 98 2HD PHE 98 1.619 -2.562 -2.562 86 HE1 PHE 98 1HE PHE 98 2.778 -5.640 -5.640 87 HE2 PHE 98 2HE PHE 98 0.306 -2.535 -2.535 88 HZ PHE 98 HZ PHE 98 0.765 -4.231 -4.231 89 H ARG 99 H ARG 99 6.056 -5.985 -5.985 90 HA ARG 99 HA ARG 99 8.071 -5.253 -5.253 91 1HB ARG 99 2HB ARG 99 7.304 -7.848 -7.848 92 2HB ARG 99 1HB ARG 99 8.673 -7.633 -7.633 93 1HG ARG 99 2HG ARG 99 9.963 -7.348 -7.348 94 2HG ARG 99 1HG ARG 99 9.302 -5.684 -5.684 95 1HD ARG 99 2HD ARG 99 8.033 -8.099 -8.099 96 2HD ARG 99 1HD ARG 99 9.408 -7.140 -7.140 97 HE ARG 99 HE ARG 99 7.386 -5.281 -5.281 98 1HH1 ARG 99 1HH2 ARG 99 7.945 -7.968 -7.968 99 2HH1 ARG 99 2HH2 ARG 99 6.982 -7.294 -7.294 100 1HH2 ARG 99 1HH1 ARG 99 6.076 -4.367 -4.367 101 2HH2 ARG 99 2HH1 ARG 99 5.911 -5.226 -5.226 102 HA PRO 100 HA PRO 100 5.998 -7.034 -7.034 103 1HB PRO 100 2HB PRO 100 8.292 -8.140 -8.140 104 2HB PRO 100 1HB PRO 100 7.872 -6.382 -6.382 105 1HG PRO 100 2HG PRO 100 9.786 -7.717 -7.717 106 2HG PRO 100 1HG PRO 100 10.048 -6.239 -6.239 107 1HD PRO 100 2HD PRO 100 9.255 -5.937 -5.937 108 2HD PRO 100 1HD PRO 100 8.341 -4.993 -4.993 109 H GLY 101 H GLY 101 4.873 -8.788 -8.788 110 1HA GLY 101 2HA GLY 101 3.983 -10.551 -10.551 111 2HA GLY 101 1HA GLY 101 5.122 -11.326 -11.326 112 H THR 102 H THR 102 3.982 -11.034 -11.034 113 HA THR 102 HA THR 102 5.895 -12.593 -12.593 114 HB THR 102 HB THR 102 5.559 -9.606 -9.606 115 HG1 THR 102 1HG THR 102 7.855 -11.177 -11.177 116 1HG2 THR 102 1HG2 THR 102 6.798 -12.007 -12.007 117 2HG2 THR 102 3HG2 THR 102 7.282 -10.299 -10.299 118 3HG2 THR 102 2HG2 THR 102 5.587 -10.813 -10.813 119 H ASP 103 H ASP 103 4.404 -13.736 -13.736 120 HA ASP 103 HA ASP 103 2.324 -12.281 -12.281 121 1HB ASP 103 2HB ASP 103 1.904 -13.927 -13.927 122 2HB ASP 103 1HB ASP 103 2.383 -15.196 -15.196 123 H GLU 104 H GLU 104 3.550 -15.537 -15.537 124 HA GLU 104 HA GLU 104 1.057 -14.230 -14.230 125 1HB GLU 104 2HB GLU 104 1.252 -16.708 -16.708 126 2HB GLU 104 1HB GLU 104 2.259 -16.558 -16.558 127 1HG GLU 104 2HG GLU 104 0.305 -15.494 -15.494 128 2HG GLU 104 1HG GLU 104 -0.666 -15.579 -15.579 129 H GLY 105 H GLY 105 3.409 -15.263 -15.263 130 1HA GLY 105 2HA GLY 105 2.751 -12.704 -12.704 131 2HA GLY 105 1HA GLY 105 3.351 -14.202 -14.202 132 H ASP 106 H ASP 106 4.574 -12.688 -12.688 133 HA ASP 106 HA ASP 106 6.554 -11.244 -11.244 134 1HB ASP 106 2HB ASP 106 7.246 -12.622 -12.622 135 2HB ASP 106 1HB ASP 106 6.333 -11.491 -11.491 136 H TYR 107 H TYR 107 3.941 -11.284 -11.284 137 HA TYR 107 HA TYR 107 3.909 -8.469 -8.469 138 1HB TYR 107 2HB TYR 107 3.322 -10.299 -10.299 139 2HB TYR 107 1HB TYR 107 2.019 -10.862 -10.862 140 HD1 TYR 107 1HD TYR 107 1.899 -7.254 -7.254 141 HD2 TYR 107 2HD TYR 107 1.043 -10.833 -10.833 142 HE1 TYR 107 1HE TYR 107 -0.320 -6.401 -6.401 143 HE2 TYR 107 2HE TYR 107 -0.846 -9.779 -9.779 144 HH TYR 107 HH TYR 107 -2.084 -6.718 -6.718 145 H GLN 108 H GLN 108 1.114 -10.479 -10.479 146 HA GLN 108 HA GLN 108 -0.036 -8.495 -8.495 147 1HB GLN 108 2HB GLN 108 -0.774 -11.036 -11.036 148 2HB GLN 108 1HB GLN 108 -1.720 -9.765 -9.765 149 1HG GLN 108 2HG GLN 108 -0.059 -11.610 -11.610 150 2HG GLN 108 1HG GLN 108 -1.434 -12.220 -12.220 151 1HE2 GLN 108 1HE2 GLN 108 -0.712 -8.881 -8.881 152 2HE2 GLN 108 2HE2 GLN 108 -2.057 -8.809 -8.809 153 H VAL 109 H VAL 109 2.582 -9.863 -9.863 154 HA VAL 109 HA VAL 109 2.144 -9.070 -9.070 155 HB VAL 109 HB VAL 109 4.667 -9.345 -9.345 156 1HG1 VAL 109 1HG1 VAL 109 4.388 -8.553 -8.553 157 2HG1 VAL 109 3HG1 VAL 109 5.884 -9.260 -9.260 158 3HG1 VAL 109 2HG1 VAL 109 5.309 -7.672 -7.672 159 1HG2 VAL 109 1HG2 VAL 109 3.382 -11.435 -11.435 160 2HG2 VAL 109 3HG2 VAL 109 4.990 -11.360 -11.360 161 3HG2 VAL 109 2HG2 VAL 109 3.492 -10.981 -10.981 162 H LYS 110 H LYS 110 3.340 -7.411 -7.411 163 HA LYS 110 HA LYS 110 3.312 -4.885 -4.885 164 1HB LYS 110 2HB LYS 110 4.249 -5.756 -5.756 165 2HB LYS 110 1HB LYS 110 4.207 -4.062 -4.062 166 1HG LYS 110 2HG LYS 110 5.911 -6.366 -6.366 167 2HG LYS 110 1HG LYS 110 6.336 -4.648 -4.648 168 1HD LYS 110 2HD LYS 110 5.509 -3.793 -3.793 169 2HD LYS 110 1HD LYS 110 5.082 -5.459 -5.459 170 1HE LYS 110 2HE LYS 110 7.507 -6.132 -6.132 171 2HE LYS 110 1HE LYS 110 7.932 -4.431 -4.431 172 1HZ LYS 110 1HZ LYS 110 6.608 -5.284 -5.284 173 2HZ LYS 110 3HZ LYS 110 8.235 -4.841 -4.841 174 3HZ LYS 110 2HZ LYS 110 7.010 -3.692 -3.692 175 H LEU 111 H LEU 111 1.029 -6.649 -6.649 176 HA LEU 111 HA LEU 111 -0.462 -4.349 -4.349 177 1HB LEU 111 2HB LEU 111 -0.780 -6.715 -6.715 178 2HB LEU 111 1HB LEU 111 -1.506 -7.150 -7.150 179 HG LEU 111 HG LEU 111 -2.536 -4.785 -4.785 180 1HD1 LEU 111 2HD1 LEU 111 -2.219 -6.697 -6.697 181 2HD1 LEU 111 1HD1 LEU 111 -3.292 -7.719 -7.719 182 3HD1 LEU 111 3HD1 LEU 111 -3.951 -6.246 -6.246 183 1HD2 LEU 111 2HD2 LEU 111 -3.916 -6.929 -6.929 184 2HD2 LEU 111 1HD2 LEU 111 -3.606 -5.209 -5.209 185 3HD2 LEU 111 3HD2 LEU 111 -4.788 -5.604 -5.604 186 H ARG 112 H ARG 112 0.220 -6.460 -6.460 187 HA ARG 112 HA ARG 112 -1.575 -5.406 -5.406 188 1HB ARG 112 2HB ARG 112 0.213 -7.442 -7.442 189 2HB ARG 112 1HB ARG 112 1.084 -6.221 -6.221 190 1HG ARG 112 2HG ARG 112 -0.977 -6.067 -6.067 191 2HG ARG 112 1HG ARG 112 -1.741 -7.339 -7.339 192 1HD ARG 112 2HD ARG 112 -0.777 -8.549 -8.549 193 2HD ARG 112 1HD ARG 112 0.386 -8.788 -8.788 194 HE ARG 112 HE ARG 112 0.679 -6.641 -6.641 195 1HH1 ARG 112 1HH2 ARG 112 2.129 -9.156 -9.156 196 2HH1 ARG 112 2HH2 ARG 112 3.742 -8.876 -8.876 197 1HH2 ARG 112 1HH1 ARG 112 2.844 -6.291 -6.291 198 2HH2 ARG 112 2HH1 ARG 112 4.153 -7.232 -7.232 199 H SER 113 H SER 113 1.964 -4.403 -4.403 200 HA SER 113 HA SER 113 1.939 -2.455 -2.455 201 1HB SER 113 2HB SER 113 3.482 -2.529 -2.529 202 2HB SER 113 1HB SER 113 3.645 -1.294 -1.294 203 HG SER 113 HG SER 113 3.989 -2.992 -2.992 204 H LEU 114 H LEU 114 0.668 -2.362 -2.362 205 HA LEU 114 HA LEU 114 0.144 0.354 0.354 206 1HB LEU 114 2HB LEU 114 -1.087 -1.991 -1.991 207 2HB LEU 114 1HB LEU 114 -1.719 -0.322 -0.322 208 HG LEU 114 HG LEU 114 1.217 -1.106 -1.106 209 1HD1 LEU 114 2HD1 LEU 114 -1.199 -0.771 -0.771 210 2HD1 LEU 114 1HD1 LEU 114 0.508 -1.007 -1.007 211 3HD1 LEU 114 3HD1 LEU 114 -0.328 -2.294 -2.294 212 1HD2 LEU 114 2HD2 LEU 114 -0.443 1.445 1.445 213 2HD2 LEU 114 1HD2 LEU 114 1.070 1.279 1.279 214 3HD2 LEU 114 3HD2 LEU 114 1.113 1.226 1.226 215 H ILE 115 H ILE 115 -1.903 -2.282 -2.282 216 HA ILE 115 HA ILE 115 -4.191 -0.814 -0.814 217 HB ILE 115 HB ILE 115 -3.377 -2.372 -2.372 218 1HG1 ILE 115 2HG1 ILE 115 -2.769 -3.923 -3.923 219 2HG1 ILE 115 1HG1 ILE 115 -4.172 -4.464 -4.464 220 1HG2 ILE 115 1HG2 ILE 115 -5.852 -1.733 -1.733 221 2HG2 ILE 115 3HG2 ILE 115 -5.895 -2.819 -2.819 222 3HG2 ILE 115 2HG2 ILE 115 -5.418 -1.091 -1.091 223 1HD1 ILE 115 3HD1 ILE 115 -5.692 -3.604 -3.604 224 2HD1 ILE 115 2HD1 ILE 115 -4.151 -3.279 -3.279 225 3HD1 ILE 115 1HD1 ILE 115 -4.616 -4.974 -4.974 226 H ARG 116 H ARG 116 -1.458 -1.179 -1.179 227 HA ARG 116 HA ARG 116 -2.095 0.426 0.426 228 1HB ARG 116 2HB ARG 116 0.048 -1.107 -1.107 229 2HB ARG 116 1HB ARG 116 0.789 0.445 0.445 230 1HG ARG 116 2HG ARG 116 1.359 0.105 0.105 231 2HG ARG 116 1HG ARG 116 0.138 1.421 1.421 232 1HD ARG 116 2HD ARG 116 -1.643 -0.276 -0.276 233 2HD ARG 116 1HD ARG 116 -0.379 -1.566 -1.566 234 HE ARG 116 HE ARG 116 0.574 -0.702 -0.702 235 1HH1 ARG 116 1HH2 ARG 116 -1.990 1.484 1.484 236 2HH1 ARG 116 2HH2 ARG 116 -2.088 2.391 2.391 237 1HH2 ARG 116 1HH1 ARG 116 0.421 0.530 0.530 238 2HH2 ARG 116 2HH1 ARG 116 -0.703 1.843 1.843 239 H PHE 117 H PHE 117 -0.474 1.469 1.469 240 HA PHE 117 HA PHE 117 -0.028 4.140 4.140 241 1HB PHE 117 2HB PHE 117 -0.409 2.850 2.850 242 2HB PHE 117 1HB PHE 117 -0.177 4.658 4.658 243 HD1 PHE 117 2HD PHE 117 1.565 5.444 5.444 244 HD2 PHE 117 1HD PHE 117 1.314 1.438 1.438 245 HE1 PHE 117 2HE PHE 117 3.979 5.165 5.165 246 HE2 PHE 117 1HE PHE 117 3.697 1.037 1.037 247 HZ PHE 117 HZ PHE 117 5.027 2.942 2.942 248 H LEU 118 H LEU 118 -2.860 2.757 2.757 249 HA LEU 118 HA LEU 118 -4.304 5.208 5.208 250 1HB LEU 118 2HB LEU 118 -4.987 2.362 2.362 251 2HB LEU 118 1HB LEU 118 -6.167 3.728 3.728 252 HG LEU 118 HG LEU 118 -3.566 4.533 4.533 253 1HD1 LEU 118 3HD1 LEU 118 -3.994 1.794 1.794 254 2HD1 LEU 118 2HD1 LEU 118 -4.444 2.678 2.678 255 3HD1 LEU 118 1HD1 LEU 118 -2.809 2.993 2.993 256 1HD2 LEU 118 1HD2 LEU 118 -5.713 5.547 5.547 257 2HD2 LEU 118 3HD2 LEU 118 -4.870 5.083 5.083 258 3HD2 LEU 118 2HD2 LEU 118 -6.279 4.107 4.107 259 H GLU 119 H GLU 119 -3.987 2.857 2.857 260 HA GLU 119 HA GLU 119 -6.371 3.547 3.547 261 1HB GLU 119 2HB GLU 119 -3.853 2.027 2.027 262 2HB GLU 119 1HB GLU 119 -5.004 2.551 2.551 263 1HG GLU 119 2HG GLU 119 -6.841 1.266 1.266 264 2HG GLU 119 1HG GLU 119 -5.785 0.793 0.793 265 H GLU 120 H GLU 120 -2.941 4.612 4.612 266 HA GLU 120 HA GLU 120 -3.274 6.402 6.402 267 1HB GLU 120 2HB GLU 120 -1.442 6.876 6.876 268 2HB GLU 120 1HB GLU 120 -1.306 7.605 7.605 269 1HG GLU 120 2HG GLU 120 -0.788 5.232 5.232 270 2HG GLU 120 1HG GLU 120 -0.698 4.708 4.708 271 H GLY 121 H GLY 121 -4.149 6.373 6.373 272 1HA GLY 121 2HA GLY 121 -5.483 7.704 7.704 273 2HA GLY 121 1HA GLY 121 -5.396 8.926 8.926 274 H ASP 122 H ASP 122 -3.222 7.174 7.174 275 HA ASP 122 HA ASP 122 -2.128 9.751 9.751 276 1HB ASP 122 2HB ASP 122 -0.579 7.105 7.105 277 2HB ASP 122 1HB ASP 122 0.057 8.766 8.766 278 H LYS 123 H LYS 123 -1.220 9.251 9.251 279 HA LYS 123 HA LYS 123 -3.026 7.350 7.350 280 1HB LYS 123 2HB LYS 123 -3.272 9.747 9.747 281 2HB LYS 123 1HB LYS 123 -1.483 9.857 9.857 282 1HG LYS 123 2HG LYS 123 -1.941 7.888 7.888 283 2HG LYS 123 1HG LYS 123 -3.281 9.058 9.058 284 1HD LYS 123 2HD LYS 123 -0.260 9.540 9.540 285 2HD LYS 123 1HD LYS 123 -1.469 9.865 9.865 286 1HE LYS 123 2HE LYS 123 -2.503 11.565 11.565 287 2HE LYS 123 1HE LYS 123 -0.811 11.429 11.429 288 1HZ LYS 123 1HZ LYS 123 0.039 12.086 12.086 289 2HZ LYS 123 3HZ LYS 123 -1.528 12.188 12.188 290 3HZ LYS 123 2HZ LYS 123 -1.046 13.255 13.255 291 H ALA 124 H ALA 124 -1.800 5.456 5.456 292 HA ALA 124 HA ALA 124 1.084 5.931 5.931 293 1HB ALA 124 1HB ALA 124 0.121 3.708 3.708 294 2HB ALA 124 3HB ALA 124 -0.332 3.449 3.449 295 3HB ALA 124 2HB ALA 124 1.399 3.605 3.605 296 H LYS 125 H LYS 125 2.345 5.737 5.737 297 HA LYS 125 HA LYS 125 0.575 5.519 5.519 298 1HB LYS 125 2HB LYS 125 3.411 6.788 6.788 299 2HB LYS 125 1HB LYS 125 2.674 6.364 6.364 300 1HG LYS 125 2HG LYS 125 0.801 7.938 7.938 301 2HG LYS 125 1HG LYS 125 1.587 8.453 8.453 302 1HD LYS 125 2HD LYS 125 3.503 9.362 9.362 303 2HD LYS 125 1HD LYS 125 2.966 8.576 8.576 304 1HE LYS 125 2HE LYS 125 0.980 10.028 10.028 305 2HE LYS 125 1HE LYS 125 1.412 10.831 10.831 306 1HZ LYS 125 2HZ LYS 125 3.054 10.804 10.804 307 2HZ LYS 125 1HZ LYS 125 2.123 12.099 12.099 308 3HZ LYS 125 3HZ LYS 125 3.467 11.557 11.557 309 H ILE 126 H ILE 126 0.835 3.552 3.552 310 HA ILE 126 HA ILE 126 2.988 1.899 1.899 311 HB ILE 126 HB ILE 126 1.201 1.408 1.408 312 1HG1 ILE 126 2HG1 ILE 126 -0.542 1.985 1.985 313 2HG1 ILE 126 1HG1 ILE 126 -0.389 0.202 0.202 314 1HG2 ILE 126 2HG2 ILE 126 3.341 0.039 0.039 315 2HG2 ILE 126 1HG2 ILE 126 2.187 -0.468 -0.468 316 3HG2 ILE 126 3HG2 ILE 126 1.816 -0.820 -0.820 317 1HD1 ILE 126 3HD1 ILE 126 1.041 0.698 0.698 318 2HD1 ILE 126 2HD1 ILE 126 0.141 2.246 2.246 319 3HD1 ILE 126 1HD1 ILE 126 -0.760 0.673 0.673 320 H THR 127 H THR 127 4.959 2.087 2.087 321 HA THR 127 HA THR 127 4.920 3.120 3.120 322 HB THR 127 HB THR 127 7.295 2.738 2.738 323 HG1 THR 127 1HG THR 127 5.847 5.036 5.036 324 1HG2 THR 127 2HG2 THR 127 6.838 4.010 4.010 325 2HG2 THR 127 1HG2 THR 127 8.354 4.203 4.203 326 3HG2 THR 127 3HG2 THR 127 7.877 2.580 2.580 327 H LEU 128 H LEU 128 4.852 1.407 1.407 328 HA LEU 128 HA LEU 128 5.723 -1.245 -1.245 329 1HB LEU 128 2HB LEU 128 4.272 0.208 0.208 330 2HB LEU 128 1HB LEU 128 5.611 -0.697 -0.697 331 HG LEU 128 HG LEU 128 3.567 -1.877 -1.877 332 1HD1 LEU 128 1HD1 LEU 128 2.644 -0.680 -0.680 333 2HD1 LEU 128 3HD1 LEU 128 3.283 -2.052 -2.052 334 3HD1 LEU 128 2HD1 LEU 128 2.102 -2.374 -2.374 335 1HD2 LEU 128 1HD2 LEU 128 5.552 -3.368 -3.368 336 2HD2 LEU 128 3HD2 LEU 128 4.093 -4.125 -4.125 337 3HD2 LEU 128 2HD2 LEU 128 5.389 -3.424 -3.424 338 H ARG 129 H ARG 129 7.775 -2.107 -2.107 339 HA ARG 129 HA ARG 129 9.372 -0.148 -0.148 340 1HB ARG 129 2HB ARG 129 9.811 0.338 0.338 341 2HB ARG 129 1HB ARG 129 10.151 -1.413 -1.413 342 1HG ARG 129 2HG ARG 129 11.760 -0.705 -0.705 343 2HG ARG 129 1HG ARG 129 11.779 0.812 0.812 344 1HD ARG 129 2HD ARG 129 12.636 -0.430 -0.430 345 2HD ARG 129 1HD ARG 129 12.581 -1.985 -1.985 346 HE ARG 129 HE ARG 129 14.107 -0.093 -0.093 347 1HH1 ARG 129 1HH2 ARG 129 14.195 -1.860 -1.860 348 2HH1 ARG 129 2HH2 ARG 129 15.921 -1.961 -1.961 349 1HH2 ARG 129 1HH1 ARG 129 16.457 -0.234 -0.234 350 2HH2 ARG 129 2HH1 ARG 129 17.226 -1.023 -1.023 351 H PHE 130 H PHE 130 9.170 -1.402 -1.402 352 HA PHE 130 HA PHE 130 8.920 -4.311 -4.311 353 1HB PHE 130 2HB PHE 130 9.482 -2.550 -2.550 354 2HB PHE 130 1HB PHE 130 8.927 -4.303 -4.303 355 HD1 PHE 130 2HD PHE 130 6.801 -4.922 -4.922 356 HD2 PHE 130 1HD PHE 130 8.036 -0.817 -0.817 357 HE1 PHE 130 2HE PHE 130 4.496 -4.163 -4.163 358 HE2 PHE 130 1HE PHE 130 5.662 -0.145 -0.145 359 HZ PHE 130 HZ PHE 130 3.896 -1.887 -1.887 360 H ARG 131 H ARG 131 11.136 -5.214 -5.214 361 HA ARG 131 HA ARG 131 13.455 -3.584 -3.584 362 1HB ARG 131 2HB ARG 131 13.265 -6.444 -6.444 363 2HB ARG 131 1HB ARG 131 14.801 -5.522 -5.522 364 1HG ARG 131 2HG ARG 131 13.895 -3.744 -3.744 365 2HG ARG 131 1HG ARG 131 12.437 -4.756 -4.756 366 1HD ARG 131 2HD ARG 131 15.349 -5.615 -5.615 367 2HD ARG 131 1HD ARG 131 14.144 -4.971 -4.971 368 HE ARG 131 HE ARG 131 12.940 -7.169 -7.169 369 1HH1 ARG 131 1HH2 ARG 131 15.578 -6.428 -6.428 370 2HH1 ARG 131 2HH2 ARG 131 15.523 -7.964 -7.964 371 1HH2 ARG 131 1HH1 ARG 131 12.869 -9.258 -9.258 372 2HH2 ARG 131 2HH1 ARG 131 13.961 -9.596 -9.596 373 H GLY 132 H GLY 132 12.489 -6.537 -6.537 374 1HA GLY 132 2HA GLY 132 11.499 -6.128 -6.128 375 2HA GLY 132 1HA GLY 132 13.142 -6.666 -6.666 376 H ARG 133 H ARG 133 10.129 -7.595 -7.595 377 HA ARG 133 HA ARG 133 10.963 -10.264 -10.264 378 1HB ARG 133 2HB ARG 133 8.923 -9.692 -9.692 379 2HB ARG 133 1HB ARG 133 8.140 -9.348 -9.348 380 1HG ARG 133 2HG ARG 133 8.282 -11.747 -11.747 381 2HG ARG 133 1HG ARG 133 9.235 -12.098 -12.098 382 1HD ARG 133 2HD ARG 133 7.311 -11.551 -11.551 383 2HD ARG 133 1HD ARG 133 6.341 -10.984 -10.984 384 HE ARG 133 HE ARG 133 6.973 -13.798 -13.798 385 1HH1 ARG 133 1HH1 ARG 133 5.757 -11.535 -11.535 386 2HH1 ARG 133 2HH1 ARG 133 4.909 -12.760 -12.760 387 1HH2 ARG 133 1HH2 ARG 133 5.823 -15.424 -15.424 388 2HH2 ARG 133 2HH2 ARG 133 4.947 -14.995 -14.995 389 H GLU 134 H GLU 134 9.145 -8.930 -8.930 390 HA GLU 134 HA GLU 134 10.642 -10.235 -10.235 391 1HB GLU 134 2HB GLU 134 7.685 -9.409 -9.409 392 2HB GLU 134 1HB GLU 134 8.662 -10.159 -10.159 393 1HG GLU 134 2HG GLU 134 7.827 -11.529 -11.529 394 2HG GLU 134 1HG GLU 134 7.092 -11.787 -11.787 395 H MET 135 H MET 135 10.999 -7.774 -7.774 396 HA MET 135 HA MET 135 11.376 -5.638 -5.638 397 1HB MET 135 2HB MET 135 10.125 -5.459 -5.459 398 2HB MET 135 1HB MET 135 10.886 -4.124 -4.124 399 1HG MET 135 2HG MET 135 13.051 -5.367 -5.367 400 2HG MET 135 1HG MET 135 12.336 -6.646 -6.646 401 1HE MET 135 1HE MET 135 14.321 -6.391 -6.391 402 2HE MET 135 3HE MET 135 14.873 -4.852 -4.852 403 3HE MET 135 2HE MET 135 14.997 -5.083 -5.083 404 H ALA 136 H ALA 136 9.658 -3.498 -3.498 405 HA ALA 136 HA ALA 136 7.531 -4.071 -4.071 406 1HB ALA 136 3HB ALA 136 8.637 -1.836 -1.836 407 2HB ALA 136 2HB ALA 136 8.034 -1.688 -1.688 408 3HB ALA 136 1HB ALA 136 6.871 -1.735 -1.735 409 H HIS 137 H HIS 137 5.683 -5.116 -5.116 410 HA HIS 137 HA HIS 137 4.366 -4.303 -4.303 411 1HB HIS 137 2HB HIS 137 3.964 -7.036 -7.036 412 2HB HIS 137 1HB HIS 137 3.080 -6.290 -6.290 413 HD1 HIS 137 1HD HIS 137 3.680 -7.802 -7.802 414 HD2 HIS 137 2HD HIS 137 7.016 -6.309 -6.309 415 HE1 HIS 137 1HE HIS 137 5.753 -8.418 -8.418 416 H GLN 138 H GLN 138 1.949 -4.593 -4.593 417 HA GLN 138 HA GLN 138 1.068 -3.718 -3.718 418 1HB GLN 138 2HB GLN 138 -0.351 -3.734 -3.734 419 2HB GLN 138 1HB GLN 138 -1.088 -3.181 -3.181 420 1HG GLN 138 2HG GLN 138 0.777 -1.460 -1.460 421 2HG GLN 138 1HG GLN 138 1.325 -1.897 -1.897 422 1HE2 GLN 138 1HE2 GLN 138 -1.825 -2.469 -2.469 423 2HE2 GLN 138 2HE2 GLN 138 -2.436 -0.896 -0.896 424 H GLN 139 H GLN 139 1.935 -6.464 -6.464 425 HA GLN 139 HA GLN 139 -0.434 -7.989 -7.989 426 1HB GLN 139 2HB GLN 139 2.419 -9.015 -9.015 427 2HB GLN 139 1HB GLN 139 0.937 -9.967 -9.967 428 1HG GLN 139 2HG GLN 139 0.161 -8.715 -8.715 429 2HG GLN 139 1HG GLN 139 1.778 -7.878 -7.878 430 1HE2 GLN 139 1HE2 GLN 139 0.083 -10.550 -10.550 431 2HE2 GLN 139 2HE2 GLN 139 1.420 -11.572 -11.572 432 H ILE 140 H ILE 140 3.006 -7.120 -7.120 433 HA ILE 140 HA ILE 140 3.572 -8.429 -8.429 434 HB ILE 140 HB ILE 140 4.788 -6.415 -6.415 435 1HG1 ILE 140 2HG1 ILE 140 5.341 -9.378 -9.378 436 2HG1 ILE 140 1HG1 ILE 140 4.247 -8.915 -8.915 437 1HG2 ILE 140 3HG2 ILE 140 5.620 -6.354 -6.354 438 2HG2 ILE 140 2HG2 ILE 140 5.867 -8.136 -8.136 439 3HG2 ILE 140 1HG2 ILE 140 6.850 -7.041 -7.041 440 1HD1 ILE 140 2HD1 ILE 140 7.206 -8.119 -8.119 441 2HD1 ILE 140 1HD1 ILE 140 6.505 -9.437 -9.437 442 3HD1 ILE 140 3HD1 ILE 140 6.074 -7.717 -7.717 443 H GLY 141 H GLY 141 2.487 -5.270 -5.270 444 1HA GLY 141 2HA GLY 141 2.634 -4.307 -4.307 445 2HA GLY 141 1HA GLY 141 1.887 -3.512 -3.512 446 H MET 142 H MET 142 -0.124 -4.994 -4.994 447 HA MET 142 HA MET 142 -1.929 -4.043 -4.043 448 1HB MET 142 2HB MET 142 -2.416 -5.282 -5.282 449 2HB MET 142 1HB MET 142 -3.697 -4.456 -4.456 450 1HG MET 142 2HG MET 142 -1.919 -2.469 -2.469 451 2HG MET 142 1HG MET 142 -1.505 -3.164 -3.164 452 1HE MET 142 1HE MET 142 -3.200 -3.818 -3.818 453 2HE MET 142 3HE MET 142 -4.405 -4.566 -4.566 454 3HE MET 142 2HE MET 142 -4.918 -3.300 -3.300 455 H GLU 143 H GLU 143 -0.638 -7.303 -7.303 456 HA GLU 143 HA GLU 143 -2.869 -8.283 -8.283 457 1HB GLU 143 2HB GLU 143 -0.823 -9.735 -9.735 458 2HB GLU 143 1HB GLU 143 0.025 -9.128 -9.128 459 1HG GLU 143 2HG GLU 143 -2.753 -10.441 -10.441 460 2HG GLU 143 1HG GLU 143 -1.287 -11.494 -11.494 461 H VAL 144 H VAL 144 0.204 -6.936 -6.936 462 HA VAL 144 HA VAL 144 -0.324 -7.529 -7.529 463 HB VAL 144 HB VAL 144 1.627 -5.503 -5.503 464 1HG1 VAL 144 1HG1 VAL 144 1.111 -7.083 -7.083 465 2HG1 VAL 144 3HG1 VAL 144 2.726 -6.417 -6.417 466 3HG1 VAL 144 2HG1 VAL 144 1.317 -5.302 -5.302 467 1HG2 VAL 144 1HG2 VAL 144 1.171 -8.494 -8.494 468 2HG2 VAL 144 3HG2 VAL 144 1.779 -7.619 -7.619 469 3HG2 VAL 144 2HG2 VAL 144 2.892 -7.858 -7.858 470 H LEU 145 H LEU 145 -0.267 -4.433 -4.433 471 HA LEU 145 HA LEU 145 -1.119 -2.805 -2.805 472 1HB LEU 145 2HB LEU 145 -1.493 -2.979 -2.979 473 2HB LEU 145 1HB LEU 145 -2.087 -1.555 -1.555 474 HG LEU 145 HG LEU 145 0.796 -2.510 -2.510 475 1HD1 LEU 145 2HD1 LEU 145 -0.968 -0.187 -0.187 476 2HD1 LEU 145 1HD1 LEU 145 0.826 -0.118 -0.118 477 3HD1 LEU 145 3HD1 LEU 145 -0.082 -1.430 -1.430 478 1HD2 LEU 145 1HD2 LEU 145 -0.442 -0.443 -0.443 479 2HD2 LEU 145 3HD2 LEU 145 0.648 -1.793 -1.793 480 3HD2 LEU 145 2HD2 LEU 145 1.310 -0.373 -0.373 481 H ASN 146 H ASN 146 -3.099 -4.146 -4.146 482 HA ASN 146 HA ASN 146 -5.670 -3.350 -3.350 483 1HB ASN 146 2HB ASN 146 -4.344 -4.333 -4.333 484 2HB ASN 146 1HB ASN 146 -5.172 -5.856 -5.856 485 1HD2 ASN 146 1HD2 ASN 146 -5.287 -5.111 -5.111 486 2HD2 ASN 146 2HD2 ASN 146 -6.940 -5.408 -5.408 487 H ARG 147 H ARG 147 -3.775 -6.335 -6.335 488 HA ARG 147 HA ARG 147 -6.189 -7.134 -7.134 489 1HB ARG 147 2HB ARG 147 -4.999 -8.830 -8.830 490 2HB ARG 147 1HB ARG 147 -3.434 -8.134 -8.134 491 1HG ARG 147 2HG ARG 147 -3.445 -9.387 -9.387 492 2HG ARG 147 1HG ARG 147 -5.159 -8.910 -8.910 493 1HD ARG 147 2HD ARG 147 -5.249 -11.289 -11.289 494 2HD ARG 147 1HD ARG 147 -5.839 -10.769 -10.769 495 HE ARG 147 HE ARG 147 -3.007 -11.032 -11.032 496 1HH1 ARG 147 1HH1 ARG 147 -5.837 -13.070 -13.070 497 2HH1 ARG 147 2HH1 ARG 147 -5.093 -14.546 -14.546 498 1HH2 ARG 147 1HH2 ARG 147 -2.011 -13.028 -13.028 499 2HH2 ARG 147 2HH2 ARG 147 -2.886 -14.521 -14.521 500 H VAL 148 H VAL 148 -3.495 -4.846 -4.846 501 HA VAL 148 HA VAL 148 -3.577 -5.429 -5.429 502 HB VAL 148 HB VAL 148 -2.987 -2.747 -2.747 503 1HG1 VAL 148 1HG1 VAL 148 -3.058 -3.769 -3.769 504 2HG1 VAL 148 3HG1 VAL 148 -1.542 -4.622 -4.622 505 3HG1 VAL 148 2HG1 VAL 148 -1.608 -2.806 -2.806 506 1HG2 VAL 148 2HG2 VAL 148 -1.136 -5.124 -5.124 507 2HG2 VAL 148 1HG2 VAL 148 -1.825 -4.075 -4.075 508 3HG2 VAL 148 3HG2 VAL 148 -0.656 -3.375 -3.375 509 H LYS 149 H LYS 149 -5.147 -3.008 -3.008 510 HA LYS 149 HA LYS 149 -6.666 -1.573 -1.573 511 1HB LYS 149 2HB LYS 149 -6.497 -1.401 -1.401 512 2HB LYS 149 1HB LYS 149 -7.402 -2.954 -2.954 513 1HG LYS 149 2HG LYS 149 -9.360 -2.195 -2.195 514 2HG LYS 149 1HG LYS 149 -8.759 -0.640 -0.640 515 1HD LYS 149 2HD LYS 149 -8.901 -1.451 -1.451 516 2HD LYS 149 1HD LYS 149 -10.177 -0.469 -0.469 517 1HE LYS 149 2HE LYS 149 -8.789 1.456 1.456 518 2HE LYS 149 1HE LYS 149 -7.473 0.499 0.499 519 1HZ LYS 149 2HZ LYS 149 -8.998 0.139 0.139 520 2HZ LYS 149 1HZ LYS 149 -10.225 1.006 1.006 521 3HZ LYS 149 3HZ LYS 149 -8.806 1.799 1.799 522 H ASP 150 H ASP 150 -7.407 -4.828 -4.828 523 HA ASP 150 HA ASP 150 -10.037 -4.782 -4.782 524 1HB ASP 150 2HB ASP 150 -7.998 -6.828 -6.828 525 2HB ASP 150 1HB ASP 150 -9.668 -7.243 -7.243 526 H ASP 151 H ASP 151 -7.026 -6.394 -6.394 527 HA ASP 151 HA ASP 151 -8.762 -7.391 -7.391 528 1HB ASP 151 2HB ASP 151 -6.570 -8.418 -8.418 529 2HB ASP 151 1HB ASP 151 -5.741 -7.108 -7.108 530 H LEU 152 H LEU 152 -6.962 -4.221 -4.221 531 HA LEU 152 HA LEU 152 -7.212 -3.829 -3.829 532 1HB LEU 152 2HB LEU 152 -6.274 -2.474 -2.474 533 2HB LEU 152 1HB LEU 152 -7.202 -1.426 -1.426 534 HG LEU 152 HG LEU 152 -5.026 -3.258 -3.258 535 1HD1 LEU 152 1HD1 LEU 152 -4.282 -2.188 -2.188 536 2HD1 LEU 152 3HD1 LEU 152 -4.556 -0.541 -0.541 537 3HD1 LEU 152 2HD1 LEU 152 -3.304 -1.637 -1.637 538 1HD2 LEU 152 2HD2 LEU 152 -6.267 -0.600 -0.600 539 2HD2 LEU 152 1HD2 LEU 152 -6.364 -2.202 -2.202 540 3HD2 LEU 152 3HD2 LEU 152 -4.805 -1.335 -1.335 541 H GLN 153 H GLN 153 -9.113 -3.033 -3.033 542 HA GLN 153 HA GLN 153 -10.459 -1.160 -1.160 543 1HB GLN 153 2HB GLN 153 -10.664 -3.578 -3.578 544 2HB GLN 153 1HB GLN 153 -12.062 -3.694 -3.694 545 1HG GLN 153 2HG GLN 153 -12.975 -1.597 -1.597 546 2HG GLN 153 1HG GLN 153 -11.352 -1.588 -1.588 547 1HE2 GLN 153 1HE2 GLN 153 -11.609 -2.252 -2.252 548 2HE2 GLN 153 2HE2 GLN 153 -12.485 -3.650 -3.650 549 H GLU 154 H GLU 154 -10.932 -3.223 -3.223 550 HA GLU 154 HA GLU 154 -13.347 -2.551 -2.551 551 1HB GLU 154 2HB GLU 154 -10.835 -3.010 -3.010 552 2HB GLU 154 1HB GLU 154 -12.487 -3.597 -3.597 553 1HG GLU 154 2HG GLU 154 -12.100 -5.159 -5.159 554 2HG GLU 154 1HG GLU 154 -10.410 -4.485 -4.485 555 H LEU 155 H LEU 155 -10.166 -1.304 -1.304 556 HA LEU 155 HA LEU 155 -11.083 0.739 0.739 557 1HB LEU 155 2HB LEU 155 -9.601 -1.222 -1.222 558 2HB LEU 155 1HB LEU 155 -8.325 -0.568 -0.568 559 HG LEU 155 HG LEU 155 -9.454 1.402 1.402 560 1HD1 LEU 155 3HD1 LEU 155 -9.690 -0.685 -0.685 561 2HD1 LEU 155 2HD1 LEU 155 -7.954 -1.075 -1.075 562 3HD1 LEU 155 1HD1 LEU 155 -8.408 0.392 0.392 563 1HD2 LEU 155 1HD2 LEU 155 -6.579 0.437 0.437 564 2HD2 LEU 155 3HD2 LEU 155 -7.391 1.875 1.875 565 3HD2 LEU 155 2HD2 LEU 155 -7.027 1.838 1.838 566 H ALA 156 H ALA 156 -8.842 -0.043 -0.043 567 HA ALA 156 HA ALA 156 -8.093 2.880 2.880 568 1HB ALA 156 3HB ALA 156 -6.659 0.533 0.533 569 2HB ALA 156 2HB ALA 156 -6.301 2.280 2.280 570 3HB ALA 156 1HB ALA 156 -6.065 1.466 1.466 571 H VAL 157 H VAL 157 -8.945 3.703 3.703 572 HA VAL 157 HA VAL 157 -8.261 1.457 1.457 573 HB VAL 157 HB VAL 157 -9.720 2.385 2.385 574 1HG1 VAL 157 3HG1 VAL 157 -11.148 2.161 2.161 575 2HG1 VAL 157 2HG1 VAL 157 -11.960 2.141 2.141 576 3HG1 VAL 157 1HG1 VAL 157 -10.807 0.812 0.812 577 1HG2 VAL 157 1HG2 VAL 157 -9.376 4.921 4.921 578 2HG2 VAL 157 3HG2 VAL 157 -10.942 4.403 4.403 579 3HG2 VAL 157 2HG2 VAL 157 -10.736 4.495 4.495 580 H VAL 158 H VAL 158 -8.050 2.229 2.229 581 HA VAL 158 HA VAL 158 -5.673 3.782 3.782 582 HB VAL 158 HB VAL 158 -7.377 2.753 2.753 583 1HG1 VAL 158 2HG1 VAL 158 -5.309 3.973 3.973 584 2HG1 VAL 158 1HG1 VAL 158 -4.382 2.762 2.762 585 3HG1 VAL 158 3HG1 VAL 158 -5.299 2.245 2.245 586 1HG2 VAL 158 3HG2 VAL 158 -5.610 1.089 1.089 587 2HG2 VAL 158 2HG2 VAL 158 -7.338 0.790 0.790 588 3HG2 VAL 158 1HG2 VAL 158 -6.009 0.527 0.527 589 H GLU 159 H GLU 159 -5.604 5.660 5.660 590 HA GLU 159 HA GLU 159 -7.944 7.288 7.288 591 1HB GLU 159 2HB GLU 159 -5.691 8.058 8.058 592 2HB GLU 159 1HB GLU 159 -5.157 7.595 7.595 593 1HG GLU 159 2HG GLU 159 -6.562 9.457 9.457 594 2HG GLU 159 1HG GLU 159 -7.216 9.819 9.819 595 H SER 160 H SER 160 -5.748 5.560 5.560 596 HA SER 160 HA SER 160 -7.581 5.854 5.854 597 1HB SER 160 2HB SER 160 -5.891 7.884 7.884 598 2HB SER 160 1HB SER 160 -4.841 6.610 6.610 599 HG SER 160 HG SER 160 -5.937 7.901 7.901 600 H PHE 161 H PHE 161 -7.121 4.239 4.239 601 HA PHE 161 HA PHE 161 -4.735 2.592 2.592 602 1HB PHE 161 2HB PHE 161 -7.212 1.624 1.624 603 2HB PHE 161 1HB PHE 161 -6.830 1.495 1.495 604 HD1 PHE 161 1HD PHE 161 -4.648 0.615 0.615 605 HD2 PHE 161 2HD PHE 161 -6.436 -0.036 -0.036 606 HE1 PHE 161 1HE PHE 161 -2.923 -1.065 -1.065 607 HE2 PHE 161 2HE PHE 161 -4.890 -1.530 -1.530 608 HZ PHE 161 HZ PHE 161 -3.211 -2.378 -2.378 609 HA PRO 162 HA PRO 162 -4.971 5.726 5.726 610 1HB PRO 162 2HB PRO 162 -2.567 7.041 7.041 611 2HB PRO 162 1HB PRO 162 -3.835 6.899 6.899 612 1HG PRO 162 2HG PRO 162 -1.215 5.442 5.442 613 2HG PRO 162 1HG PRO 162 -2.344 5.779 5.779 614 1HD PRO 162 2HD PRO 162 -2.130 3.383 3.383 615 2HD PRO 162 1HD PRO 162 -3.074 3.554 3.554 616 H THR 163 H THR 163 -1.324 5.386 5.386 617 HA THR 163 HA THR 163 -2.444 6.320 6.320 618 HB THR 163 HB THR 163 0.338 6.909 6.909 619 HG1 THR 163 1HG THR 163 -0.024 5.961 5.961 620 1HG2 THR 163 3HG2 THR 163 -2.300 8.271 8.271 621 2HG2 THR 163 2HG2 THR 163 -0.711 9.116 9.116 622 3HG2 THR 163 1HG2 THR 163 -1.539 8.433 8.433 623 H LYS 164 H LYS 164 0.874 5.326 5.326 624 HA LYS 164 HA LYS 164 0.665 3.000 3.000 625 1HB LYS 164 2HB LYS 164 0.428 5.005 5.005 626 2HB LYS 164 1HB LYS 164 2.052 5.512 5.512 627 1HG LYS 164 2HG LYS 164 2.949 3.249 3.249 628 2HG LYS 164 1HG LYS 164 1.286 2.865 2.865 629 1HD LYS 164 2HD LYS 164 2.578 3.605 3.605 630 2HD LYS 164 1HD LYS 164 1.396 4.908 4.908 631 1HE LYS 164 2HE LYS 164 3.224 6.231 6.231 632 2HE LYS 164 1HE LYS 164 4.392 4.882 4.882 633 1HZ LYS 164 1HZ LYS 164 2.908 6.431 6.431 634 2HZ LYS 164 3HZ LYS 164 4.539 6.629 6.629 635 3HZ LYS 164 2HZ LYS 164 4.020 5.180 5.180 636 H ILE 165 H ILE 165 3.006 2.116 2.116 637 HA ILE 165 HA ILE 165 4.419 3.056 3.056 638 HB ILE 165 HB ILE 165 5.531 1.392 1.392 639 1HG1 ILE 165 2HG1 ILE 165 3.278 0.581 0.581 640 2HG1 ILE 165 1HG1 ILE 165 3.281 0.479 0.479 641 1HG2 ILE 165 3HG2 ILE 165 5.719 1.360 1.360 642 2HG2 ILE 165 2HG2 ILE 165 6.613 0.228 0.228 643 3HG2 ILE 165 1HG2 ILE 165 6.973 1.968 1.968 644 1HD1 ILE 165 2HD1 ILE 165 5.022 -1.391 -1.391 645 2HD1 ILE 165 1HD1 ILE 165 4.862 -1.268 -1.268 646 3HD1 ILE 165 3HD1 ILE 165 3.450 -1.723 -1.723 647 H GLU 166 H GLU 166 6.127 4.275 4.275 648 HA GLU 166 HA GLU 166 7.056 5.564 5.564 649 1HB GLU 166 2HB GLU 166 6.705 6.656 6.656 650 2HB GLU 166 1HB GLU 166 8.160 7.171 7.171 651 1HG GLU 166 2HG GLU 166 5.305 7.330 7.330 652 2HG GLU 166 1HG GLU 166 6.124 8.679 8.679 653 H GLY 167 H GLY 167 8.839 4.429 4.429 654 1HA GLY 167 2HA GLY 167 10.883 3.424 3.424 655 2HA GLY 167 1HA GLY 167 10.895 3.938 3.938 656 H ARG 168 H ARG 168 11.399 2.149 2.149 657 HA ARG 168 HA ARG 168 9.517 -0.028 -0.028 658 1HB ARG 168 2HB ARG 168 12.489 -0.197 -0.197 659 2HB ARG 168 1HB ARG 168 11.314 -1.528 -1.528 660 1HG ARG 168 2HG ARG 168 10.748 -1.658 -1.658 661 2HG ARG 168 1HG ARG 168 11.968 -0.395 -0.395 662 1HD ARG 168 2HD ARG 168 12.639 -3.071 -3.071 663 2HD ARG 168 1HD ARG 168 12.753 -2.821 -2.821 664 HE ARG 168 HE ARG 168 14.507 -1.611 -1.611 665 1HH1 ARG 168 1HH2 ARG 168 13.517 -1.754 -1.754 666 2HH1 ARG 168 2HH2 ARG 168 14.984 -1.048 -1.048 667 1HH2 ARG 168 1HH1 ARG 168 16.476 -0.664 -0.664 668 2HH2 ARG 168 2HH1 ARG 168 16.683 -0.423 -0.423 669 H GLN 169 H GLN 169 8.544 1.839 1.839 670 HA GLN 169 HA GLN 169 8.409 0.872 0.872 671 1HB GLN 169 2HB GLN 169 10.573 2.298 2.298 672 2HB GLN 169 1HB GLN 169 9.502 3.586 3.586 673 1HG GLN 169 2HG GLN 169 8.094 3.023 3.023 674 2HG GLN 169 1HG GLN 169 9.579 2.134 2.134 675 1HE2 GLN 169 1HE2 GLN 169 7.881 5.122 5.122 676 2HE2 GLN 169 2HE2 GLN 169 9.107 6.228 6.228 677 H MET 170 H MET 170 6.267 1.412 1.412 678 HA MET 170 HA MET 170 4.910 3.632 3.632 679 1HB MET 170 2HB MET 170 4.123 1.218 1.218 680 2HB MET 170 1HB MET 170 3.630 1.031 1.031 681 1HG MET 170 2HG MET 170 2.255 3.296 3.296 682 2HG MET 170 1HG MET 170 2.526 2.601 2.601 683 1HE MET 170 3HE MET 170 0.973 1.100 1.100 684 2HE MET 170 2HE MET 170 1.965 -0.200 -0.200 685 3HE MET 170 1HE MET 170 0.171 -0.310 -0.310 686 H ILE 171 H ILE 171 3.228 4.770 4.770 687 HA ILE 171 HA ILE 171 3.498 3.605 3.605 688 HB ILE 171 HB ILE 171 2.305 6.245 6.245 689 1HG1 ILE 171 2HG1 ILE 171 5.171 6.271 6.271 690 2HG1 ILE 171 1HG1 ILE 171 4.808 6.314 6.314 691 1HG2 ILE 171 3HG2 ILE 171 2.008 5.182 5.182 692 2HG2 ILE 171 2HG2 ILE 171 3.789 5.249 5.249 693 3HG2 ILE 171 1HG2 ILE 171 2.816 6.740 6.740 694 1HD1 ILE 171 1HD1 ILE 171 3.291 8.101 8.101 695 2HD1 ILE 171 3HD1 ILE 171 4.827 8.621 8.621 696 3HD1 ILE 171 2HD1 ILE 171 3.319 8.116 8.116 697 H MET 172 H MET 172 1.417 3.352 3.352 698 HA MET 172 HA MET 172 -1.049 4.231 4.231 699 1HB MET 172 2HB MET 172 -1.212 1.828 1.828 700 2HB MET 172 1HB MET 172 -0.220 1.632 1.632 701 1HG MET 172 2HG MET 172 -2.049 2.265 2.265 702 2HG MET 172 1HG MET 172 -2.982 2.918 2.918 703 1HE MET 172 1HE MET 172 -3.259 0.925 0.925 704 2HE MET 172 3HE MET 172 -3.864 -0.679 -0.679 705 3HE MET 172 2HE MET 172 -2.077 -0.370 -0.370 706 H VAL 173 H VAL 173 -2.057 5.678 5.678 707 HA VAL 173 HA VAL 173 -0.666 6.279 6.279 708 HB VAL 173 HB VAL 173 -3.136 7.587 7.587 709 1HG1 VAL 173 2HG1 VAL 173 -1.226 7.940 7.940 710 2HG1 VAL 173 1HG1 VAL 173 -1.897 9.438 9.438 711 3HG1 VAL 173 3HG1 VAL 173 -3.006 8.237 8.237 712 1HG2 VAL 173 1HG2 VAL 173 -0.108 8.016 8.016 713 2HG2 VAL 173 3HG2 VAL 173 -1.336 7.694 7.694 714 3HG2 VAL 173 2HG2 VAL 173 -1.353 9.261 9.261 715 H LEU 174 H LEU 174 -1.710 5.830 5.830 716 HA LEU 174 HA LEU 174 -4.260 4.405 4.405 717 1HB LEU 174 2HB LEU 174 -2.412 3.021 3.021 718 2HB LEU 174 1HB LEU 174 -1.679 3.712 3.712 719 HG LEU 174 HG LEU 174 -4.329 3.175 3.175 720 1HD1 LEU 174 2HD1 LEU 174 -4.745 2.229 2.229 721 2HD1 LEU 174 1HD1 LEU 174 -3.553 0.905 0.905 722 3HD1 LEU 174 3HD1 LEU 174 -5.052 1.158 1.158 723 1HD2 LEU 174 3HD2 LEU 174 -2.179 2.622 2.622 724 2HD2 LEU 174 2HD2 LEU 174 -3.455 1.304 1.304 725 3HD2 LEU 174 1HD2 LEU 174 -2.028 1.187 1.187 726 H ALA 175 H ALA 175 -5.677 6.173 6.173 727 HA ALA 175 HA ALA 175 -4.984 7.437 7.437 728 1HB ALA 175 2HB ALA 175 -5.897 8.683 8.683 729 2HB ALA 175 1HB ALA 175 -7.359 7.593 7.593 730 3HB ALA 175 3HB ALA 175 -7.022 8.930 8.930 731 HA PRO 176 HA PRO 176 -7.940 5.558 5.558 732 1HB PRO 176 2HB PRO 176 -9.187 7.622 7.622 733 2HB PRO 176 1HB PRO 176 -7.559 6.908 6.908 734 1HG PRO 176 2HG PRO 176 -8.217 9.461 9.461 735 2HG PRO 176 1HG PRO 176 -6.897 9.178 9.178 736 1HD PRO 176 2HD PRO 176 -6.400 9.138 9.138 737 2HD PRO 176 1HD PRO 176 -5.586 7.936 7.936 738 H LYS 177 H LYS 177 -9.931 4.697 4.697 739 HA LYS 177 HA LYS 177 -11.451 5.599 5.599 740 1HB LYS 177 2HB LYS 177 -11.205 3.172 3.172 741 2HB LYS 177 1HB LYS 177 -12.133 3.537 3.537 742 1HG LYS 177 2HG LYS 177 -13.600 4.327 4.327 743 2HG LYS 177 1HG LYS 177 -13.106 2.608 2.608 744 1HD LYS 177 2HD LYS 177 -14.615 3.870 3.870 745 2HD LYS 177 1HD LYS 177 -15.403 3.023 3.023 746 1HE LYS 177 2HE LYS 177 -14.221 0.915 0.915 747 2HE LYS 177 1HE LYS 177 -13.308 1.715 1.715 748 1HZ LYS 177 3HZ LYS 177 -15.431 2.205 2.205 749 2HZ LYS 177 2HZ LYS 177 -16.265 1.413 1.413 750 3HZ LYS 177 1HZ LYS 177 -15.212 0.538 0.538 751 H LYS 178 H LYS 178 -13.239 6.716 6.716 752 HA LYS 178 HA LYS 178 -13.840 8.423 8.423 753 1HB LYS 178 2HB LYS 178 -13.924 9.134 9.134 754 2HB LYS 178 1HB LYS 178 -15.294 8.009 8.009 755 1HG LYS 178 2HG LYS 178 -16.063 10.330 10.330 756 2HG LYS 178 1HG LYS 178 -16.740 9.386 9.386 757 1HD LYS 178 2HD LYS 178 -15.005 10.353 10.353 758 2HD LYS 178 1HD LYS 178 -14.284 11.250 11.250 759 1HE LYS 178 2HE LYS 178 -16.424 12.538 12.538 760 2HE LYS 178 1HE LYS 178 -17.148 11.625 11.625 761 1HZ LYS 178 1HZ LYS 178 -14.713 13.331 13.331 762 2HZ LYS 178 3HZ LYS 178 -16.262 13.754 13.754 763 3HZ LYS 178 2HZ LYS 178 -15.409 12.491 12.491 764 H LYS 179 H LYS 179 -14.960 7.816 7.816 765 HA LYS 179 HA LYS 179 -17.209 6.032 6.032 766 1HB LYS 179 2HB LYS 179 -16.253 7.838 7.838 767 2HB LYS 179 1HB LYS 179 -17.633 6.684 6.684 768 1HG LYS 179 2HG LYS 179 -16.067 4.781 4.781 769 2HG LYS 179 1HG LYS 179 -14.686 5.931 5.931 770 1HD LYS 179 2HD LYS 179 -15.107 6.641 6.641 771 2HD LYS 179 1HD LYS 179 -16.477 5.478 5.478 772 1HE LYS 179 2HE LYS 179 -14.895 3.565 3.565 773 2HE LYS 179 1HE LYS 179 -13.514 4.735 4.735 774 1HZ LYS 179 3HZ LYS 179 -15.289 4.369 4.369 775 2HZ LYS 179 2HZ LYS 179 -13.702 3.785 3.785 776 3HZ LYS 179 1HZ LYS 179 -13.990 5.458 5.458 777 H GLN 180 H GLN 180 -19.023 6.815 6.815 778 HA GLN 180 HA GLN 180 -19.274 9.639 9.639 779 1HB GLN 180 2HB GLN 180 -19.961 8.050 8.050 780 2HB GLN 180 1HB GLN 180 -21.231 7.394 7.394 781 1HG GLN 180 2HG GLN 180 -22.195 9.000 9.000 782 2HG GLN 180 1HG GLN 180 -22.369 9.645 9.645 783 1HE2 GLN 180 1HE2 GLN 180 -19.972 9.625 9.625 784 2HE2 GLN 180 2HE2 GLN 180 -19.507 11.287 11.287 Start of MODEL 8 1 HA VAL 90 HA VAL 90 -1.765 16.435 16.435 2 HB VAL 90 HB VAL 90 -3.675 16.729 16.729 3 1HG1 VAL 90 3HG1 VAL 90 -3.660 18.715 18.715 4 2HG1 VAL 90 2HG1 VAL 90 -4.782 17.785 17.785 5 3HG1 VAL 90 1HG1 VAL 90 -5.318 18.283 18.283 6 1HG2 VAL 90 1HG2 VAL 90 -5.334 15.339 15.339 7 2HG2 VAL 90 3HG2 VAL 90 -4.807 14.598 14.598 8 3HG2 VAL 90 2HG2 VAL 90 -5.973 15.948 15.948 9 H ILE 91 H ILE 91 -2.814 15.598 15.598 10 HA ILE 91 HA ILE 91 -2.724 12.665 12.665 11 HB ILE 91 HB ILE 91 -3.369 14.394 14.394 12 1HG1 ILE 91 2HG1 ILE 91 -5.141 14.682 14.682 13 2HG1 ILE 91 1HG1 ILE 91 -5.723 13.536 13.536 14 1HG2 ILE 91 3HG2 ILE 91 -3.455 11.335 11.335 15 2HG2 ILE 91 2HG2 ILE 91 -4.256 12.167 12.167 16 3HG2 ILE 91 1HG2 ILE 91 -2.472 12.222 12.222 17 1HD1 ILE 91 2HD1 ILE 91 -5.202 11.608 11.608 18 2HD1 ILE 91 1HD1 ILE 91 -4.674 12.782 12.782 19 3HD1 ILE 91 3HD1 ILE 91 -6.393 12.763 12.763 20 H GLN 92 H GLN 92 -0.838 11.601 11.601 21 HA GLN 92 HA GLN 92 1.375 13.153 13.153 22 1HB GLN 92 2HB GLN 92 1.361 10.328 10.328 23 2HB GLN 92 1HB GLN 92 2.765 11.457 11.457 24 1HG GLN 92 2HG GLN 92 0.244 11.663 11.663 25 2HG GLN 92 1HG GLN 92 1.877 11.146 11.146 26 1HE2 GLN 92 1HE2 GLN 92 -0.332 13.715 13.715 27 2HE2 GLN 92 2HE2 GLN 92 0.738 15.051 15.051 28 H VAL 93 H VAL 93 2.936 11.814 11.814 29 HA VAL 93 HA VAL 93 1.388 9.847 9.847 30 HB VAL 93 HB VAL 93 4.040 11.140 11.140 31 1HG1 VAL 93 2HG1 VAL 93 2.256 8.899 8.899 32 2HG1 VAL 93 1HG1 VAL 93 3.479 9.753 9.753 33 3HG1 VAL 93 3HG1 VAL 93 4.040 8.749 8.749 34 1HG2 VAL 93 1HG2 VAL 93 1.745 12.415 12.415 35 2HG2 VAL 93 3HG2 VAL 93 2.780 12.077 12.077 36 3HG2 VAL 93 2HG2 VAL 93 1.409 10.986 10.986 37 H LYS 94 H LYS 94 1.615 7.709 7.709 38 HA LYS 94 HA LYS 94 4.489 7.248 7.248 39 1HB LYS 94 2HB LYS 94 2.265 5.267 5.267 40 2HB LYS 94 1HB LYS 94 3.905 5.187 5.187 41 1HG LYS 94 2HG LYS 94 1.783 7.282 7.282 42 2HG LYS 94 1HG LYS 94 2.108 5.794 5.794 43 1HD LYS 94 2HD LYS 94 4.481 6.532 6.532 44 2HD LYS 94 1HD LYS 94 4.148 8.049 8.049 45 1HE LYS 94 2HE LYS 94 2.425 8.700 8.700 46 2HE LYS 94 1HE LYS 94 2.820 7.206 7.206 47 1HZ LYS 94 3HZ LYS 94 4.713 9.383 9.383 48 2HZ LYS 94 2HZ LYS 94 3.992 9.137 9.137 49 3HZ LYS 94 1HZ LYS 94 5.083 7.991 7.991 50 H GLU 95 H GLU 95 5.086 4.969 4.969 51 HA GLU 95 HA GLU 95 3.863 4.713 4.713 52 1HB GLU 95 2HB GLU 95 5.787 6.402 6.402 53 2HB GLU 95 1HB GLU 95 6.745 4.975 4.975 54 1HG GLU 95 2HG GLU 95 6.413 3.879 3.879 55 2HG GLU 95 1HG GLU 95 5.432 5.304 5.304 56 H ILE 96 H ILE 96 4.315 2.679 2.679 57 HA ILE 96 HA ILE 96 5.868 0.789 0.789 58 HB ILE 96 HB ILE 96 3.145 0.694 0.694 59 1HG1 ILE 96 2HG1 ILE 96 3.317 -1.848 -1.848 60 2HG1 ILE 96 1HG1 ILE 96 5.010 -1.751 -1.751 61 1HG2 ILE 96 2HG2 ILE 96 2.775 0.668 0.668 62 2HG2 ILE 96 1HG2 ILE 96 3.529 -0.994 -0.994 63 3HG2 ILE 96 3HG2 ILE 96 2.095 -0.736 -0.736 64 1HD1 ILE 96 1HD1 ILE 96 5.544 -0.272 -0.272 65 2HD1 ILE 96 3HD1 ILE 96 3.836 -0.491 -0.491 66 3HD1 ILE 96 2HD1 ILE 96 4.941 -1.908 -1.908 67 H LYS 97 H LYS 97 6.656 -1.027 -1.027 68 HA LYS 97 HA LYS 97 6.044 -0.292 -0.292 69 1HB LYS 97 2HB LYS 97 8.672 -1.634 -1.634 70 2HB LYS 97 1HB LYS 97 7.972 -1.276 -1.276 71 1HG LYS 97 2HG LYS 97 7.953 1.216 1.216 72 2HG LYS 97 1HG LYS 97 9.086 0.724 0.724 73 1HD LYS 97 2HD LYS 97 10.674 -0.160 -0.160 74 2HD LYS 97 1HD LYS 97 9.481 0.232 0.232 75 1HE LYS 97 2HE LYS 97 9.652 2.677 2.677 76 2HE LYS 97 1HE LYS 97 10.903 2.288 2.288 77 1HZ LYS 97 2HZ LYS 97 12.254 1.326 1.326 78 2HZ LYS 97 1HZ LYS 97 11.078 1.700 1.700 79 3HZ LYS 97 3HZ LYS 97 11.877 2.947 2.947 80 H PHE 98 H PHE 98 5.834 -2.021 -2.021 81 HA PHE 98 HA PHE 98 5.803 -4.678 -4.678 82 1HB PHE 98 2HB PHE 98 3.699 -3.355 -3.355 83 2HB PHE 98 1HB PHE 98 3.787 -5.127 -5.127 84 HD1 PHE 98 1HD PHE 98 4.073 -5.794 -5.794 85 HD2 PHE 98 2HD PHE 98 2.152 -2.453 -2.453 86 HE1 PHE 98 1HE PHE 98 2.914 -5.470 -5.470 87 HE2 PHE 98 2HE PHE 98 0.817 -2.169 -2.169 88 HZ PHE 98 HZ PHE 98 1.093 -3.867 -3.867 89 H ARG 99 H ARG 99 6.791 -6.170 -6.170 90 HA ARG 99 HA ARG 99 7.658 -5.094 -5.094 91 1HB ARG 99 2HB ARG 99 8.918 -6.958 -6.958 92 2HB ARG 99 1HB ARG 99 9.479 -6.762 -6.762 93 1HG ARG 99 2HG ARG 99 9.924 -4.364 -4.364 94 2HG ARG 99 1HG ARG 99 9.405 -4.506 -4.506 95 1HD ARG 99 2HD ARG 99 11.337 -5.945 -5.945 96 2HD ARG 99 1HD ARG 99 11.773 -6.058 -6.058 97 HE ARG 99 HE ARG 99 11.578 -3.280 -3.280 98 1HH1 ARG 99 1HH1 ARG 99 13.672 -6.166 -6.166 99 2HH1 ARG 99 2HH1 ARG 99 15.151 -5.263 -5.263 100 1HH2 ARG 99 1HH2 ARG 99 13.589 -2.076 -2.076 101 2HH2 ARG 99 2HH2 ARG 99 15.103 -2.911 -2.911 102 HA PRO 100 HA PRO 100 5.509 -8.739 -8.739 103 1HB PRO 100 2HB PRO 100 7.380 -9.782 -9.782 104 2HB PRO 100 1HB PRO 100 6.114 -8.562 -8.562 105 1HG PRO 100 2HG PRO 100 9.056 -8.173 -8.173 106 2HG PRO 100 1HG PRO 100 8.069 -7.242 -7.242 107 1HD PRO 100 2HD PRO 100 8.709 -6.251 -6.251 108 2HD PRO 100 1HD PRO 100 7.071 -5.904 -5.904 109 H GLY 101 H GLY 101 5.542 -10.961 -10.961 110 1HA GLY 101 2HA GLY 101 6.402 -12.932 -12.932 111 2HA GLY 101 1HA GLY 101 8.049 -12.172 -12.172 112 H THR 102 H THR 102 5.974 -10.341 -10.341 113 HA THR 102 HA THR 102 6.865 -11.227 -11.227 114 HB THR 102 HB THR 102 5.696 -8.456 -8.456 115 HG1 THR 102 1HG THR 102 7.780 -8.773 -8.773 116 1HG2 THR 102 2HG2 THR 102 6.694 -10.185 -10.185 117 2HG2 THR 102 1HG2 THR 102 6.912 -8.374 -8.374 118 3HG2 THR 102 3HG2 THR 102 5.269 -9.090 -9.090 119 H ASP 103 H ASP 103 5.517 -12.730 -12.730 120 HA ASP 103 HA ASP 103 2.826 -11.967 -11.967 121 1HB ASP 103 2HB ASP 103 3.351 -13.366 -13.366 122 2HB ASP 103 1HB ASP 103 3.754 -14.655 -14.655 123 H GLU 104 H GLU 104 3.921 -15.219 -15.219 124 HA GLU 104 HA GLU 104 1.444 -13.805 -13.805 125 1HB GLU 104 2HB GLU 104 1.469 -16.293 -16.293 126 2HB GLU 104 1HB GLU 104 2.195 -16.268 -16.268 127 1HG GLU 104 2HG GLU 104 0.127 -15.148 -15.148 128 2HG GLU 104 1HG GLU 104 -0.551 -15.056 -15.056 129 H GLY 105 H GLY 105 3.528 -14.995 -14.995 130 1HA GLY 105 2HA GLY 105 2.626 -12.586 -12.586 131 2HA GLY 105 1HA GLY 105 3.167 -14.141 -14.141 132 H ASP 106 H ASP 106 4.688 -12.500 -12.500 133 HA ASP 106 HA ASP 106 6.420 -11.036 -11.036 134 1HB ASP 106 2HB ASP 106 7.425 -12.242 -12.242 135 2HB ASP 106 1HB ASP 106 6.551 -11.131 -11.131 136 H TYR 107 H TYR 107 4.067 -11.099 -11.099 137 HA TYR 107 HA TYR 107 3.941 -8.333 -8.333 138 1HB TYR 107 2HB TYR 107 3.431 -10.226 -10.226 139 2HB TYR 107 1HB TYR 107 2.066 -10.755 -10.755 140 HD1 TYR 107 1HD TYR 107 2.059 -7.180 -7.180 141 HD2 TYR 107 2HD TYR 107 1.134 -10.875 -10.875 142 HE1 TYR 107 1HE TYR 107 0.008 -6.200 -6.200 143 HE2 TYR 107 2HE TYR 107 -0.550 -9.747 -9.747 144 HH TYR 107 HH TYR 107 -1.583 -6.457 -6.457 145 H GLN 108 H GLN 108 1.036 -10.256 -10.256 146 HA GLN 108 HA GLN 108 -0.068 -8.230 -8.230 147 1HB GLN 108 2HB GLN 108 -0.992 -10.735 -10.735 148 2HB GLN 108 1HB GLN 108 -1.823 -9.412 -9.412 149 1HG GLN 108 2HG GLN 108 -0.147 -11.383 -11.383 150 2HG GLN 108 1HG GLN 108 -1.652 -11.836 -11.836 151 1HE2 GLN 108 1HE2 GLN 108 -0.523 -8.569 -8.569 152 2HE2 GLN 108 2HE2 GLN 108 -1.762 -8.389 -8.389 153 H VAL 109 H VAL 109 2.425 -9.754 -9.754 154 HA VAL 109 HA VAL 109 1.867 -8.975 -8.975 155 HB VAL 109 HB VAL 109 4.503 -9.380 -9.380 156 1HG1 VAL 109 3HG1 VAL 109 3.985 -8.586 -8.586 157 2HG1 VAL 109 2HG1 VAL 109 5.497 -9.371 -9.371 158 3HG1 VAL 109 1HG1 VAL 109 5.065 -7.752 -7.752 159 1HG2 VAL 109 2HG2 VAL 109 3.059 -11.395 -11.395 160 2HG2 VAL 109 1HG2 VAL 109 4.562 -11.409 -11.409 161 3HG2 VAL 109 3HG2 VAL 109 2.987 -10.952 -10.952 162 H LYS 110 H LYS 110 3.379 -7.346 -7.346 163 HA LYS 110 HA LYS 110 3.426 -4.849 -4.849 164 1HB LYS 110 2HB LYS 110 4.441 -5.732 -5.732 165 2HB LYS 110 1HB LYS 110 4.498 -4.052 -4.052 166 1HG LYS 110 2HG LYS 110 5.976 -6.497 -6.497 167 2HG LYS 110 1HG LYS 110 6.551 -4.815 -4.815 168 1HD LYS 110 2HD LYS 110 5.644 -3.900 -3.900 169 2HD LYS 110 1HD LYS 110 5.121 -5.545 -5.545 170 1HE LYS 110 2HE LYS 110 7.510 -6.319 -6.319 171 2HE LYS 110 1HE LYS 110 8.043 -4.663 -4.663 172 1HZ LYS 110 1HZ LYS 110 7.059 -3.791 -3.791 173 2HZ LYS 110 3HZ LYS 110 6.570 -5.345 -5.345 174 3HZ LYS 110 2HZ LYS 110 8.223 -4.978 -4.978 175 H LEU 111 H LEU 111 1.153 -6.456 -6.456 176 HA LEU 111 HA LEU 111 -0.128 -4.038 -4.038 177 1HB LEU 111 2HB LEU 111 -0.478 -6.349 -6.349 178 2HB LEU 111 1HB LEU 111 -1.406 -6.774 -6.774 179 HG LEU 111 HG LEU 111 -2.112 -4.321 -4.321 180 1HD1 LEU 111 3HD1 LEU 111 -1.801 -6.277 -6.277 181 2HD1 LEU 111 2HD1 LEU 111 -3.001 -7.207 -7.207 182 3HD1 LEU 111 1HD1 LEU 111 -3.516 -5.713 -5.713 183 1HD2 LEU 111 1HD2 LEU 111 -3.652 -6.264 -6.264 184 2HD2 LEU 111 3HD2 LEU 111 -3.460 -4.471 -4.471 185 3HD2 LEU 111 2HD2 LEU 111 -4.500 -5.168 -5.168 186 H ARG 112 H ARG 112 0.288 -6.259 -6.259 187 HA ARG 112 HA ARG 112 -1.589 -5.054 -5.054 188 1HB ARG 112 2HB ARG 112 -0.276 -7.249 -7.249 189 2HB ARG 112 1HB ARG 112 0.844 -6.161 -6.161 190 1HG ARG 112 2HG ARG 112 -1.066 -5.354 -5.354 191 2HG ARG 112 1HG ARG 112 -2.199 -6.356 -6.356 192 1HD ARG 112 2HD ARG 112 -0.948 -8.449 -8.449 193 2HD ARG 112 1HD ARG 112 0.081 -7.390 -7.390 194 HE ARG 112 HE ARG 112 -1.771 -6.987 -6.987 195 1HH1 ARG 112 1HH1 ARG 112 -2.780 -8.851 -8.851 196 2HH1 ARG 112 2HH1 ARG 112 -4.321 -9.288 -9.288 197 1HH2 ARG 112 1HH2 ARG 112 -3.858 -7.584 -7.584 198 2HH2 ARG 112 2HH2 ARG 112 -4.941 -8.557 -8.557 199 H SER 113 H SER 113 2.031 -4.229 -4.229 200 HA SER 113 HA SER 113 1.997 -2.315 -2.315 201 1HB SER 113 2HB SER 113 3.700 -2.430 -2.430 202 2HB SER 113 1HB SER 113 3.853 -1.241 -1.241 203 HG SER 113 HG SER 113 4.020 -2.991 -2.991 204 H LEU 114 H LEU 114 0.890 -2.094 -2.094 205 HA LEU 114 HA LEU 114 0.641 0.615 0.615 206 1HB LEU 114 2HB LEU 114 1.105 -1.166 -1.166 207 2HB LEU 114 1HB LEU 114 -0.436 -1.976 -1.976 208 HG LEU 114 HG LEU 114 -1.667 -0.095 -0.095 209 1HD1 LEU 114 2HD1 LEU 114 1.130 1.029 1.029 210 2HD1 LEU 114 1HD1 LEU 114 -0.343 1.738 1.738 211 3HD1 LEU 114 3HD1 LEU 114 -0.132 1.746 1.746 212 1HD2 LEU 114 3HD2 LEU 114 -1.198 -2.019 -2.019 213 2HD2 LEU 114 2HD2 LEU 114 -1.416 -0.530 -0.530 214 3HD2 LEU 114 1HD2 LEU 114 0.236 -1.200 -1.200 215 H ILE 115 H ILE 115 -1.676 -2.045 -2.045 216 HA ILE 115 HA ILE 115 -3.929 -0.452 -0.452 217 HB ILE 115 HB ILE 115 -3.475 -1.964 -1.964 218 1HG1 ILE 115 2HG1 ILE 115 -2.710 -3.585 -3.585 219 2HG1 ILE 115 1HG1 ILE 115 -4.217 -4.067 -4.067 220 1HG2 ILE 115 3HG2 ILE 115 -5.663 -1.255 -1.255 221 2HG2 ILE 115 2HG2 ILE 115 -5.925 -2.356 -2.356 222 3HG2 ILE 115 1HG2 ILE 115 -5.400 -0.659 -0.659 223 1HD1 ILE 115 2HD1 ILE 115 -5.540 -3.283 -3.283 224 2HD1 ILE 115 1HD1 ILE 115 -3.944 -2.870 -2.870 225 3HD1 ILE 115 3HD1 ILE 115 -4.368 -4.594 -4.594 226 H ARG 116 H ARG 116 -1.414 -0.912 -0.912 227 HA ARG 116 HA ARG 116 -2.301 0.580 0.580 228 1HB ARG 116 2HB ARG 116 -0.208 -0.981 -0.981 229 2HB ARG 116 1HB ARG 116 0.680 0.504 0.504 230 1HG ARG 116 2HG ARG 116 -0.874 0.021 0.021 231 2HG ARG 116 1HG ARG 116 0.872 -0.318 -0.318 232 1HD ARG 116 2HD ARG 116 -0.440 2.470 2.470 233 2HD ARG 116 1HD ARG 116 0.716 1.766 1.766 234 HE ARG 116 HE ARG 116 1.765 1.779 1.779 235 1HH1 ARG 116 1HH2 ARG 116 1.252 3.712 3.712 236 2HH1 ARG 116 2HH2 ARG 116 2.469 4.882 4.882 237 1HH2 ARG 116 1HH1 ARG 116 3.406 3.370 3.370 238 2HH2 ARG 116 2HH1 ARG 116 3.710 4.687 4.687 239 H PHE 117 H PHE 117 -0.230 1.628 1.628 240 HA PHE 117 HA PHE 117 0.162 4.218 4.218 241 1HB PHE 117 2HB PHE 117 -0.342 2.891 2.891 242 2HB PHE 117 1HB PHE 117 0.395 4.498 4.498 243 HD1 PHE 117 1HD PHE 117 1.757 2.582 2.582 244 HD2 PHE 117 2HD PHE 117 1.482 2.943 2.943 245 HE1 PHE 117 1HE PHE 117 4.023 1.667 1.667 246 HE2 PHE 117 2HE PHE 117 3.751 1.859 1.859 247 HZ PHE 117 HZ PHE 117 5.030 1.270 1.270 248 H LEU 118 H LEU 118 -2.453 2.753 2.753 249 HA LEU 118 HA LEU 118 -3.764 4.962 4.962 250 1HB LEU 118 2HB LEU 118 -4.143 2.308 2.308 251 2HB LEU 118 1HB LEU 118 -5.594 2.914 2.914 252 HG LEU 118 HG LEU 118 -5.152 5.003 5.003 253 1HD1 LEU 118 1HD1 LEU 118 -4.246 2.334 2.334 254 2HD1 LEU 118 3HD1 LEU 118 -4.977 3.660 3.660 255 3HD1 LEU 118 2HD1 LEU 118 -3.475 3.996 3.996 256 1HD2 LEU 118 3HD2 LEU 118 -6.899 2.577 2.577 257 2HD2 LEU 118 2HD2 LEU 118 -7.164 4.258 4.258 258 3HD2 LEU 118 1HD2 LEU 118 -7.068 3.966 3.966 259 H GLU 119 H GLU 119 -4.193 2.936 2.936 260 HA GLU 119 HA GLU 119 -6.613 4.174 4.174 261 1HB GLU 119 2HB GLU 119 -7.003 2.373 2.373 262 2HB GLU 119 1HB GLU 119 -6.063 1.734 1.734 263 1HG GLU 119 2HG GLU 119 -5.098 0.597 0.597 264 2HG GLU 119 1HG GLU 119 -3.959 1.971 1.971 265 H GLU 120 H GLU 120 -3.291 4.736 4.736 266 HA GLU 120 HA GLU 120 -3.718 6.245 6.245 267 1HB GLU 120 2HB GLU 120 -1.745 6.688 6.688 268 2HB GLU 120 1HB GLU 120 -1.725 7.633 7.633 269 1HG GLU 120 2HG GLU 120 -1.023 4.652 4.652 270 2HG GLU 120 1HG GLU 120 0.067 6.010 6.010 271 H GLY 121 H GLY 121 -4.505 6.610 6.610 272 1HA GLY 121 2HA GLY 121 -5.842 8.107 8.107 273 2HA GLY 121 1HA GLY 121 -5.529 9.248 9.248 274 H ASP 122 H ASP 122 -3.605 7.290 7.290 275 HA ASP 122 HA ASP 122 -2.349 9.800 9.800 276 1HB ASP 122 2HB ASP 122 -0.892 7.141 7.141 277 2HB ASP 122 1HB ASP 122 -0.199 8.765 8.765 278 H LYS 123 H LYS 123 -1.419 9.471 9.471 279 HA LYS 123 HA LYS 123 -3.274 7.953 7.953 280 1HB LYS 123 2HB LYS 123 -3.515 10.349 10.349 281 2HB LYS 123 1HB LYS 123 -1.701 10.558 10.558 282 1HG LYS 123 2HG LYS 123 -2.884 8.958 8.958 283 2HG LYS 123 1HG LYS 123 -3.151 10.729 10.729 284 1HD LYS 123 2HD LYS 123 -1.106 11.140 11.140 285 2HD LYS 123 1HD LYS 123 -0.421 10.378 10.378 286 1HE LYS 123 2HE LYS 123 0.048 8.355 8.355 287 2HE LYS 123 1HE LYS 123 -1.326 8.551 8.551 288 1HZ LYS 123 3HZ LYS 123 -0.060 10.277 10.277 289 2HZ LYS 123 2HZ LYS 123 1.221 10.111 10.111 290 3HZ LYS 123 1HZ LYS 123 0.831 8.833 8.833 291 H ALA 124 H ALA 124 -2.392 6.232 6.232 292 HA ALA 124 HA ALA 124 0.427 5.952 5.952 293 1HB ALA 124 1HB ALA 124 -1.168 4.413 4.413 294 2HB ALA 124 3HB ALA 124 -1.695 3.816 3.816 295 3HB ALA 124 2HB ALA 124 0.081 3.680 3.680 296 H LYS 125 H LYS 125 1.778 5.923 5.923 297 HA LYS 125 HA LYS 125 0.527 5.637 5.637 298 1HB LYS 125 2HB LYS 125 2.024 7.634 7.634 299 2HB LYS 125 1HB LYS 125 3.398 6.508 6.508 300 1HG LYS 125 2HG LYS 125 3.287 6.234 6.234 301 2HG LYS 125 1HG LYS 125 1.827 7.299 7.299 302 1HD LYS 125 2HD LYS 125 3.302 9.051 9.051 303 2HD LYS 125 1HD LYS 125 4.712 8.039 8.039 304 1HE LYS 125 2HE LYS 125 4.110 8.399 8.399 305 2HE LYS 125 1HE LYS 125 2.661 9.359 9.359 306 1HZ LYS 125 3HZ LYS 125 5.499 9.999 9.999 307 2HZ LYS 125 2HZ LYS 125 4.532 10.743 10.743 308 3HZ LYS 125 1HZ LYS 125 4.138 10.901 10.901 309 H ILE 126 H ILE 126 0.648 3.642 3.642 310 HA ILE 126 HA ILE 126 2.764 1.887 1.887 311 HB ILE 126 HB ILE 126 0.970 1.770 1.770 312 1HG1 ILE 126 2HG1 ILE 126 -0.663 2.246 2.246 313 2HG1 ILE 126 1HG1 ILE 126 -0.679 0.490 0.490 314 1HG2 ILE 126 2HG2 ILE 126 2.424 -0.197 -0.197 315 2HG2 ILE 126 1HG2 ILE 126 1.193 -0.699 -0.699 316 3HG2 ILE 126 3HG2 ILE 126 2.732 0.075 0.075 317 1HD1 ILE 126 2HD1 ILE 126 0.636 0.103 0.103 318 2HD1 ILE 126 1HD1 ILE 126 0.525 1.869 1.869 319 3HD1 ILE 126 3HD1 ILE 126 -0.980 0.869 0.869 320 H THR 127 H THR 127 4.678 1.641 1.641 321 HA THR 127 HA THR 127 4.784 2.894 2.894 322 HB THR 127 HB THR 127 7.152 2.305 2.305 323 HG1 THR 127 1HG THR 127 5.863 4.755 4.755 324 1HG2 THR 127 3HG2 THR 127 6.689 3.736 3.736 325 2HG2 THR 127 2HG2 THR 127 8.239 3.844 3.844 326 3HG2 THR 127 1HG2 THR 127 7.682 2.256 2.256 327 H LEU 128 H LEU 128 4.484 1.362 1.362 328 HA LEU 128 HA LEU 128 5.377 -1.371 -1.371 329 1HB LEU 128 2HB LEU 128 3.319 -0.665 -0.665 330 2HB LEU 128 1HB LEU 128 4.577 -0.188 -0.188 331 HG LEU 128 HG LEU 128 5.369 -2.397 -2.397 332 1HD1 LEU 128 1HD1 LEU 128 3.317 -3.330 -3.330 333 2HD1 LEU 128 3HD1 LEU 128 4.143 -4.409 -4.409 334 3HD1 LEU 128 2HD1 LEU 128 5.110 -3.554 -3.554 335 1HD2 LEU 128 1HD2 LEU 128 3.243 -1.232 -1.232 336 2HD2 LEU 128 3HD2 LEU 128 3.473 -3.032 -3.032 337 3HD2 LEU 128 2HD2 LEU 128 2.331 -2.383 -2.383 338 H ARG 129 H ARG 129 7.195 -2.333 -2.333 339 HA ARG 129 HA ARG 129 8.821 -0.530 -0.530 340 1HB ARG 129 2HB ARG 129 9.598 -0.170 -0.170 341 2HB ARG 129 1HB ARG 129 9.788 -1.951 -1.951 342 1HG ARG 129 2HG ARG 129 11.536 -1.907 -1.907 343 2HG ARG 129 1HG ARG 129 11.150 -0.192 -0.192 344 1HD ARG 129 2HD ARG 129 12.019 0.468 0.468 345 2HD ARG 129 1HD ARG 129 12.482 -1.266 -1.266 346 HE ARG 129 HE ARG 129 13.582 -0.573 -0.573 347 1HH1 ARG 129 1HH1 ARG 129 13.805 0.510 0.510 348 2HH1 ARG 129 2HH1 ARG 129 15.424 1.107 1.107 349 1HH2 ARG 129 1HH2 ARG 129 15.778 0.240 0.240 350 2HH2 ARG 129 2HH2 ARG 129 16.558 0.959 0.959 351 H PHE 130 H PHE 130 8.759 -1.702 -1.702 352 HA PHE 130 HA PHE 130 7.984 -4.460 -4.460 353 1HB PHE 130 2HB PHE 130 9.092 -2.265 -2.265 354 2HB PHE 130 1HB PHE 130 8.644 -3.895 -3.895 355 HD1 PHE 130 1HD PHE 130 6.483 -4.770 -4.770 356 HD2 PHE 130 2HD PHE 130 7.445 -0.775 -0.775 357 HE1 PHE 130 1HE PHE 130 4.079 -4.105 -4.105 358 HE2 PHE 130 2HE PHE 130 5.082 -0.164 -0.164 359 HZ PHE 130 HZ PHE 130 3.376 -1.890 -1.890 360 H ARG 131 H ARG 131 9.610 -5.620 -5.620 361 HA ARG 131 HA ARG 131 12.339 -5.502 -5.502 362 1HB ARG 131 2HB ARG 131 11.369 -6.826 -6.826 363 2HB ARG 131 1HB ARG 131 13.070 -6.847 -6.847 364 1HG ARG 131 2HG ARG 131 11.472 -4.330 -4.330 365 2HG ARG 131 1HG ARG 131 12.673 -5.190 -5.190 366 1HD ARG 131 2HD ARG 131 13.372 -3.818 -3.818 367 2HD ARG 131 1HD ARG 131 13.626 -3.146 -3.146 368 HE ARG 131 HE ARG 131 14.763 -5.853 -5.853 369 1HH1 ARG 131 1HH1 ARG 131 15.293 -2.317 -2.317 370 2HH1 ARG 131 2HH1 ARG 131 17.009 -2.442 -2.442 371 1HH2 ARG 131 1HH2 ARG 131 17.077 -5.996 -5.996 372 2HH2 ARG 131 2HH2 ARG 131 18.036 -4.559 -4.559 373 H GLY 132 H GLY 132 10.036 -6.660 -6.660 374 1HA GLY 132 2HA GLY 132 10.932 -9.393 -9.393 375 2HA GLY 132 1HA GLY 132 9.640 -8.538 -8.538 376 H ARG 133 H ARG 133 10.641 -6.395 -6.395 377 HA ARG 133 HA ARG 133 11.752 -4.929 -4.929 378 1HB ARG 133 2HB ARG 133 13.238 -5.455 -5.455 379 2HB ARG 133 1HB ARG 133 14.309 -6.340 -6.340 380 1HG ARG 133 2HG ARG 133 14.749 -4.213 -4.213 381 2HG ARG 133 1HG ARG 133 13.444 -3.381 -3.381 382 1HD ARG 133 2HD ARG 133 15.746 -2.789 -2.789 383 2HD ARG 133 1HD ARG 133 14.744 -3.594 -3.594 384 HE ARG 133 HE ARG 133 16.149 -5.673 -5.673 385 1HH1 ARG 133 1HH1 ARG 133 16.887 -2.672 -2.672 386 2HH1 ARG 133 2HH1 ARG 133 18.352 -3.274 -3.274 387 1HH2 ARG 133 1HH2 ARG 133 18.151 -6.477 -6.477 388 2HH2 ARG 133 2HH2 ARG 133 19.081 -5.462 -5.462 389 H GLU 134 H GLU 134 10.808 -7.020 -7.020 390 HA GLU 134 HA GLU 134 12.821 -7.124 -7.124 391 1HB GLU 134 2HB GLU 134 11.127 -8.989 -8.989 392 2HB GLU 134 1HB GLU 134 9.810 -7.788 -7.788 393 1HG GLU 134 2HG GLU 134 10.702 -7.161 -7.161 394 2HG GLU 134 1HG GLU 134 11.972 -8.432 -8.432 395 H MET 135 H MET 135 9.525 -5.837 -5.837 396 HA MET 135 HA MET 135 10.375 -3.296 -3.296 397 1HB MET 135 2HB MET 135 7.609 -4.640 -4.640 398 2HB MET 135 1HB MET 135 7.962 -2.932 -2.932 399 1HG MET 135 2HG MET 135 9.140 -5.482 -5.482 400 2HG MET 135 1HG MET 135 7.836 -4.471 -4.471 401 1HE MET 135 1HE MET 135 9.331 -4.747 -4.747 402 2HE MET 135 3HE MET 135 11.018 -4.147 -4.147 403 3HE MET 135 2HE MET 135 10.661 -5.529 -5.529 404 H ALA 136 H ALA 136 7.268 -4.110 -4.110 405 HA ALA 136 HA ALA 136 7.342 -3.103 -3.103 406 1HB ALA 136 1HB ALA 136 6.946 -0.800 -0.800 407 2HB ALA 136 3HB ALA 136 6.526 -0.747 -0.747 408 3HB ALA 136 2HB ALA 136 8.244 -0.847 -0.847 409 H HIS 137 H HIS 137 5.418 -4.198 -4.198 410 HA HIS 137 HA HIS 137 3.974 -4.589 -4.589 411 1HB HIS 137 2HB HIS 137 4.090 -6.522 -6.522 412 2HB HIS 137 1HB HIS 137 3.330 -6.728 -6.728 413 HD1 HIS 137 1HD HIS 137 4.749 -8.337 -8.337 414 HD2 HIS 137 2HD HIS 137 7.086 -5.581 -5.581 415 HE1 HIS 137 1HE HIS 137 7.203 -8.797 -8.797 416 H GLN 138 H GLN 138 1.718 -5.282 -5.282 417 HA GLN 138 HA GLN 138 0.185 -3.953 -3.953 418 1HB GLN 138 2HB GLN 138 -0.676 -5.309 -5.309 419 2HB GLN 138 1HB GLN 138 -1.815 -4.553 -4.553 420 1HG GLN 138 2HG GLN 138 -0.688 -2.323 -2.323 421 2HG GLN 138 1HG GLN 138 0.396 -3.073 -3.073 422 1HE2 GLN 138 1HE2 GLN 138 -2.451 -4.795 -4.795 423 2HE2 GLN 138 2HE2 GLN 138 -3.262 -3.836 -3.836 424 H GLN 139 H GLN 139 1.559 -6.751 -6.751 425 HA GLN 139 HA GLN 139 -0.363 -8.576 -8.576 426 1HB GLN 139 2HB GLN 139 2.647 -9.175 -9.175 427 2HB GLN 139 1HB GLN 139 1.271 -10.314 -10.314 428 1HG GLN 139 2HG GLN 139 0.643 -9.376 -9.376 429 2HG GLN 139 1HG GLN 139 2.083 -8.277 -8.277 430 1HE2 GLN 139 1HE2 GLN 139 2.373 -9.664 -9.664 431 2HE2 GLN 139 2HE2 GLN 139 3.399 -11.050 -11.050 432 H ILE 140 H ILE 140 2.905 -7.301 -7.301 433 HA ILE 140 HA ILE 140 3.261 -8.066 -8.066 434 HB ILE 140 HB ILE 140 4.530 -6.007 -6.007 435 1HG1 ILE 140 2HG1 ILE 140 5.318 -8.791 -8.791 436 2HG1 ILE 140 1HG1 ILE 140 4.677 -8.457 -8.457 437 1HG2 ILE 140 1HG2 ILE 140 4.913 -6.960 -6.960 438 2HG2 ILE 140 3HG2 ILE 140 6.234 -6.184 -6.184 439 3HG2 ILE 140 2HG2 ILE 140 4.767 -5.257 -5.257 440 1HD1 ILE 140 1HD1 ILE 140 6.559 -6.801 -6.801 441 2HD1 ILE 140 3HD1 ILE 140 7.337 -7.442 -7.442 442 3HD1 ILE 140 2HD1 ILE 140 7.060 -8.535 -8.535 443 H GLY 141 H GLY 141 1.892 -5.011 -5.011 444 1HA GLY 141 2HA GLY 141 1.862 -4.157 -4.157 445 2HA GLY 141 1HA GLY 141 1.202 -3.259 -3.259 446 H MET 142 H MET 142 -0.711 -4.894 -4.894 447 HA MET 142 HA MET 142 -2.588 -4.098 -4.098 448 1HB MET 142 2HB MET 142 -2.946 -5.443 -5.443 449 2HB MET 142 1HB MET 142 -4.361 -4.841 -4.841 450 1HG MET 142 2HG MET 142 -3.111 -2.543 -2.543 451 2HG MET 142 1HG MET 142 -2.379 -3.178 -3.178 452 1HE MET 142 2HE MET 142 -3.581 -3.856 -3.856 453 2HE MET 142 1HE MET 142 -4.503 -5.102 -5.102 454 3HE MET 142 3HE MET 142 -5.358 -3.986 -3.986 455 H GLU 143 H GLU 143 -1.009 -7.268 -7.268 456 HA GLU 143 HA GLU 143 -3.145 -8.247 -8.247 457 1HB GLU 143 2HB GLU 143 -1.050 -9.723 -9.723 458 2HB GLU 143 1HB GLU 143 -0.377 -9.295 -9.295 459 1HG GLU 143 2HG GLU 143 -1.449 -11.220 -11.220 460 2HG GLU 143 1HG GLU 143 -2.754 -10.090 -10.090 461 H VAL 144 H VAL 144 0.072 -7.139 -7.139 462 HA VAL 144 HA VAL 144 -0.352 -7.590 -7.590 463 HB VAL 144 HB VAL 144 1.679 -5.817 -5.817 464 1HG1 VAL 144 1HG1 VAL 144 1.259 -7.129 -7.129 465 2HG1 VAL 144 3HG1 VAL 144 2.878 -6.632 -6.632 466 3HG1 VAL 144 2HG1 VAL 144 1.597 -5.387 -5.387 467 1HG2 VAL 144 2HG2 VAL 144 1.052 -8.750 -8.750 468 2HG2 VAL 144 1HG2 VAL 144 1.581 -8.071 -8.071 469 3HG2 VAL 144 3HG2 VAL 144 2.788 -8.233 -8.233 470 H LEU 145 H LEU 145 -0.134 -4.488 -4.488 471 HA LEU 145 HA LEU 145 -0.858 -2.792 -2.792 472 1HB LEU 145 2HB LEU 145 -1.416 -2.766 -2.766 473 2HB LEU 145 1HB LEU 145 -1.792 -1.369 -1.369 474 HG LEU 145 HG LEU 145 0.957 -2.614 -2.614 475 1HD1 LEU 145 2HD1 LEU 145 -0.501 -0.062 -0.062 476 2HD1 LEU 145 1HD1 LEU 145 1.258 -0.374 -0.374 477 3HD1 LEU 145 3HD1 LEU 145 0.029 -1.484 -1.484 478 1HD2 LEU 145 1HD2 LEU 145 -0.085 -0.493 -0.493 479 2HD2 LEU 145 3HD2 LEU 145 0.998 -1.868 -1.868 480 3HD2 LEU 145 2HD2 LEU 145 1.660 -0.455 -0.455 481 H ASN 146 H ASN 146 -2.978 -4.058 -4.058 482 HA ASN 146 HA ASN 146 -5.488 -3.230 -3.230 483 1HB ASN 146 2HB ASN 146 -4.312 -4.225 -4.225 484 2HB ASN 146 1HB ASN 146 -5.088 -5.749 -5.749 485 1HD2 ASN 146 1HD2 ASN 146 -6.436 -6.328 -6.328 486 2HD2 ASN 146 2HD2 ASN 146 -7.326 -5.380 -5.380 487 H ARG 147 H ARG 147 -3.617 -6.214 -6.214 488 HA ARG 147 HA ARG 147 -5.852 -7.104 -7.104 489 1HB ARG 147 2HB ARG 147 -4.544 -8.640 -8.640 490 2HB ARG 147 1HB ARG 147 -3.006 -7.906 -7.906 491 1HG ARG 147 2HG ARG 147 -3.173 -8.994 -8.994 492 2HG ARG 147 1HG ARG 147 -4.994 -9.076 -9.076 493 1HD ARG 147 2HD ARG 147 -3.843 -11.376 -11.376 494 2HD ARG 147 1HD ARG 147 -4.643 -10.933 -10.933 495 HE ARG 147 HE ARG 147 -2.060 -9.854 -9.854 496 1HH1 ARG 147 1HH2 ARG 147 -3.435 -13.089 -13.089 497 2HH1 ARG 147 2HH2 ARG 147 -2.029 -13.943 -13.943 498 1HH2 ARG 147 1HH1 ARG 147 -0.166 -11.015 -11.015 499 2HH2 ARG 147 2HH1 ARG 147 -0.142 -12.745 -12.745 500 H VAL 148 H VAL 148 -3.229 -4.721 -4.721 501 HA VAL 148 HA VAL 148 -3.204 -5.243 -5.243 502 HB VAL 148 HB VAL 148 -2.623 -2.611 -2.611 503 1HG1 VAL 148 3HG1 VAL 148 -2.670 -3.351 -3.351 504 2HG1 VAL 148 2HG1 VAL 148 -1.239 -4.371 -4.371 505 3HG1 VAL 148 1HG1 VAL 148 -1.142 -2.568 -2.568 506 1HG2 VAL 148 1HG2 VAL 148 -0.752 -4.993 -4.993 507 2HG2 VAL 148 3HG2 VAL 148 -1.391 -4.024 -4.024 508 3HG2 VAL 148 2HG2 VAL 148 -0.265 -3.263 -3.263 509 H LYS 149 H LYS 149 -4.846 -2.945 -2.945 510 HA LYS 149 HA LYS 149 -6.352 -1.483 -1.483 511 1HB LYS 149 2HB LYS 149 -6.327 -1.275 -1.275 512 2HB LYS 149 1HB LYS 149 -7.165 -2.871 -2.871 513 1HG LYS 149 2HG LYS 149 -9.134 -2.211 -2.211 514 2HG LYS 149 1HG LYS 149 -8.571 -0.669 -0.669 515 1HD LYS 149 2HD LYS 149 -8.823 -1.385 -1.385 516 2HD LYS 149 1HD LYS 149 -10.021 -0.407 -0.407 517 1HE LYS 149 2HE LYS 149 -8.763 1.497 1.497 518 2HE LYS 149 1HE LYS 149 -7.321 0.615 0.615 519 1HZ LYS 149 1HZ LYS 149 -10.012 0.988 0.988 520 2HZ LYS 149 3HZ LYS 149 -8.605 1.860 1.860 521 3HZ LYS 149 2HZ LYS 149 -8.684 0.195 0.195 522 H ASP 150 H ASP 150 -7.084 -4.773 -4.773 523 HA ASP 150 HA ASP 150 -9.675 -4.754 -4.754 524 1HB ASP 150 2HB ASP 150 -7.688 -6.758 -6.758 525 2HB ASP 150 1HB ASP 150 -9.310 -7.212 -7.212 526 H ASP 151 H ASP 151 -6.553 -6.267 -6.267 527 HA ASP 151 HA ASP 151 -8.139 -7.319 -7.319 528 1HB ASP 151 2HB ASP 151 -5.967 -8.285 -8.285 529 2HB ASP 151 1HB ASP 151 -5.136 -6.917 -6.917 530 H LEU 152 H LEU 152 -6.747 -4.022 -4.022 531 HA LEU 152 HA LEU 152 -6.825 -3.541 -3.541 532 1HB LEU 152 2HB LEU 152 -5.983 -2.021 -2.021 533 2HB LEU 152 1HB LEU 152 -7.291 -1.177 -1.177 534 HG LEU 152 HG LEU 152 -5.287 -0.239 -0.239 535 1HD1 LEU 152 3HD1 LEU 152 -6.809 -0.703 -0.703 536 2HD1 LEU 152 2HD1 LEU 152 -6.085 -2.317 -2.317 537 3HD1 LEU 152 1HD1 LEU 152 -5.114 -0.852 -0.852 538 1HD2 LEU 152 2HD2 LEU 152 -4.225 -3.027 -3.027 539 2HD2 LEU 152 1HD2 LEU 152 -3.671 -1.479 -1.479 540 3HD2 LEU 152 3HD2 LEU 152 -3.390 -1.732 -1.732 541 H GLN 153 H GLN 153 -8.957 -3.085 -3.085 542 HA GLN 153 HA GLN 153 -10.410 -1.286 -1.286 543 1HB GLN 153 2HB GLN 153 -10.394 -3.633 -3.633 544 2HB GLN 153 1HB GLN 153 -11.855 -3.897 -3.897 545 1HG GLN 153 2HG GLN 153 -12.822 -1.795 -1.795 546 2HG GLN 153 1HG GLN 153 -11.157 -1.582 -1.582 547 1HE2 GLN 153 1HE2 GLN 153 -11.904 -1.746 -1.746 548 2HE2 GLN 153 2HE2 GLN 153 -12.368 -3.259 -3.259 549 H GLU 154 H GLU 154 -10.789 -3.425 -3.425 550 HA GLU 154 HA GLU 154 -13.272 -2.956 -2.956 551 1HB GLU 154 2HB GLU 154 -10.723 -3.308 -3.308 552 2HB GLU 154 1HB GLU 154 -12.338 -3.979 -3.979 553 1HG GLU 154 2HG GLU 154 -11.904 -5.475 -5.475 554 2HG GLU 154 1HG GLU 154 -10.245 -4.727 -4.727 555 H LEU 155 H LEU 155 -10.215 -1.475 -1.475 556 HA LEU 155 HA LEU 155 -11.120 0.327 0.327 557 1HB LEU 155 2HB LEU 155 -9.707 -1.673 -1.673 558 2HB LEU 155 1HB LEU 155 -8.556 -1.191 -1.191 559 HG LEU 155 HG LEU 155 -7.628 -1.050 -1.050 560 1HD1 LEU 155 1HD1 LEU 155 -6.880 0.709 0.709 561 2HD1 LEU 155 3HD1 LEU 155 -7.976 1.904 1.904 562 3HD1 LEU 155 2HD1 LEU 155 -6.614 1.160 1.160 563 1HD2 LEU 155 2HD2 LEU 155 -9.468 -0.798 -0.798 564 2HD2 LEU 155 1HD2 LEU 155 -7.978 0.165 0.165 565 3HD2 LEU 155 3HD2 LEU 155 -9.469 0.998 0.998 566 H ALA 156 H ALA 156 -8.919 -0.209 -0.209 567 HA ALA 156 HA ALA 156 -8.531 2.748 2.748 568 1HB ALA 156 3HB ALA 156 -6.364 1.432 1.432 569 2HB ALA 156 2HB ALA 156 -6.930 0.873 0.873 570 3HB ALA 156 1HB ALA 156 -6.728 2.607 2.607 571 H VAL 157 H VAL 157 -9.541 3.726 3.726 572 HA VAL 157 HA VAL 157 -8.606 1.830 1.830 573 HB VAL 157 HB VAL 157 -10.163 2.637 2.637 574 1HG1 VAL 157 3HG1 VAL 157 -11.608 2.230 2.230 575 2HG1 VAL 157 2HG1 VAL 157 -12.401 2.217 2.217 576 3HG1 VAL 157 1HG1 VAL 157 -11.123 0.990 0.990 577 1HG2 VAL 157 2HG2 VAL 157 -10.272 5.098 5.098 578 2HG2 VAL 157 1HG2 VAL 157 -10.361 4.864 4.864 579 3HG2 VAL 157 3HG2 VAL 157 -11.832 4.591 4.591 580 H VAL 158 H VAL 158 -8.325 2.425 2.425 581 HA VAL 158 HA VAL 158 -6.066 4.032 4.032 582 HB VAL 158 HB VAL 158 -7.414 2.832 2.832 583 1HG1 VAL 158 3HG1 VAL 158 -5.301 4.005 4.005 584 2HG1 VAL 158 2HG1 VAL 158 -4.436 2.822 2.822 585 3HG1 VAL 158 1HG1 VAL 158 -5.336 2.245 2.245 586 1HG2 VAL 158 2HG2 VAL 158 -5.863 1.370 1.370 587 2HG2 VAL 158 1HG2 VAL 158 -7.522 0.999 0.999 588 3HG2 VAL 158 3HG2 VAL 158 -6.054 0.673 0.673 589 H GLU 159 H GLU 159 -5.666 5.760 5.760 590 HA GLU 159 HA GLU 159 -7.870 7.544 7.544 591 1HB GLU 159 2HB GLU 159 -5.601 8.150 8.150 592 2HB GLU 159 1HB GLU 159 -5.004 7.651 7.651 593 1HG GLU 159 2HG GLU 159 -6.208 9.604 9.604 594 2HG GLU 159 1HG GLU 159 -6.959 10.001 10.001 595 H SER 160 H SER 160 -5.674 5.654 5.654 596 HA SER 160 HA SER 160 -7.417 5.996 5.996 597 1HB SER 160 2HB SER 160 -5.648 7.970 7.970 598 2HB SER 160 1HB SER 160 -4.651 6.648 6.648 599 HG SER 160 HG SER 160 -6.220 6.520 6.520 600 H PHE 161 H PHE 161 -6.955 4.373 4.373 601 HA PHE 161 HA PHE 161 -4.576 2.723 2.723 602 1HB PHE 161 2HB PHE 161 -7.068 1.756 1.756 603 2HB PHE 161 1HB PHE 161 -6.650 1.658 1.658 604 HD1 PHE 161 2HD PHE 161 -4.480 0.766 0.766 605 HD2 PHE 161 1HD PHE 161 -6.318 0.099 0.099 606 HE1 PHE 161 2HE PHE 161 -2.774 -0.935 -0.935 607 HE2 PHE 161 1HE PHE 161 -4.791 -1.404 -1.404 608 HZ PHE 161 HZ PHE 161 -3.110 -2.261 -2.261 609 HA PRO 162 HA PRO 162 -4.861 6.033 6.033 610 1HB PRO 162 2HB PRO 162 -2.307 7.200 7.200 611 2HB PRO 162 1HB PRO 162 -3.554 7.182 7.182 612 1HG PRO 162 2HG PRO 162 -1.049 5.613 5.613 613 2HG PRO 162 1HG PRO 162 -2.249 5.873 5.873 614 1HD PRO 162 2HD PRO 162 -1.986 3.608 3.608 615 2HD PRO 162 1HD PRO 162 -2.885 3.618 3.618 616 H THR 163 H THR 163 -1.305 5.669 5.669 617 HA THR 163 HA THR 163 -2.594 6.785 6.785 618 HB THR 163 HB THR 163 0.258 7.196 7.196 619 HG1 THR 163 1HG THR 163 -1.121 7.100 7.100 620 1HG2 THR 163 1HG2 THR 163 -2.200 8.658 8.658 621 2HG2 THR 163 3HG2 THR 163 -0.589 9.421 9.421 622 3HG2 THR 163 2HG2 THR 163 -1.606 8.865 8.865 623 H LYS 164 H LYS 164 0.635 5.646 5.646 624 HA LYS 164 HA LYS 164 0.213 3.211 3.211 625 1HB LYS 164 2HB LYS 164 -0.301 4.793 4.793 626 2HB LYS 164 1HB LYS 164 1.320 5.530 5.530 627 1HG LYS 164 2HG LYS 164 2.403 3.340 3.340 628 2HG LYS 164 1HG LYS 164 0.789 2.559 2.559 629 1HD LYS 164 2HD LYS 164 1.808 4.874 4.874 630 2HD LYS 164 1HD LYS 164 1.941 3.128 3.128 631 1HE LYS 164 2HE LYS 164 -0.569 2.913 2.913 632 2HE LYS 164 1HE LYS 164 -0.698 4.695 4.695 633 1HZ LYS 164 2HZ LYS 164 0.593 3.409 3.409 634 2HZ LYS 164 1HZ LYS 164 -0.935 4.150 4.150 635 3HZ LYS 164 3HZ LYS 164 0.465 5.078 5.078 636 H ILE 165 H ILE 165 2.512 2.272 2.272 637 HA ILE 165 HA ILE 165 3.927 3.506 3.506 638 HB ILE 165 HB ILE 165 4.973 1.372 1.372 639 1HG1 ILE 165 2HG1 ILE 165 2.927 0.975 0.975 640 2HG1 ILE 165 1HG1 ILE 165 2.500 0.828 0.828 641 1HG2 ILE 165 1HG2 ILE 165 5.196 2.094 2.094 642 2HG2 ILE 165 3HG2 ILE 165 5.911 0.593 0.593 643 3HG2 ILE 165 2HG2 ILE 165 6.505 2.184 2.184 644 1HD1 ILE 165 1HD1 ILE 165 4.638 -0.977 -0.977 645 2HD1 ILE 165 3HD1 ILE 165 2.878 -1.314 -1.314 646 3HD1 ILE 165 2HD1 ILE 165 3.652 -1.175 -1.175 647 H GLU 166 H GLU 166 5.689 4.541 4.541 648 HA GLU 166 HA GLU 166 6.834 5.405 5.405 649 1HB GLU 166 2HB GLU 166 6.646 7.007 7.007 650 2HB GLU 166 1HB GLU 166 7.586 7.507 7.507 651 1HG GLU 166 2HG GLU 166 5.447 7.581 7.581 652 2HG GLU 166 1HG GLU 166 4.515 7.162 7.162 653 H GLY 167 H GLY 167 8.788 4.453 4.453 654 1HA GLY 167 2HA GLY 167 10.791 3.606 3.606 655 2HA GLY 167 1HA GLY 167 10.488 4.221 4.221 656 H ARG 168 H ARG 168 11.164 2.370 2.370 657 HA ARG 168 HA ARG 168 9.683 -0.048 -0.048 658 1HB ARG 168 2HB ARG 168 11.570 -1.205 -1.205 659 2HB ARG 168 1HB ARG 168 12.091 -0.362 -0.362 660 1HG ARG 168 2HG ARG 168 12.935 1.574 1.574 661 2HG ARG 168 1HG ARG 168 12.410 0.788 0.788 662 1HD ARG 168 2HD ARG 168 13.958 -1.162 -1.162 663 2HD ARG 168 1HD ARG 168 14.604 -0.188 -0.188 664 HE ARG 168 HE ARG 168 14.507 1.246 1.246 665 1HH1 ARG 168 1HH1 ARG 168 16.404 -0.879 -0.879 666 2HH1 ARG 168 2HH1 ARG 168 17.924 -0.503 -0.503 667 1HH2 ARG 168 1HH2 ARG 168 16.573 1.735 1.735 668 2HH2 ARG 168 2HH2 ARG 168 18.022 0.997 0.997 669 H GLN 169 H GLN 169 8.274 1.943 1.943 670 HA GLN 169 HA GLN 169 7.995 0.765 0.765 671 1HB GLN 169 2HB GLN 169 10.251 1.972 1.972 672 2HB GLN 169 1HB GLN 169 9.338 3.400 3.400 673 1HG GLN 169 2HG GLN 169 8.020 3.164 3.164 674 2HG GLN 169 1HG GLN 169 9.004 1.662 1.662 675 1HE2 GLN 169 1HE2 GLN 169 8.857 5.119 5.119 676 2HE2 GLN 169 2HE2 GLN 169 10.477 5.400 5.400 677 H MET 170 H MET 170 5.873 1.145 1.145 678 HA MET 170 HA MET 170 4.527 3.461 3.461 679 1HB MET 170 2HB MET 170 3.651 1.252 1.252 680 2HB MET 170 1HB MET 170 3.276 0.742 0.742 681 1HG MET 170 2HG MET 170 1.748 2.800 2.800 682 2HG MET 170 1HG MET 170 2.081 2.961 2.961 683 1HE MET 170 1HE MET 170 0.660 1.314 1.314 684 2HE MET 170 3HE MET 170 1.320 -0.247 -0.247 685 3HE MET 170 2HE MET 170 -0.450 -0.002 -0.002 686 H ILE 171 H ILE 171 3.865 4.945 4.945 687 HA ILE 171 HA ILE 171 3.440 3.994 3.994 688 HB ILE 171 HB ILE 171 2.895 6.627 6.627 689 1HG1 ILE 171 2HG1 ILE 171 5.299 5.764 5.764 690 2HG1 ILE 171 1HG1 ILE 171 4.861 7.450 7.450 691 1HG2 ILE 171 2HG2 ILE 171 2.310 5.730 5.730 692 2HG2 ILE 171 1HG2 ILE 171 2.606 7.477 7.477 693 3HG2 ILE 171 3HG2 ILE 171 1.205 6.644 6.644 694 1HD1 ILE 171 3HD1 ILE 171 4.323 6.344 6.344 695 2HD1 ILE 171 2HD1 ILE 171 4.840 4.826 4.826 696 3HD1 ILE 171 1HD1 ILE 171 6.048 6.140 6.140 697 H MET 172 H MET 172 1.579 3.290 3.290 698 HA MET 172 HA MET 172 -0.986 4.165 4.165 699 1HB MET 172 2HB MET 172 -0.992 1.714 1.714 700 2HB MET 172 1HB MET 172 -0.199 1.647 1.647 701 1HG MET 172 2HG MET 172 -2.193 2.398 2.398 702 2HG MET 172 1HG MET 172 -2.907 2.992 2.992 703 1HE MET 172 1HE MET 172 -3.220 0.894 0.894 704 2HE MET 172 3HE MET 172 -3.876 -0.673 -0.673 705 3HE MET 172 2HE MET 172 -2.085 -0.407 -0.407 706 H VAL 173 H VAL 173 -1.864 5.683 5.683 707 HA VAL 173 HA VAL 173 -0.555 6.213 6.213 708 HB VAL 173 HB VAL 173 -2.968 7.577 7.577 709 1HG1 VAL 173 1HG1 VAL 173 -1.217 7.831 7.831 710 2HG1 VAL 173 3HG1 VAL 173 -1.755 9.407 9.407 711 3HG1 VAL 173 2HG1 VAL 173 -2.975 8.231 8.231 712 1HG2 VAL 173 3HG2 VAL 173 0.054 8.130 8.130 713 2HG2 VAL 173 2HG2 VAL 173 -1.087 7.725 7.725 714 3HG2 VAL 173 1HG2 VAL 173 -1.239 9.294 9.294 715 H LEU 174 H LEU 174 -1.710 5.706 5.706 716 HA LEU 174 HA LEU 174 -4.511 4.589 4.589 717 1HB LEU 174 2HB LEU 174 -3.443 2.607 2.607 718 2HB LEU 174 1HB LEU 174 -2.091 3.256 3.256 719 HG LEU 174 HG LEU 174 -3.801 3.693 3.693 720 1HD1 LEU 174 2HD1 LEU 174 -5.325 2.486 2.486 721 2HD1 LEU 174 1HD1 LEU 174 -5.392 1.414 1.414 722 3HD1 LEU 174 3HD1 LEU 174 -5.906 3.174 3.174 723 1HD2 LEU 174 2HD2 LEU 174 -3.058 0.852 0.852 724 2HD2 LEU 174 1HD2 LEU 174 -2.078 2.090 2.090 725 3HD2 LEU 174 3HD2 LEU 174 -3.721 1.482 1.482 726 H ALA 175 H ALA 175 -5.885 5.333 5.333 727 HA ALA 175 HA ALA 175 -4.714 7.316 7.316 728 1HB ALA 175 1HB ALA 175 -7.279 7.157 7.157 729 2HB ALA 175 3HB ALA 175 -6.842 8.661 8.661 730 3HB ALA 175 2HB ALA 175 -5.827 8.197 8.197 731 HA PRO 176 HA PRO 176 -7.953 5.787 5.787 732 1HB PRO 176 2HB PRO 176 -9.044 8.623 8.623 733 2HB PRO 176 1HB PRO 176 -8.826 7.512 7.512 734 1HG PRO 176 2HG PRO 176 -6.999 9.500 9.500 735 2HG PRO 176 1HG PRO 176 -6.421 7.826 7.826 736 1HD PRO 176 2HD PRO 176 -6.587 9.155 9.155 737 2HD PRO 176 1HD PRO 176 -5.276 8.104 8.104 738 H LYS 177 H LYS 177 -9.932 4.782 4.782 739 HA LYS 177 HA LYS 177 -11.503 5.662 5.662 740 1HB LYS 177 2HB LYS 177 -11.349 3.239 3.239 741 2HB LYS 177 1HB LYS 177 -12.293 3.857 3.857 742 1HG LYS 177 2HG LYS 177 -14.237 4.289 4.289 743 2HG LYS 177 1HG LYS 177 -13.224 3.899 3.899 744 1HD LYS 177 2HD LYS 177 -14.740 2.040 2.040 745 2HD LYS 177 1HD LYS 177 -13.016 1.554 1.554 746 1HE LYS 177 2HE LYS 177 -14.437 0.647 0.647 747 2HE LYS 177 1HE LYS 177 -13.154 1.748 1.748 748 1HZ LYS 177 3HZ LYS 177 -16.002 2.453 2.453 749 2HZ LYS 177 2HZ LYS 177 -15.274 2.160 2.160 750 3HZ LYS 177 1HZ LYS 177 -14.804 3.505 3.505 751 H LYS 178 H LYS 178 -13.772 6.444 6.444 752 HA LYS 178 HA LYS 178 -14.004 8.470 8.470 753 1HB LYS 178 2HB LYS 178 -16.002 6.969 6.969 754 2HB LYS 178 1HB LYS 178 -16.503 8.342 8.342 755 1HG LYS 178 2HG LYS 178 -14.430 8.523 8.523 756 2HG LYS 178 1HG LYS 178 -16.165 8.976 8.976 757 1HD LYS 178 2HD LYS 178 -15.854 10.695 10.695 758 2HD LYS 178 1HD LYS 178 -14.102 10.291 10.291 759 1HE LYS 178 2HE LYS 178 -13.804 10.995 10.995 760 2HE LYS 178 1HE LYS 178 -15.570 11.393 11.393 761 1HZ LYS 178 1HZ LYS 178 -13.605 12.613 12.613 762 2HZ LYS 178 3HZ LYS 178 -14.235 13.321 13.321 763 3HZ LYS 178 2HZ LYS 178 -15.260 12.984 12.984 764 H LYS 179 H LYS 179 -14.752 8.478 8.478 765 HA LYS 179 HA LYS 179 -15.176 7.811 7.811 766 1HB LYS 179 2HB LYS 179 -16.937 5.592 5.592 767 2HB LYS 179 1HB LYS 179 -16.842 6.063 6.063 768 1HG LYS 179 2HG LYS 179 -17.664 8.350 8.350 769 2HG LYS 179 1HG LYS 179 -17.761 7.901 7.901 770 1HD LYS 179 2HD LYS 179 -19.428 6.124 6.124 771 2HD LYS 179 1HD LYS 179 -19.338 6.556 6.556 772 1HE LYS 179 2HE LYS 179 -20.213 8.852 8.852 773 2HE LYS 179 1HE LYS 179 -20.289 8.433 8.433 774 1HZ LYS 179 1HZ LYS 179 -21.749 7.046 7.046 775 2HZ LYS 179 3HZ LYS 179 -22.400 8.178 8.178 776 3HZ LYS 179 2HZ LYS 179 -21.832 6.683 6.683 777 H GLN 180 H GLN 180 -12.877 7.368 7.368 778 HA GLN 180 HA GLN 180 -11.110 6.344 6.344 779 1HB GLN 180 2HB GLN 180 -12.262 5.562 5.562 780 2HB GLN 180 1HB GLN 180 -12.766 4.069 4.069 781 1HG GLN 180 2HG GLN 180 -10.790 3.643 3.643 782 2HG GLN 180 1HG GLN 180 -10.351 3.411 3.411 783 1HE2 GLN 180 1HE2 GLN 180 -10.226 5.702 5.702 784 2HE2 GLN 180 2HE2 GLN 180 -8.841 6.597 6.597 Start of MODEL 9 1 HA VAL 90 HA VAL 90 -4.178 16.511 16.511 2 HB VAL 90 HB VAL 90 -3.242 16.939 16.939 3 1HG1 VAL 90 3HG1 VAL 90 -3.388 19.158 19.158 4 2HG1 VAL 90 2HG1 VAL 90 -3.506 19.318 19.318 5 3HG1 VAL 90 1HG1 VAL 90 -4.720 18.315 18.315 6 1HG2 VAL 90 1HG2 VAL 90 -0.835 18.002 18.002 7 2HG2 VAL 90 3HG2 VAL 90 -0.868 16.563 16.563 8 3HG2 VAL 90 2HG2 VAL 90 -1.166 18.209 18.209 9 H ILE 91 H ILE 91 -3.806 15.321 15.321 10 HA ILE 91 HA ILE 91 -2.843 12.660 12.660 11 HB ILE 91 HB ILE 91 -4.421 13.724 13.724 12 1HG1 ILE 91 2HG1 ILE 91 -5.790 13.826 13.826 13 2HG1 ILE 91 1HG1 ILE 91 -6.308 12.411 12.411 14 1HG2 ILE 91 2HG2 ILE 91 -3.560 10.864 10.864 15 2HG2 ILE 91 1HG2 ILE 91 -4.837 11.241 11.241 16 3HG2 ILE 91 3HG2 ILE 91 -3.150 11.762 11.762 17 1HD1 ILE 91 1HD1 ILE 91 -4.899 10.916 10.916 18 2HD1 ILE 91 3HD1 ILE 91 -4.542 12.353 12.353 19 3HD1 ILE 91 2HD1 ILE 91 -6.239 11.770 11.770 20 H GLN 92 H GLN 92 -0.985 11.854 11.854 21 HA GLN 92 HA GLN 92 0.730 13.786 13.786 22 1HB GLN 92 2HB GLN 92 1.468 11.471 11.471 23 2HB GLN 92 1HB GLN 92 2.513 12.877 12.877 24 1HG GLN 92 2HG GLN 92 1.082 14.384 14.384 25 2HG GLN 92 1HG GLN 92 -0.153 13.108 13.108 26 1HE2 GLN 92 1HE2 GLN 92 -0.316 12.243 12.243 27 2HE2 GLN 92 2HE2 GLN 92 0.962 11.883 11.883 28 H VAL 93 H VAL 93 2.545 12.713 12.713 29 HA VAL 93 HA VAL 93 1.521 10.188 10.188 30 HB VAL 93 HB VAL 93 3.804 11.879 11.879 31 1HG1 VAL 93 2HG1 VAL 93 2.686 9.049 9.049 32 2HG1 VAL 93 1HG1 VAL 93 3.681 9.920 9.920 33 3HG1 VAL 93 3HG1 VAL 93 4.461 9.407 9.407 34 1HG2 VAL 93 1HG2 VAL 93 1.273 12.305 12.305 35 2HG2 VAL 93 3HG2 VAL 93 2.338 11.828 11.828 36 3HG2 VAL 93 2HG2 VAL 93 1.328 10.569 10.569 37 H LYS 94 H LYS 94 1.941 8.556 8.556 38 HA LYS 94 HA LYS 94 4.886 8.142 8.142 39 1HB LYS 94 2HB LYS 94 2.776 6.285 6.285 40 2HB LYS 94 1HB LYS 94 4.502 6.377 6.377 41 1HG LYS 94 2HG LYS 94 2.424 8.593 8.593 42 2HG LYS 94 1HG LYS 94 2.884 7.359 7.359 43 1HD LYS 94 2HD LYS 94 5.246 8.133 8.133 44 2HD LYS 94 1HD LYS 94 4.807 9.441 9.441 45 1HE LYS 94 2HE LYS 94 3.179 10.375 10.375 46 2HE LYS 94 1HE LYS 94 3.679 9.089 9.089 47 1HZ LYS 94 3HZ LYS 94 5.927 9.931 9.931 48 2HZ LYS 94 2HZ LYS 94 5.451 11.137 11.137 49 3HZ LYS 94 1HZ LYS 94 4.841 11.145 11.145 50 H GLU 95 H GLU 95 5.379 5.643 5.643 51 HA GLU 95 HA GLU 95 4.016 5.030 5.030 52 1HB GLU 95 2HB GLU 95 6.208 6.371 6.371 53 2HB GLU 95 1HB GLU 95 6.944 4.841 4.841 54 1HG GLU 95 2HG GLU 95 6.336 3.704 3.704 55 2HG GLU 95 1HG GLU 95 5.389 5.158 5.158 56 H ILE 96 H ILE 96 4.214 2.792 2.792 57 HA ILE 96 HA ILE 96 5.714 0.996 0.996 58 HB ILE 96 HB ILE 96 2.956 1.012 1.012 59 1HG1 ILE 96 2HG1 ILE 96 3.141 -1.510 -1.510 60 2HG1 ILE 96 1HG1 ILE 96 4.872 -1.415 -1.415 61 1HG2 ILE 96 1HG2 ILE 96 2.646 0.697 0.697 62 2HG2 ILE 96 3HG2 ILE 96 3.392 -0.978 -0.978 63 3HG2 ILE 96 2HG2 ILE 96 1.931 -0.617 -0.617 64 1HD1 ILE 96 3HD1 ILE 96 3.473 0.211 0.211 65 2HD1 ILE 96 2HD1 ILE 96 4.560 -1.209 -1.209 66 3HD1 ILE 96 1HD1 ILE 96 5.223 0.329 0.329 67 H LYS 97 H LYS 97 6.404 -0.920 -0.920 68 HA LYS 97 HA LYS 97 5.864 -0.218 -0.218 69 1HB LYS 97 2HB LYS 97 8.316 -1.770 -1.770 70 2HB LYS 97 1HB LYS 97 7.757 -1.370 -1.370 71 1HG LYS 97 2HG LYS 97 7.993 1.089 1.089 72 2HG LYS 97 1HG LYS 97 8.752 0.634 0.634 73 1HD LYS 97 2HD LYS 97 9.802 -0.135 -0.135 74 2HD LYS 97 1HD LYS 97 10.402 1.237 1.237 75 1HE LYS 97 2HE LYS 97 11.122 -0.383 -0.383 76 2HE LYS 97 1HE LYS 97 10.591 -1.761 -1.761 77 1HZ LYS 97 1HZ LYS 97 12.128 -0.992 -0.992 78 2HZ LYS 97 3HZ LYS 97 12.635 0.285 0.285 79 3HZ LYS 97 2HZ LYS 97 12.922 -1.323 -1.323 80 H PHE 98 H PHE 98 5.642 -2.061 -2.061 81 HA PHE 98 HA PHE 98 5.526 -4.634 -4.634 82 1HB PHE 98 2HB PHE 98 3.284 -3.361 -3.361 83 2HB PHE 98 1HB PHE 98 3.476 -5.129 -5.129 84 HD1 PHE 98 1HD PHE 98 3.916 -5.824 -5.824 85 HD2 PHE 98 2HD PHE 98 1.546 -2.805 -2.805 86 HE1 PHE 98 1HE PHE 98 2.771 -5.635 -5.635 87 HE2 PHE 98 2HE PHE 98 0.305 -2.575 -2.575 88 HZ PHE 98 HZ PHE 98 0.829 -4.153 -4.153 89 H ARG 99 H ARG 99 7.108 -5.656 -5.656 90 HA ARG 99 HA ARG 99 7.889 -4.733 -4.733 91 1HB ARG 99 2HB ARG 99 9.045 -6.721 -6.721 92 2HB ARG 99 1HB ARG 99 9.759 -6.265 -6.265 93 1HG ARG 99 2HG ARG 99 10.902 -4.645 -4.645 94 2HG ARG 99 1HG ARG 99 9.364 -3.778 -3.778 95 1HD ARG 99 2HD ARG 99 10.678 -5.835 -5.835 96 2HD ARG 99 1HD ARG 99 10.810 -4.028 -4.028 97 HE ARG 99 HE ARG 99 8.049 -4.581 -4.581 98 1HH1 ARG 99 1HH2 ARG 99 10.802 -5.460 -5.460 99 2HH1 ARG 99 2HH2 ARG 99 9.822 -5.751 -5.751 100 1HH2 ARG 99 1HH1 ARG 99 6.742 -4.970 -4.970 101 2HH2 ARG 99 2HH1 ARG 99 7.484 -5.471 -5.471 102 HA PRO 100 HA PRO 100 6.218 -8.568 -8.568 103 1HB PRO 100 2HB PRO 100 8.467 -9.428 -9.428 104 2HB PRO 100 1HB PRO 100 7.049 -8.492 -8.492 105 1HG PRO 100 2HG PRO 100 9.816 -7.566 -7.566 106 2HG PRO 100 1HG PRO 100 8.628 -6.771 -6.771 107 1HD PRO 100 2HD PRO 100 9.263 -5.929 -5.929 108 2HD PRO 100 1HD PRO 100 7.675 -5.530 -5.530 109 H GLY 101 H GLY 101 6.397 -10.723 -10.723 110 1HA GLY 101 2HA GLY 101 7.428 -12.516 -12.516 111 2HA GLY 101 1HA GLY 101 8.942 -11.522 -11.522 112 H THR 102 H THR 102 6.404 -9.845 -9.845 113 HA THR 102 HA THR 102 6.597 -10.495 -10.495 114 HB THR 102 HB THR 102 5.384 -7.899 -7.899 115 HG1 THR 102 1HG THR 102 7.677 -8.025 -8.025 116 1HG2 THR 102 3HG2 THR 102 5.528 -9.491 -9.491 117 2HG2 THR 102 2HG2 THR 102 5.870 -7.706 -7.706 118 3HG2 THR 102 1HG2 THR 102 4.312 -8.272 -8.272 119 H ASP 103 H ASP 103 5.450 -12.225 -12.225 120 HA ASP 103 HA ASP 103 2.652 -11.805 -11.805 121 1HB ASP 103 2HB ASP 103 4.055 -13.256 -13.256 122 2HB ASP 103 1HB ASP 103 4.026 -14.384 -14.384 123 H GLU 104 H GLU 104 2.046 -14.520 -14.520 124 HA GLU 104 HA GLU 104 0.823 -12.774 -12.774 125 1HB GLU 104 2HB GLU 104 1.026 -15.742 -15.742 126 2HB GLU 104 1HB GLU 104 -0.247 -14.627 -14.627 127 1HG GLU 104 2HG GLU 104 -0.932 -14.123 -14.123 128 2HG GLU 104 1HG GLU 104 0.270 -15.344 -15.344 129 H GLY 105 H GLY 105 3.480 -14.874 -14.874 130 1HA GLY 105 2HA GLY 105 2.841 -13.975 -13.975 131 2HA GLY 105 1HA GLY 105 4.086 -15.228 -15.228 132 H ASP 106 H ASP 106 4.716 -12.751 -12.751 133 HA ASP 106 HA ASP 106 6.465 -11.352 -11.352 134 1HB ASP 106 2HB ASP 106 7.162 -12.264 -12.264 135 2HB ASP 106 1HB ASP 106 6.125 -11.067 -11.067 136 H TYR 107 H TYR 107 3.650 -11.355 -11.355 137 HA TYR 107 HA TYR 107 3.650 -8.515 -8.515 138 1HB TYR 107 2HB TYR 107 3.148 -10.299 -10.299 139 2HB TYR 107 1HB TYR 107 1.764 -10.868 -10.868 140 HD1 TYR 107 2HD TYR 107 1.776 -7.286 -7.286 141 HD2 TYR 107 1HD TYR 107 0.904 -11.002 -11.002 142 HE1 TYR 107 2HE TYR 107 -0.377 -6.386 -6.386 143 HE2 TYR 107 1HE TYR 107 -0.921 -9.924 -9.924 144 HH TYR 107 HH TYR 107 -2.068 -6.728 -6.728 145 H GLN 108 H GLN 108 0.758 -10.480 -10.480 146 HA GLN 108 HA GLN 108 -0.370 -8.481 -8.481 147 1HB GLN 108 2HB GLN 108 -1.194 -11.016 -11.016 148 2HB GLN 108 1HB GLN 108 -2.084 -9.717 -9.717 149 1HG GLN 108 2HG GLN 108 -0.381 -11.677 -11.677 150 2HG GLN 108 1HG GLN 108 -1.907 -12.108 -12.108 151 1HE2 GLN 108 1HE2 GLN 108 -0.856 -8.796 -8.796 152 2HE2 GLN 108 2HE2 GLN 108 -2.028 -8.676 -8.676 153 H VAL 109 H VAL 109 2.206 -10.037 -10.037 154 HA VAL 109 HA VAL 109 1.850 -9.273 -9.273 155 HB VAL 109 HB VAL 109 4.398 -9.478 -9.478 156 1HG1 VAL 109 3HG1 VAL 109 3.979 -9.168 -9.168 157 2HG1 VAL 109 2HG1 VAL 109 5.500 -9.788 -9.788 158 3HG1 VAL 109 1HG1 VAL 109 4.967 -8.119 -8.119 159 1HG2 VAL 109 3HG2 VAL 109 3.021 -11.492 -11.492 160 2HG2 VAL 109 2HG2 VAL 109 3.159 -11.623 -11.623 161 3HG2 VAL 109 1HG2 VAL 109 4.637 -11.700 -11.700 162 H LYS 110 H LYS 110 3.259 -7.627 -7.627 163 HA LYS 110 HA LYS 110 3.284 -5.149 -5.149 164 1HB LYS 110 2HB LYS 110 4.374 -5.921 -5.921 165 2HB LYS 110 1HB LYS 110 4.408 -4.264 -4.264 166 1HG LYS 110 2HG LYS 110 5.870 -6.752 -6.752 167 2HG LYS 110 1HG LYS 110 6.462 -5.065 -5.065 168 1HD LYS 110 2HD LYS 110 5.577 -4.214 -4.214 169 2HD LYS 110 1HD LYS 110 4.940 -5.841 -5.841 170 1HE LYS 110 2HE LYS 110 7.276 -6.764 -6.764 171 2HE LYS 110 1HE LYS 110 7.919 -5.108 -5.108 172 1HZ LYS 110 2HZ LYS 110 6.886 -4.328 -4.328 173 2HZ LYS 110 1HZ LYS 110 6.293 -5.883 -5.883 174 3HZ LYS 110 3HZ LYS 110 7.967 -5.601 -5.601 175 H LEU 111 H LEU 111 0.925 -6.684 -6.684 176 HA LEU 111 HA LEU 111 -0.310 -4.264 -4.264 177 1HB LEU 111 2HB LEU 111 -0.747 -6.573 -6.573 178 2HB LEU 111 1HB LEU 111 -1.587 -6.990 -6.990 179 HG LEU 111 HG LEU 111 -2.421 -4.583 -4.583 180 1HD1 LEU 111 3HD1 LEU 111 -2.193 -6.583 -6.583 181 2HD1 LEU 111 2HD1 LEU 111 -3.290 -7.511 -7.511 182 3HD1 LEU 111 1HD1 LEU 111 -3.910 -6.069 -6.069 183 1HD2 LEU 111 1HD2 LEU 111 -3.877 -6.490 -6.490 184 2HD2 LEU 111 3HD2 LEU 111 -3.601 -4.718 -4.718 185 3HD2 LEU 111 2HD2 LEU 111 -4.740 -5.323 -5.323 186 H ARG 112 H ARG 112 0.107 -6.480 -6.480 187 HA ARG 112 HA ARG 112 -1.640 -5.331 -5.331 188 1HB ARG 112 2HB ARG 112 -0.038 -7.472 -7.472 189 2HB ARG 112 1HB ARG 112 0.996 -6.308 -6.308 190 1HG ARG 112 2HG ARG 112 -0.779 -6.017 -6.017 191 2HG ARG 112 1HG ARG 112 -1.898 -7.048 -7.048 192 1HD ARG 112 2HD ARG 112 -0.820 -8.446 -8.446 193 2HD ARG 112 1HD ARG 112 -0.247 -8.958 -8.958 194 HE ARG 112 HE ARG 112 1.426 -6.886 -6.886 195 1HH1 ARG 112 1HH2 ARG 112 0.813 -10.380 -10.380 196 2HH1 ARG 112 2HH2 ARG 112 2.452 -10.844 -10.844 197 1HH2 ARG 112 1HH1 ARG 112 3.631 -7.529 -7.529 198 2HH2 ARG 112 2HH1 ARG 112 4.073 -9.203 -9.203 199 H SER 113 H SER 113 1.950 -4.554 -4.554 200 HA SER 113 HA SER 113 2.068 -2.621 -2.621 201 1HB SER 113 2HB SER 113 4.025 -3.518 -3.518 202 2HB SER 113 1HB SER 113 3.588 -2.783 -2.783 203 HG SER 113 HG SER 113 4.030 -1.413 -1.413 204 H LEU 114 H LEU 114 0.813 -2.441 -2.441 205 HA LEU 114 HA LEU 114 0.706 0.231 0.231 206 1HB LEU 114 2HB LEU 114 1.034 -1.416 -1.416 207 2HB LEU 114 1HB LEU 114 -0.516 -2.207 -2.207 208 HG LEU 114 HG LEU 114 -1.706 -0.256 -0.256 209 1HD1 LEU 114 3HD1 LEU 114 1.021 0.830 0.830 210 2HD1 LEU 114 2HD1 LEU 114 -0.494 1.568 1.568 211 3HD1 LEU 114 1HD1 LEU 114 -0.033 1.576 1.576 212 1HD2 LEU 114 3HD2 LEU 114 -1.358 -2.177 -2.177 213 2HD2 LEU 114 2HD2 LEU 114 -1.606 -0.668 -0.668 214 3HD2 LEU 114 1HD2 LEU 114 0.050 -1.362 -1.362 215 H ILE 115 H ILE 115 -1.729 -2.231 -2.231 216 HA ILE 115 HA ILE 115 -3.879 -0.595 -0.595 217 HB ILE 115 HB ILE 115 -3.181 -2.179 -2.179 218 1HG1 ILE 115 2HG1 ILE 115 -2.770 -3.829 -3.829 219 2HG1 ILE 115 1HG1 ILE 115 -4.232 -4.183 -4.183 220 1HG2 ILE 115 2HG2 ILE 115 -5.655 -1.288 -1.288 221 2HG2 ILE 115 1HG2 ILE 115 -5.742 -2.438 -2.438 222 3HG2 ILE 115 3HG2 ILE 115 -5.109 -0.780 -0.780 223 1HD1 ILE 115 1HD1 ILE 115 -5.641 -3.248 -3.248 224 2HD1 ILE 115 3HD1 ILE 115 -4.071 -3.051 -3.051 225 3HD1 ILE 115 2HD1 ILE 115 -4.666 -4.702 -4.702 226 H ARG 116 H ARG 116 -1.230 -1.105 -1.105 227 HA ARG 116 HA ARG 116 -1.781 0.459 0.459 228 1HB ARG 116 2HB ARG 116 0.257 -1.141 -1.141 229 2HB ARG 116 1HB ARG 116 1.085 0.440 0.440 230 1HG ARG 116 2HG ARG 116 0.599 0.827 0.827 231 2HG ARG 116 1HG ARG 116 -0.405 -0.673 -0.673 232 1HD ARG 116 2HD ARG 116 2.618 -0.631 -0.631 233 2HD ARG 116 1HD ARG 116 1.889 -1.062 -1.062 234 HE ARG 116 HE ARG 116 0.538 -2.716 -2.716 235 1HH1 ARG 116 1HH2 ARG 116 3.987 -2.058 -2.058 236 2HH1 ARG 116 2HH2 ARG 116 4.522 -3.626 -3.626 237 1HH2 ARG 116 1HH1 ARG 116 1.279 -4.831 -4.831 238 2HH2 ARG 116 2HH1 ARG 116 2.964 -5.222 -5.222 239 H PHE 117 H PHE 117 -0.101 1.463 1.463 240 HA PHE 117 HA PHE 117 0.393 4.162 4.162 241 1HB PHE 117 2HB PHE 117 -0.025 2.761 2.761 242 2HB PHE 117 1HB PHE 117 0.117 4.586 4.586 243 HD1 PHE 117 2HD PHE 117 1.850 5.536 5.536 244 HD2 PHE 117 1HD PHE 117 1.730 1.436 1.436 245 HE1 PHE 117 2HE PHE 117 4.272 5.391 5.391 246 HE2 PHE 117 1HE PHE 117 4.117 1.176 1.176 247 HZ PHE 117 HZ PHE 117 5.384 3.190 3.190 248 H LEU 118 H LEU 118 -2.440 2.776 2.776 249 HA LEU 118 HA LEU 118 -3.903 5.205 5.205 250 1HB LEU 118 2HB LEU 118 -4.517 2.307 2.307 251 2HB LEU 118 1HB LEU 118 -5.793 3.589 3.589 252 HG LEU 118 HG LEU 118 -3.246 4.412 4.412 253 1HD1 LEU 118 3HD1 LEU 118 -3.504 1.811 1.811 254 2HD1 LEU 118 2HD1 LEU 118 -4.580 2.459 2.459 255 3HD1 LEU 118 1HD1 LEU 118 -2.862 3.068 3.068 256 1HD2 LEU 118 2HD2 LEU 118 -5.385 5.561 5.561 257 2HD2 LEU 118 1HD2 LEU 118 -4.764 5.024 5.024 258 3HD2 LEU 118 3HD2 LEU 118 -6.131 4.142 4.142 259 H GLU 119 H GLU 119 -3.622 2.897 2.897 260 HA GLU 119 HA GLU 119 -5.973 3.668 3.668 261 1HB GLU 119 2HB GLU 119 -3.550 1.984 1.984 262 2HB GLU 119 1HB GLU 119 -4.624 2.564 2.564 263 1HG GLU 119 2HG GLU 119 -6.578 1.453 1.453 264 2HG GLU 119 1HG GLU 119 -5.632 0.957 0.957 265 H GLU 120 H GLU 120 -2.528 4.636 4.636 266 HA GLU 120 HA GLU 120 -2.806 6.366 6.366 267 1HB GLU 120 2HB GLU 120 -0.911 6.789 6.789 268 2HB GLU 120 1HB GLU 120 -0.802 7.544 7.544 269 1HG GLU 120 2HG GLU 120 -0.498 5.080 5.080 270 2HG GLU 120 1HG GLU 120 -0.111 4.684 4.684 271 H GLY 121 H GLY 121 -3.780 6.349 6.349 272 1HA GLY 121 2HA GLY 121 -5.038 7.707 7.707 273 2HA GLY 121 1HA GLY 121 -4.925 8.946 8.946 274 H ASP 122 H ASP 122 -3.007 7.196 7.196 275 HA ASP 122 HA ASP 122 -1.853 9.789 9.789 276 1HB ASP 122 2HB ASP 122 -0.335 7.131 7.131 277 2HB ASP 122 1HB ASP 122 0.280 8.765 8.765 278 H LYS 123 H LYS 123 -1.013 9.364 9.364 279 HA LYS 123 HA LYS 123 -2.978 7.631 7.631 280 1HB LYS 123 2HB LYS 123 -3.183 10.066 10.066 281 2HB LYS 123 1HB LYS 123 -1.386 10.081 10.081 282 1HG LYS 123 2HG LYS 123 -2.149 8.066 8.066 283 2HG LYS 123 1HG LYS 123 -3.426 9.315 9.315 284 1HD LYS 123 2HD LYS 123 -0.398 9.605 9.605 285 2HD LYS 123 1HD LYS 123 -1.687 9.947 9.947 286 1HE LYS 123 2HE LYS 123 -2.531 11.718 11.718 287 2HE LYS 123 1HE LYS 123 -0.791 11.549 11.549 288 1HZ LYS 123 3HZ LYS 123 -0.044 12.138 12.138 289 2HZ LYS 123 2HZ LYS 123 -1.638 12.267 12.267 290 3HZ LYS 123 1HZ LYS 123 -1.068 13.352 13.352 291 H ALA 124 H ALA 124 -1.877 5.793 5.793 292 HA ALA 124 HA ALA 124 1.023 5.996 5.996 293 1HB ALA 124 2HB ALA 124 -0.842 3.647 3.647 294 2HB ALA 124 1HB ALA 124 0.964 3.553 3.553 295 3HB ALA 124 3HB ALA 124 -0.005 3.964 3.964 296 H LYS 125 H LYS 125 2.133 5.577 5.577 297 HA LYS 125 HA LYS 125 0.220 5.216 5.216 298 1HB LYS 125 2HB LYS 125 3.155 6.308 6.308 299 2HB LYS 125 1HB LYS 125 2.309 5.830 5.830 300 1HG LYS 125 2HG LYS 125 0.694 7.630 7.630 301 2HG LYS 125 1HG LYS 125 1.402 8.124 8.124 302 1HD LYS 125 2HD LYS 125 3.439 8.880 8.880 303 2HD LYS 125 1HD LYS 125 3.113 7.956 7.956 304 1HE LYS 125 2HE LYS 125 1.307 9.442 9.442 305 2HE LYS 125 1HE LYS 125 1.438 10.390 10.390 306 1HZ LYS 125 3HZ LYS 125 3.556 10.086 10.086 307 2HZ LYS 125 2HZ LYS 125 2.576 11.450 11.450 308 3HZ LYS 125 1HZ LYS 125 3.682 10.974 10.974 309 H ILE 126 H ILE 126 0.459 3.270 3.270 310 HA ILE 126 HA ILE 126 2.628 1.592 1.592 311 HB ILE 126 HB ILE 126 0.855 1.340 1.340 312 1HG1 ILE 126 2HG1 ILE 126 -0.823 1.856 1.856 313 2HG1 ILE 126 1HG1 ILE 126 -0.798 0.084 0.084 314 1HG2 ILE 126 2HG2 ILE 126 2.822 -0.226 -0.226 315 2HG2 ILE 126 1HG2 ILE 126 2.166 -0.574 -0.574 316 3HG2 ILE 126 3HG2 ILE 126 1.233 -1.050 -1.050 317 1HD1 ILE 126 2HD1 ILE 126 0.432 -0.188 -0.188 318 2HD1 ILE 126 1HD1 ILE 126 0.357 1.587 1.587 319 3HD1 ILE 126 3HD1 ILE 126 -1.176 0.628 0.628 320 H THR 127 H THR 127 4.565 1.562 1.562 321 HA THR 127 HA THR 127 4.624 2.841 2.841 322 HB THR 127 HB THR 127 6.950 2.277 2.277 323 HG1 THR 127 1HG THR 127 6.998 4.500 4.500 324 1HG2 THR 127 2HG2 THR 127 6.557 3.769 3.769 325 2HG2 THR 127 1HG2 THR 127 8.057 3.915 3.915 326 3HG2 THR 127 3HG2 THR 127 7.604 2.320 2.320 327 H LEU 128 H LEU 128 4.615 1.321 1.321 328 HA LEU 128 HA LEU 128 5.518 -1.373 -1.373 329 1HB LEU 128 2HB LEU 128 3.958 -0.089 -0.089 330 2HB LEU 128 1HB LEU 128 5.273 -0.964 -0.964 331 HG LEU 128 HG LEU 128 3.532 -2.149 -2.149 332 1HD1 LEU 128 3HD1 LEU 128 2.137 -0.889 -0.889 333 2HD1 LEU 128 2HD1 LEU 128 2.680 -1.966 -1.966 334 3HD1 LEU 128 1HD1 LEU 128 1.754 -2.649 -2.649 335 1HD2 LEU 128 3HD2 LEU 128 5.486 -3.579 -3.579 336 2HD2 LEU 128 2HD2 LEU 128 3.875 -4.363 -4.363 337 3HD2 LEU 128 1HD2 LEU 128 4.690 -3.736 -3.736 338 H ARG 129 H ARG 129 7.347 -2.327 -2.327 339 HA ARG 129 HA ARG 129 9.131 -0.469 -0.469 340 1HB ARG 129 2HB ARG 129 9.658 -0.256 -0.256 341 2HB ARG 129 1HB ARG 129 9.809 -2.037 -2.037 342 1HG ARG 129 2HG ARG 129 11.767 -2.029 -2.029 343 2HG ARG 129 1HG ARG 129 11.343 -0.408 -0.408 344 1HD ARG 129 2HD ARG 129 12.395 -0.997 -0.997 345 2HD ARG 129 1HD ARG 129 13.396 -0.373 -0.373 346 HE ARG 129 HE ARG 129 11.063 1.306 1.306 347 1HH1 ARG 129 1HH2 ARG 129 14.212 0.434 0.434 348 2HH1 ARG 129 2HH2 ARG 129 14.453 1.964 1.964 349 1HH2 ARG 129 1HH1 ARG 129 11.395 3.384 3.384 350 2HH2 ARG 129 2HH1 ARG 129 12.831 3.668 3.668 351 H PHE 130 H PHE 130 8.880 -1.526 -1.526 352 HA PHE 130 HA PHE 130 8.323 -4.349 -4.349 353 1HB PHE 130 2HB PHE 130 8.951 -2.197 -2.197 354 2HB PHE 130 1HB PHE 130 8.288 -3.913 -3.913 355 HD1 PHE 130 2HD PHE 130 6.279 -4.650 -4.650 356 HD2 PHE 130 1HD PHE 130 7.561 -0.542 -0.542 357 HE1 PHE 130 2HE PHE 130 4.008 -3.839 -3.839 358 HE2 PHE 130 1HE PHE 130 5.226 0.136 0.136 359 HZ PHE 130 HZ PHE 130 3.379 -1.560 -1.560 360 H ARG 131 H ARG 131 9.728 -5.778 -5.778 361 HA ARG 131 HA ARG 131 12.483 -4.826 -4.826 362 1HB ARG 131 2HB ARG 131 11.464 -7.712 -7.712 363 2HB ARG 131 1HB ARG 131 13.180 -7.245 -7.245 364 1HG ARG 131 2HG ARG 131 13.326 -6.176 -6.176 365 2HG ARG 131 1HG ARG 131 11.574 -6.436 -6.436 366 1HD ARG 131 2HD ARG 131 11.944 -8.944 -8.944 367 2HD ARG 131 1HD ARG 131 13.739 -8.623 -8.623 368 HE ARG 131 HE ARG 131 12.628 -7.101 -7.101 369 1HH1 ARG 131 1HH1 ARG 131 12.927 -10.511 -10.511 370 2HH1 ARG 131 2HH1 ARG 131 12.889 -11.140 -11.140 371 1HH2 ARG 131 1HH2 ARG 131 12.576 -7.961 -7.961 372 2HH2 ARG 131 2HH2 ARG 131 12.687 -9.669 -9.669 373 H GLY 132 H GLY 132 10.239 -4.160 -4.160 374 1HA GLY 132 2HA GLY 132 11.009 -5.573 -5.573 375 2HA GLY 132 1HA GLY 132 9.350 -4.903 -4.903 376 H ARG 133 H ARG 133 10.964 -2.875 -2.875 377 HA ARG 133 HA ARG 133 12.089 -0.936 -0.936 378 1HB ARG 133 2HB ARG 133 13.131 -1.984 -1.984 379 2HB ARG 133 1HB ARG 133 13.748 -0.545 -0.545 380 1HG ARG 133 2HG ARG 133 14.597 -1.776 -1.776 381 2HG ARG 133 1HG ARG 133 13.729 -3.276 -3.276 382 1HD ARG 133 2HD ARG 133 15.958 -2.018 -2.018 383 2HD ARG 133 1HD ARG 133 16.208 -3.371 -3.371 384 HE ARG 133 HE ARG 133 14.808 -3.502 -3.502 385 1HH1 ARG 133 1HH1 ARG 133 15.399 -5.080 -5.080 386 2HH1 ARG 133 2HH1 ARG 133 14.910 -6.650 -6.650 387 1HH2 ARG 133 1HH2 ARG 133 14.154 -5.626 -5.626 388 2HH2 ARG 133 2HH2 ARG 133 14.193 -6.963 -6.963 389 H GLU 134 H GLU 134 12.564 0.295 0.295 390 HA GLU 134 HA GLU 134 10.656 2.181 2.181 391 1HB GLU 134 2HB GLU 134 12.243 1.138 1.138 392 2HB GLU 134 1HB GLU 134 11.376 2.719 2.719 393 1HG GLU 134 2HG GLU 134 12.852 3.440 3.440 394 2HG GLU 134 1HG GLU 134 13.727 1.861 1.861 395 H MET 135 H MET 135 8.569 2.029 2.029 396 HA MET 135 HA MET 135 6.582 1.309 1.309 397 1HB MET 135 2HB MET 135 7.413 1.092 1.092 398 2HB MET 135 1HB MET 135 5.732 0.947 0.947 399 1HG MET 135 2HG MET 135 6.761 3.333 3.333 400 2HG MET 135 1HG MET 135 7.360 3.351 3.351 401 1HE MET 135 3HE MET 135 4.443 3.398 3.398 402 2HE MET 135 2HE MET 135 2.944 3.304 3.304 403 3HE MET 135 1HE MET 135 4.003 1.864 1.864 404 H ALA 136 H ALA 136 6.962 -0.535 -0.535 405 HA ALA 136 HA ALA 136 7.809 -2.937 -2.937 406 1HB ALA 136 3HB ALA 136 8.182 -2.138 -2.138 407 2HB ALA 136 2HB ALA 136 6.453 -2.514 -2.514 408 3HB ALA 136 1HB ALA 136 7.608 -3.822 -3.822 409 H HIS 137 H HIS 137 6.463 -4.791 -4.791 410 HA HIS 137 HA HIS 137 4.340 -6.014 -6.014 411 1HB HIS 137 2HB HIS 137 4.957 -5.362 -5.362 412 2HB HIS 137 1HB HIS 137 4.080 -6.817 -6.817 413 HD1 HIS 137 1HD HIS 137 5.845 -8.253 -8.253 414 HD2 HIS 137 2HD HIS 137 7.487 -5.561 -5.561 415 HE1 HIS 137 1HE HIS 137 8.303 -8.887 -8.887 416 H GLN 138 H GLN 138 2.080 -6.107 -6.107 417 HA GLN 138 HA GLN 138 0.976 -3.996 -3.996 418 1HB GLN 138 2HB GLN 138 0.482 -3.862 -3.862 419 2HB GLN 138 1HB GLN 138 -0.530 -5.311 -5.311 420 1HG GLN 138 2HG GLN 138 -1.915 -3.259 -3.259 421 2HG GLN 138 1HG GLN 138 -1.951 -3.916 -3.916 422 1HE2 GLN 138 1HE2 GLN 138 -1.809 -2.357 -2.357 423 2HE2 GLN 138 2HE2 GLN 138 -0.849 -0.919 -0.919 424 H GLN 139 H GLN 139 1.827 -6.975 -6.975 425 HA GLN 139 HA GLN 139 -0.452 -8.338 -8.338 426 1HB GLN 139 2HB GLN 139 2.441 -9.446 -9.446 427 2HB GLN 139 1HB GLN 139 0.924 -10.352 -10.352 428 1HG GLN 139 2HG GLN 139 2.136 -8.557 -8.557 429 2HG GLN 139 1HG GLN 139 2.081 -10.361 -10.361 430 1HE2 GLN 139 1HE2 GLN 139 -0.386 -11.156 -11.156 431 2HE2 GLN 139 2HE2 GLN 139 -1.596 -10.480 -10.480 432 H ILE 140 H ILE 140 2.972 -7.499 -7.499 433 HA ILE 140 HA ILE 140 2.782 -7.535 -7.535 434 HB ILE 140 HB ILE 140 4.824 -6.804 -6.804 435 1HG1 ILE 140 2HG1 ILE 140 4.701 -9.435 -9.435 436 2HG1 ILE 140 1HG1 ILE 140 4.227 -9.316 -9.316 437 1HG2 ILE 140 3HG2 ILE 140 4.939 -5.818 -5.818 438 2HG2 ILE 140 2HG2 ILE 140 5.041 -7.498 -7.498 439 3HG2 ILE 140 1HG2 ILE 140 6.365 -6.814 -6.814 440 1HD1 ILE 140 1HD1 ILE 140 7.056 -8.691 -8.691 441 2HD1 ILE 140 3HD1 ILE 140 6.518 -10.204 -10.204 442 3HD1 ILE 140 2HD1 ILE 140 6.444 -8.622 -8.622 443 H GLY 141 H GLY 141 1.797 -6.397 -6.397 444 1HA GLY 141 2HA GLY 141 2.190 -4.100 -4.100 445 2HA GLY 141 1HA GLY 141 1.400 -3.702 -3.702 446 H MET 142 H MET 142 -0.516 -4.934 -4.934 447 HA MET 142 HA MET 142 -2.322 -4.366 -4.366 448 1HB MET 142 2HB MET 142 -2.769 -4.821 -4.821 449 2HB MET 142 1HB MET 142 -4.113 -4.409 -4.409 450 1HG MET 142 2HG MET 142 -2.617 -2.327 -2.327 451 2HG MET 142 1HG MET 142 -1.848 -2.600 -2.600 452 1HE MET 142 2HE MET 142 -3.488 -3.232 -3.232 453 2HE MET 142 1HE MET 142 -4.928 -3.914 -3.914 454 3HE MET 142 3HE MET 142 -5.104 -2.488 -2.488 455 H GLU 143 H GLU 143 -0.842 -7.283 -7.283 456 HA GLU 143 HA GLU 143 -3.261 -8.406 -8.406 457 1HB GLU 143 2HB GLU 143 -0.944 -9.772 -9.772 458 2HB GLU 143 1HB GLU 143 -0.579 -9.399 -9.399 459 1HG GLU 143 2HG GLU 143 -1.544 -11.465 -11.465 460 2HG GLU 143 1HG GLU 143 -2.980 -10.468 -10.468 461 H VAL 144 H VAL 144 -0.325 -6.903 -6.903 462 HA VAL 144 HA VAL 144 -0.594 -7.724 -7.724 463 HB VAL 144 HB VAL 144 1.038 -5.392 -5.392 464 1HG1 VAL 144 1HG1 VAL 144 0.908 -7.276 -7.276 465 2HG1 VAL 144 3HG1 VAL 144 2.453 -6.526 -6.526 466 3HG1 VAL 144 2HG1 VAL 144 1.055 -5.480 -5.480 467 1HG2 VAL 144 1HG2 VAL 144 0.964 -8.451 -8.451 468 2HG2 VAL 144 3HG2 VAL 144 1.329 -7.373 -7.373 469 3HG2 VAL 144 2HG2 VAL 144 2.590 -7.619 -7.619 470 H LEU 145 H LEU 145 -0.628 -4.607 -4.607 471 HA LEU 145 HA LEU 145 -1.620 -2.979 -2.979 472 1HB LEU 145 2HB LEU 145 -1.779 -3.060 -3.060 473 2HB LEU 145 1HB LEU 145 -2.840 -1.904 -1.904 474 HG LEU 145 HG LEU 145 -1.128 -0.692 -0.692 475 1HD1 LEU 145 3HD1 LEU 145 0.791 -2.959 -2.959 476 2HD1 LEU 145 2HD1 LEU 145 1.283 -1.231 -1.231 477 3HD1 LEU 145 1HD1 LEU 145 0.129 -2.032 -2.032 478 1HD2 LEU 145 3HD2 LEU 145 -1.520 -0.422 -0.422 479 2HD2 LEU 145 2HD2 LEU 145 0.178 0.029 0.029 480 3HD2 LEU 145 1HD2 LEU 145 -0.183 -1.560 -1.560 481 H ASN 146 H ASN 146 -3.487 -4.634 -4.634 482 HA ASN 146 HA ASN 146 -6.111 -3.903 -3.903 483 1HB ASN 146 2HB ASN 146 -4.643 -5.296 -5.296 484 2HB ASN 146 1HB ASN 146 -5.781 -6.511 -6.511 485 1HD2 ASN 146 1HD2 ASN 146 -6.109 -6.608 -6.608 486 2HD2 ASN 146 2HD2 ASN 146 -7.337 -5.656 -5.656 487 H ARG 147 H ARG 147 -4.066 -6.744 -6.744 488 HA ARG 147 HA ARG 147 -6.350 -7.494 -7.494 489 1HB ARG 147 2HB ARG 147 -5.093 -9.133 -9.133 490 2HB ARG 147 1HB ARG 147 -3.534 -8.324 -8.324 491 1HG ARG 147 2HG ARG 147 -3.562 -9.296 -9.296 492 2HG ARG 147 1HG ARG 147 -5.392 -9.318 -9.318 493 1HD ARG 147 2HD ARG 147 -4.290 -11.655 -11.655 494 2HD ARG 147 1HD ARG 147 -5.266 -11.337 -11.337 495 HE ARG 147 HE ARG 147 -2.737 -10.351 -10.351 496 1HH1 ARG 147 1HH2 ARG 147 -3.970 -13.460 -13.460 497 2HH1 ARG 147 2HH2 ARG 147 -2.743 -14.413 -14.413 498 1HH2 ARG 147 1HH1 ARG 147 -1.104 -11.650 -11.650 499 2HH2 ARG 147 2HH1 ARG 147 -1.092 -13.371 -13.371 500 H VAL 148 H VAL 148 -3.750 -5.050 -5.050 501 HA VAL 148 HA VAL 148 -3.700 -5.458 -5.458 502 HB VAL 148 HB VAL 148 -3.137 -2.863 -2.863 503 1HG1 VAL 148 3HG1 VAL 148 -3.116 -3.672 -3.672 504 2HG1 VAL 148 2HG1 VAL 148 -1.634 -4.586 -4.586 505 3HG1 VAL 148 1HG1 VAL 148 -1.665 -2.777 -2.777 506 1HG2 VAL 148 3HG2 VAL 148 -1.304 -5.261 -5.261 507 2HG2 VAL 148 2HG2 VAL 148 -1.929 -4.257 -4.257 508 3HG2 VAL 148 1HG2 VAL 148 -0.765 -3.543 -3.543 509 H LYS 149 H LYS 149 -5.396 -3.125 -3.125 510 HA LYS 149 HA LYS 149 -6.909 -1.777 -1.777 511 1HB LYS 149 2HB LYS 149 -6.998 -1.226 -1.226 512 2HB LYS 149 1HB LYS 149 -7.620 -2.881 -2.881 513 1HG LYS 149 2HG LYS 149 -9.640 -2.573 -2.573 514 2HG LYS 149 1HG LYS 149 -9.274 -1.191 -1.191 515 1HD LYS 149 2HD LYS 149 -10.295 -1.225 -1.225 516 2HD LYS 149 1HD LYS 149 -10.613 -0.192 -0.192 517 1HE LYS 149 2HE LYS 149 -9.351 1.499 1.499 518 2HE LYS 149 1HE LYS 149 -8.103 0.450 0.450 519 1HZ LYS 149 3HZ LYS 149 -10.806 1.090 1.090 520 2HZ LYS 149 2HZ LYS 149 -9.342 1.804 1.804 521 3HZ LYS 149 1HZ LYS 149 -9.616 0.153 0.153 522 H ASP 150 H ASP 150 -7.551 -5.052 -5.052 523 HA ASP 150 HA ASP 150 -10.175 -5.039 -5.039 524 1HB ASP 150 2HB ASP 150 -8.241 -6.893 -6.893 525 2HB ASP 150 1HB ASP 150 -9.642 -7.552 -7.552 526 H ASP 151 H ASP 151 -7.081 -6.449 -6.449 527 HA ASP 151 HA ASP 151 -8.723 -7.391 -7.391 528 1HB ASP 151 2HB ASP 151 -6.414 -8.225 -8.225 529 2HB ASP 151 1HB ASP 151 -5.762 -6.770 -6.770 530 H LEU 152 H LEU 152 -6.940 -4.206 -4.206 531 HA LEU 152 HA LEU 152 -7.381 -3.654 -3.654 532 1HB LEU 152 2HB LEU 152 -6.007 -2.582 -2.582 533 2HB LEU 152 1HB LEU 152 -7.022 -1.340 -1.340 534 HG LEU 152 HG LEU 152 -5.357 -3.243 -3.243 535 1HD1 LEU 152 3HD1 LEU 152 -4.069 -2.672 -2.672 536 2HD1 LEU 152 2HD1 LEU 152 -4.179 -0.902 -0.902 537 3HD1 LEU 152 1HD1 LEU 152 -3.297 -1.992 -1.992 538 1HD2 LEU 152 2HD2 LEU 152 -6.093 -0.294 -0.294 539 2HD2 LEU 152 1HD2 LEU 152 -6.837 -1.755 -1.755 540 3HD2 LEU 152 3HD2 LEU 152 -5.156 -1.285 -1.285 541 H GLN 153 H GLN 153 -9.182 -2.866 -2.866 542 HA GLN 153 HA GLN 153 -10.681 -1.038 -1.038 543 1HB GLN 153 2HB GLN 153 -10.745 -3.544 -3.544 544 2HB GLN 153 1HB GLN 153 -12.062 -3.682 -3.682 545 1HG GLN 153 2HG GLN 153 -13.199 -1.754 -1.754 546 2HG GLN 153 1HG GLN 153 -11.619 -1.677 -1.677 547 1HE2 GLN 153 1HE2 GLN 153 -13.905 -4.300 -4.300 548 2HE2 GLN 153 2HE2 GLN 153 -13.954 -5.154 -5.154 549 H GLU 154 H GLU 154 -10.838 -3.150 -3.150 550 HA GLU 154 HA GLU 154 -13.263 -2.609 -2.609 551 1HB GLU 154 2HB GLU 154 -10.791 -3.040 -3.040 552 2HB GLU 154 1HB GLU 154 -12.411 -3.741 -3.741 553 1HG GLU 154 2HG GLU 154 -11.818 -5.175 -5.175 554 2HG GLU 154 1HG GLU 154 -10.198 -4.346 -4.346 555 H LEU 155 H LEU 155 -10.122 -1.309 -1.309 556 HA LEU 155 HA LEU 155 -11.112 0.674 0.674 557 1HB LEU 155 2HB LEU 155 -9.420 -1.110 -1.110 558 2HB LEU 155 1HB LEU 155 -8.265 -0.365 -0.365 559 HG LEU 155 HG LEU 155 -9.456 1.554 1.554 560 1HD1 LEU 155 2HD1 LEU 155 -9.504 -0.493 -0.493 561 2HD1 LEU 155 1HD1 LEU 155 -7.760 -0.793 -0.793 562 3HD1 LEU 155 3HD1 LEU 155 -8.259 0.669 0.669 563 1HD2 LEU 155 3HD2 LEU 155 -7.474 2.144 2.144 564 2HD2 LEU 155 2HD2 LEU 155 -7.058 2.184 2.184 565 3HD2 LEU 155 1HD2 LEU 155 -6.535 0.790 0.790 566 H ALA 156 H ALA 156 -8.911 0.164 0.164 567 HA ALA 156 HA ALA 156 -8.345 3.111 3.111 568 1HB ALA 156 3HB ALA 156 -6.894 0.837 0.837 569 2HB ALA 156 2HB ALA 156 -6.602 2.608 2.608 570 3HB ALA 156 1HB ALA 156 -6.320 1.774 1.774 571 H VAL 157 H VAL 157 -9.292 4.066 4.066 572 HA VAL 157 HA VAL 157 -8.611 2.082 2.082 573 HB VAL 157 HB VAL 157 -10.383 2.803 2.803 574 1HG1 VAL 157 3HG1 VAL 157 -11.550 2.655 2.655 575 2HG1 VAL 157 2HG1 VAL 157 -12.523 2.542 2.542 576 3HG1 VAL 157 1HG1 VAL 157 -11.233 1.299 1.299 577 1HG2 VAL 157 3HG2 VAL 157 -10.329 5.361 5.361 578 2HG2 VAL 157 2HG2 VAL 157 -10.416 5.111 5.111 579 3HG2 VAL 157 1HG2 VAL 157 -11.891 4.871 4.871 580 H VAL 158 H VAL 158 -8.509 2.446 2.446 581 HA VAL 158 HA VAL 158 -6.260 4.121 4.121 582 HB VAL 158 HB VAL 158 -7.698 2.646 2.646 583 1HG1 VAL 158 3HG1 VAL 158 -5.536 3.798 3.798 584 2HG1 VAL 158 2HG1 VAL 158 -4.714 2.696 2.696 585 3HG1 VAL 158 1HG1 VAL 158 -5.523 2.049 2.049 586 1HG2 VAL 158 3HG2 VAL 158 -6.392 1.327 1.327 587 2HG2 VAL 158 2HG2 VAL 158 -7.982 0.942 0.942 588 3HG2 VAL 158 1HG2 VAL 158 -6.410 0.546 0.546 589 H GLU 159 H GLU 159 -6.048 5.682 5.682 590 HA GLU 159 HA GLU 159 -8.320 7.343 7.343 591 1HB GLU 159 2HB GLU 159 -5.988 8.019 8.019 592 2HB GLU 159 1HB GLU 159 -5.552 7.494 7.494 593 1HG GLU 159 2HG GLU 159 -7.148 9.350 9.350 594 2HG GLU 159 1HG GLU 159 -7.477 9.777 9.777 595 H SER 160 H SER 160 -6.133 5.296 5.296 596 HA SER 160 HA SER 160 -7.933 5.421 5.421 597 1HB SER 160 2HB SER 160 -6.255 7.423 7.423 598 2HB SER 160 1HB SER 160 -5.134 6.130 6.130 599 HG SER 160 HG SER 160 -6.642 5.729 5.729 600 H PHE 161 H PHE 161 -7.200 3.757 3.757 601 HA PHE 161 HA PHE 161 -5.161 2.004 2.004 602 1HB PHE 161 2HB PHE 161 -7.804 1.554 1.554 603 2HB PHE 161 1HB PHE 161 -6.791 0.709 0.709 604 HD1 PHE 161 1HD PHE 161 -7.160 1.452 1.452 605 HD2 PHE 161 2HD PHE 161 -5.606 -1.333 -1.333 606 HE1 PHE 161 1HE PHE 161 -6.274 0.067 0.067 607 HE2 PHE 161 2HE PHE 161 -4.534 -2.473 -2.473 608 HZ PHE 161 HZ PHE 161 -5.231 -1.929 -1.929 609 HA PRO 162 HA PRO 162 -4.253 4.065 4.065 610 1HB PRO 162 2HB PRO 162 -2.990 5.959 5.959 611 2HB PRO 162 1HB PRO 162 -4.555 5.338 5.338 612 1HG PRO 162 2HG PRO 162 -1.808 4.667 4.667 613 2HG PRO 162 1HG PRO 162 -3.389 4.773 4.773 614 1HD PRO 162 2HD PRO 162 -2.069 2.514 2.514 615 2HD PRO 162 1HD PRO 162 -3.393 2.312 2.312 616 H THR 163 H THR 163 -0.942 4.817 4.817 617 HA THR 163 HA THR 163 -2.175 5.881 5.881 618 HB THR 163 HB THR 163 0.656 6.666 6.666 619 HG1 THR 163 1HG THR 163 -1.489 6.397 6.397 620 1HG2 THR 163 3HG2 THR 163 -1.096 8.150 8.150 621 2HG2 THR 163 2HG2 THR 163 -2.169 7.827 7.827 622 3HG2 THR 163 1HG2 THR 163 -0.656 8.804 8.804 623 H LYS 164 H LYS 164 1.246 5.388 5.388 624 HA LYS 164 HA LYS 164 1.155 3.939 3.939 625 1HB LYS 164 2HB LYS 164 2.485 5.541 5.541 626 2HB LYS 164 1HB LYS 164 0.829 6.143 6.143 627 1HG LYS 164 2HG LYS 164 1.877 7.544 7.544 628 2HG LYS 164 1HG LYS 164 3.469 7.094 7.094 629 1HD LYS 164 2HD LYS 164 2.922 9.252 9.252 630 2HD LYS 164 1HD LYS 164 2.672 8.106 8.106 631 1HE LYS 164 2HE LYS 164 0.174 8.180 8.180 632 2HE LYS 164 1HE LYS 164 0.464 9.297 9.297 633 1HZ LYS 164 3HZ LYS 164 1.447 10.862 10.862 634 2HZ LYS 164 2HZ LYS 164 1.160 9.813 9.813 635 3HZ LYS 164 1HZ LYS 164 -0.146 10.471 10.471 636 H ILE 165 H ILE 165 3.404 3.085 3.085 637 HA ILE 165 HA ILE 165 4.780 3.326 3.326 638 HB ILE 165 HB ILE 165 5.699 1.966 1.966 639 1HG1 ILE 165 2HG1 ILE 165 3.657 1.241 1.241 640 2HG1 ILE 165 1HG1 ILE 165 3.412 1.143 1.143 641 1HG2 ILE 165 3HG2 ILE 165 7.371 2.264 2.264 642 2HG2 ILE 165 2HG2 ILE 165 6.230 1.368 1.368 643 3HG2 ILE 165 1HG2 ILE 165 7.007 0.544 0.544 644 1HD1 ILE 165 2HD1 ILE 165 5.329 -0.764 -0.764 645 2HD1 ILE 165 1HD1 ILE 165 3.558 -1.011 -1.011 646 3HD1 ILE 165 3HD1 ILE 165 4.547 -0.949 -0.949 647 H GLU 166 H GLU 166 6.355 4.384 4.384 648 HA GLU 166 HA GLU 166 7.386 6.390 6.390 649 1HB GLU 166 2HB GLU 166 6.694 6.746 6.746 650 2HB GLU 166 1HB GLU 166 7.610 7.952 7.952 651 1HG GLU 166 2HG GLU 166 5.629 8.349 8.349 652 2HG GLU 166 1HG GLU 166 4.725 7.028 7.028 653 H GLY 167 H GLY 167 9.435 5.575 5.575 654 1HA GLY 167 2HA GLY 167 11.523 4.807 4.807 655 2HA GLY 167 1HA GLY 167 11.086 5.033 5.033 656 H ARG 168 H ARG 168 11.629 3.166 3.166 657 HA ARG 168 HA ARG 168 10.680 0.762 0.762 658 1HB ARG 168 2HB ARG 168 12.395 1.007 1.007 659 2HB ARG 168 1HB ARG 168 12.234 -0.453 -0.453 660 1HG ARG 168 2HG ARG 168 13.440 0.826 0.826 661 2HG ARG 168 1HG ARG 168 13.656 2.193 2.193 662 1HD ARG 168 2HD ARG 168 14.921 0.634 0.634 663 2HD ARG 168 1HD ARG 168 14.750 -0.680 -0.680 664 HE ARG 168 HE ARG 168 16.275 0.447 0.447 665 1HH1 ARG 168 1HH2 ARG 168 15.552 2.404 2.404 666 2HH1 ARG 168 2HH2 ARG 168 16.886 3.485 3.485 667 1HH2 ARG 168 1HH1 ARG 168 18.067 1.916 1.916 668 2HH2 ARG 168 2HH1 ARG 168 18.332 3.202 3.202 669 H GLN 169 H GLN 169 8.676 2.372 2.372 670 HA GLN 169 HA GLN 169 7.913 0.793 0.793 671 1HB GLN 169 2HB GLN 169 9.093 3.537 3.537 672 2HB GLN 169 1HB GLN 169 7.905 3.097 3.097 673 1HG GLN 169 2HG GLN 169 9.484 1.560 1.560 674 2HG GLN 169 1HG GLN 169 10.587 1.632 1.632 675 1HE2 GLN 169 1HE2 GLN 169 8.817 4.104 4.104 676 2HE2 GLN 169 2HE2 GLN 169 10.192 5.097 5.097 677 H MET 170 H MET 170 5.779 1.307 1.307 678 HA MET 170 HA MET 170 4.452 3.515 3.515 679 1HB MET 170 2HB MET 170 3.712 1.370 1.370 680 2HB MET 170 1HB MET 170 3.233 0.736 0.736 681 1HG MET 170 2HG MET 170 1.594 2.817 2.817 682 2HG MET 170 1HG MET 170 2.144 2.972 2.972 683 1HE MET 170 3HE MET 170 1.329 1.199 1.199 684 2HE MET 170 2HE MET 170 2.171 -0.130 -0.130 685 3HE MET 170 1HE MET 170 0.477 -0.345 -0.345 686 H ILE 171 H ILE 171 3.705 4.987 4.987 687 HA ILE 171 HA ILE 171 3.134 4.020 4.020 688 HB ILE 171 HB ILE 171 2.542 6.693 6.693 689 1HG1 ILE 171 2HG1 ILE 171 4.998 5.841 5.841 690 2HG1 ILE 171 1HG1 ILE 171 4.516 7.507 7.507 691 1HG2 ILE 171 3HG2 ILE 171 2.121 5.541 5.541 692 2HG2 ILE 171 2HG2 ILE 171 2.306 7.343 7.343 693 3HG2 ILE 171 1HG2 ILE 171 0.916 6.515 6.515 694 1HD1 ILE 171 1HD1 ILE 171 4.400 4.921 4.921 695 2HD1 ILE 171 3HD1 ILE 171 5.743 6.127 6.127 696 3HD1 ILE 171 2HD1 ILE 171 4.058 6.533 6.533 697 H MET 172 H MET 172 1.256 3.244 3.244 698 HA MET 172 HA MET 172 -1.308 4.211 4.211 699 1HB MET 172 2HB MET 172 -1.397 1.810 1.810 700 2HB MET 172 1HB MET 172 -0.430 1.657 1.657 701 1HG MET 172 2HG MET 172 -2.257 2.161 2.161 702 2HG MET 172 1HG MET 172 -3.166 3.030 3.030 703 1HE MET 172 3HE MET 172 -3.197 0.546 0.546 704 2HE MET 172 2HE MET 172 -4.094 -0.804 -0.804 705 3HE MET 172 1HE MET 172 -2.262 -0.771 -0.771 706 H VAL 173 H VAL 173 -2.625 5.314 5.314 707 HA VAL 173 HA VAL 173 -0.989 6.100 6.100 708 HB VAL 173 HB VAL 173 -3.502 7.425 7.425 709 1HG1 VAL 173 3HG1 VAL 173 -1.359 7.780 7.780 710 2HG1 VAL 173 2HG1 VAL 173 -1.906 9.310 9.310 711 3HG1 VAL 173 1HG1 VAL 173 -3.090 8.284 8.284 712 1HG2 VAL 173 1HG2 VAL 173 -0.573 7.826 7.826 713 2HG2 VAL 173 3HG2 VAL 173 -2.011 7.435 7.435 714 3HG2 VAL 173 2HG2 VAL 173 -1.878 9.046 9.046 715 H LEU 174 H LEU 174 -1.936 5.749 5.749 716 HA LEU 174 HA LEU 174 -4.587 4.595 4.595 717 1HB LEU 174 2HB LEU 174 -2.744 3.041 3.041 718 2HB LEU 174 1HB LEU 174 -2.066 3.799 3.799 719 HG LEU 174 HG LEU 174 -4.100 3.313 3.313 720 1HD1 LEU 174 3HD1 LEU 174 -5.316 2.588 2.588 721 2HD1 LEU 174 2HD1 LEU 174 -5.820 1.673 1.673 722 3HD1 LEU 174 1HD1 LEU 174 -5.880 3.490 3.490 723 1HD2 LEU 174 1HD2 LEU 174 -2.345 1.659 1.659 724 2HD2 LEU 174 3HD2 LEU 174 -4.056 1.076 1.076 725 3HD2 LEU 174 2HD2 LEU 174 -3.350 0.743 0.743 726 H ALA 175 H ALA 175 -5.930 6.325 6.325 727 HA ALA 175 HA ALA 175 -4.982 7.588 7.588 728 1HB ALA 175 1HB ALA 175 -6.120 8.858 8.858 729 2HB ALA 175 3HB ALA 175 -7.576 7.771 7.771 730 3HB ALA 175 2HB ALA 175 -7.109 9.071 9.071 731 HA PRO 176 HA PRO 176 -7.948 5.689 5.689 732 1HB PRO 176 2HB PRO 176 -8.745 8.393 8.393 733 2HB PRO 176 1HB PRO 176 -8.142 6.955 6.955 734 1HG PRO 176 2HG PRO 176 -6.524 9.149 9.149 735 2HG PRO 176 1HG PRO 176 -5.863 7.464 7.464 736 1HD PRO 176 2HD PRO 176 -6.695 9.315 9.315 737 2HD PRO 176 1HD PRO 176 -5.242 8.222 8.222 738 H LYS 177 H LYS 177 -10.107 5.067 5.067 739 HA LYS 177 HA LYS 177 -11.295 6.730 6.730 740 1HB LYS 177 2HB LYS 177 -12.962 5.038 5.038 741 2HB LYS 177 1HB LYS 177 -11.384 4.255 4.255 742 1HG LYS 177 2HG LYS 177 -12.086 3.876 3.876 743 2HG LYS 177 1HG LYS 177 -13.674 4.660 4.660 744 1HD LYS 177 2HD LYS 177 -14.282 3.023 3.023 745 2HD LYS 177 1HD LYS 177 -12.713 2.162 2.162 746 1HE LYS 177 2HE LYS 177 -13.232 1.613 1.613 747 2HE LYS 177 1HE LYS 177 -14.739 2.635 2.635 748 1HZ LYS 177 3HZ LYS 177 -14.248 0.239 0.239 749 2HZ LYS 177 2HZ LYS 177 -15.239 0.319 0.319 750 3HZ LYS 177 1HZ LYS 177 -15.644 1.207 1.207 751 H LYS 178 H LYS 178 -13.537 7.350 7.350 752 HA LYS 178 HA LYS 178 -14.566 8.509 8.509 753 1HB LYS 178 2HB LYS 178 -15.471 8.481 8.481 754 2HB LYS 178 1HB LYS 178 -16.492 9.162 9.162 755 1HG LYS 178 2HG LYS 178 -14.701 10.796 10.796 756 2HG LYS 178 1HG LYS 178 -13.676 10.167 10.167 757 1HD LYS 178 2HD LYS 178 -16.473 11.424 11.424 758 2HD LYS 178 1HD LYS 178 -14.914 12.312 12.312 759 1HE LYS 178 2HE LYS 178 -14.225 10.808 10.808 760 2HE LYS 178 1HE LYS 178 -15.819 9.952 9.952 761 1HZ LYS 178 2HZ LYS 178 -15.423 12.850 12.850 762 2HZ LYS 178 1HZ LYS 178 -15.810 11.658 11.658 763 3HZ LYS 178 3HZ LYS 178 -16.913 12.039 12.039 764 H LYS 179 H LYS 179 -15.865 7.269 7.269 765 HA LYS 179 HA LYS 179 -16.596 4.680 4.680 766 1HB LYS 179 2HB LYS 179 -16.208 5.353 5.353 767 2HB LYS 179 1HB LYS 179 -17.647 6.415 6.415 768 1HG LYS 179 2HG LYS 179 -18.186 4.361 4.361 769 2HG LYS 179 1HG LYS 179 -19.132 4.431 4.431 770 1HD LYS 179 2HD LYS 179 -18.410 2.166 2.166 771 2HD LYS 179 1HD LYS 179 -17.475 2.802 2.802 772 1HE LYS 179 2HE LYS 179 -15.470 3.113 3.113 773 2HE LYS 179 1HE LYS 179 -16.449 2.553 2.553 774 1HZ LYS 179 3HZ LYS 179 -16.770 0.455 0.455 775 2HZ LYS 179 2HZ LYS 179 -15.833 0.979 0.979 776 3HZ LYS 179 1HZ LYS 179 -15.121 0.801 0.801 777 H GLN 180 H GLN 180 -18.336 3.981 3.981 778 HA GLN 180 HA GLN 180 -20.064 5.852 5.852 779 1HB GLN 180 2HB GLN 180 -20.365 2.808 2.808 780 2HB GLN 180 1HB GLN 180 -21.320 3.852 3.852 781 1HG GLN 180 2HG GLN 180 -19.203 4.478 4.478 782 2HG GLN 180 1HG GLN 180 -18.262 3.384 3.384 783 1HE2 GLN 180 1HE2 GLN 180 -19.149 1.072 1.072 784 2HE2 GLN 180 2HE2 GLN 180 -19.705 0.309 0.309 Start of MODEL 10 1 HA VAL 90 HA VAL 90 -2.249 17.198 17.198 2 HB VAL 90 HB VAL 90 -3.882 17.440 17.440 3 1HG1 VAL 90 1HG1 VAL 90 -4.698 18.873 18.873 4 2HG1 VAL 90 3HG1 VAL 90 -5.715 17.464 17.464 5 3HG1 VAL 90 2HG1 VAL 90 -6.045 18.263 18.263 6 1HG2 VAL 90 1HG2 VAL 90 -5.489 15.168 15.168 7 2HG2 VAL 90 3HG2 VAL 90 -4.498 15.031 15.031 8 3HG2 VAL 90 2HG2 VAL 90 -5.969 16.041 16.041 9 H ILE 91 H ILE 91 -3.513 15.491 15.491 10 HA ILE 91 HA ILE 91 -2.904 12.787 12.787 11 HB ILE 91 HB ILE 91 -3.951 13.819 13.819 12 1HG1 ILE 91 2HG1 ILE 91 -5.609 14.146 14.146 13 2HG1 ILE 91 1HG1 ILE 91 -6.091 12.736 12.736 14 1HG2 ILE 91 1HG2 ILE 91 -3.489 10.952 10.952 15 2HG2 ILE 91 3HG2 ILE 91 -4.524 11.356 11.356 16 3HG2 ILE 91 2HG2 ILE 91 -2.769 11.708 11.708 17 1HD1 ILE 91 2HD1 ILE 91 -5.095 11.199 11.199 18 2HD1 ILE 91 1HD1 ILE 91 -4.787 12.653 12.653 19 3HD1 ILE 91 3HD1 ILE 91 -6.477 12.204 12.204 20 H GLN 92 H GLN 92 -1.108 11.805 11.805 21 HA GLN 92 HA GLN 92 1.066 13.332 13.332 22 1HB GLN 92 2HB GLN 92 1.067 10.911 10.911 23 2HB GLN 92 1HB GLN 92 2.450 12.018 12.018 24 1HG GLN 92 2HG GLN 92 1.343 13.834 13.834 25 2HG GLN 92 1HG GLN 92 -0.239 13.007 13.007 26 1HE2 GLN 92 1HE2 GLN 92 -0.914 12.211 12.211 27 2HE2 GLN 92 2HE2 GLN 92 0.038 11.525 11.525 28 H VAL 93 H VAL 93 2.874 11.920 11.920 29 HA VAL 93 HA VAL 93 1.592 9.692 9.692 30 HB VAL 93 HB VAL 93 4.215 11.113 11.113 31 1HG1 VAL 93 1HG1 VAL 93 2.705 8.646 8.646 32 2HG1 VAL 93 3HG1 VAL 93 3.967 9.489 9.489 33 3HG1 VAL 93 2HG1 VAL 93 4.467 8.652 8.652 34 1HG2 VAL 93 1HG2 VAL 93 1.844 12.075 12.075 35 2HG2 VAL 93 3HG2 VAL 93 3.036 11.676 11.676 36 3HG2 VAL 93 2HG2 VAL 93 1.762 10.476 10.476 37 H LYS 94 H LYS 94 1.796 7.690 7.690 38 HA LYS 94 HA LYS 94 4.656 7.248 7.248 39 1HB LYS 94 2HB LYS 94 2.528 5.159 5.159 40 2HB LYS 94 1HB LYS 94 4.087 5.162 5.162 41 1HG LYS 94 2HG LYS 94 1.789 7.128 7.128 42 2HG LYS 94 1HG LYS 94 2.008 5.604 5.604 43 1HD LYS 94 2HD LYS 94 4.135 7.827 7.827 44 2HD LYS 94 1HD LYS 94 2.872 7.651 7.651 45 1HE LYS 94 2HE LYS 94 3.728 5.355 5.355 46 2HE LYS 94 1HE LYS 94 5.069 5.572 5.572 47 1HZ LYS 94 2HZ LYS 94 4.522 7.295 7.295 48 2HZ LYS 94 1HZ LYS 94 5.744 6.123 6.123 49 3HZ LYS 94 3HZ LYS 94 5.777 7.506 7.506 50 H GLU 95 H GLU 95 5.422 5.056 5.056 51 HA GLU 95 HA GLU 95 4.189 4.803 4.803 52 1HB GLU 95 2HB GLU 95 6.299 6.272 6.272 53 2HB GLU 95 1HB GLU 95 7.094 4.729 4.729 54 1HG GLU 95 2HG GLU 95 6.526 3.726 3.726 55 2HG GLU 95 1HG GLU 95 5.729 5.283 5.283 56 H ILE 96 H ILE 96 4.528 2.611 2.611 57 HA ILE 96 HA ILE 96 6.190 0.900 0.900 58 HB ILE 96 HB ILE 96 3.523 0.635 0.635 59 1HG1 ILE 96 2HG1 ILE 96 3.870 -1.883 -1.883 60 2HG1 ILE 96 1HG1 ILE 96 5.543 -1.679 -1.679 61 1HG2 ILE 96 1HG2 ILE 96 3.066 0.444 0.444 62 2HG2 ILE 96 3HG2 ILE 96 3.891 -1.188 -1.188 63 3HG2 ILE 96 2HG2 ILE 96 2.482 -0.941 -0.941 64 1HD1 ILE 96 2HD1 ILE 96 4.297 -0.314 -0.314 65 2HD1 ILE 96 1HD1 ILE 96 5.466 -1.681 -1.681 66 3HD1 ILE 96 3HD1 ILE 96 5.992 -0.058 -0.058 67 H LYS 97 H LYS 97 7.017 -0.965 -0.965 68 HA LYS 97 HA LYS 97 6.379 -0.364 -0.364 69 1HB LYS 97 2HB LYS 97 8.989 -1.645 -1.645 70 2HB LYS 97 1HB LYS 97 8.352 -1.359 -1.359 71 1HG LYS 97 2HG LYS 97 8.298 1.125 1.125 72 2HG LYS 97 1HG LYS 97 9.155 0.800 0.800 73 1HD LYS 97 2HD LYS 97 11.150 0.779 0.779 74 2HD LYS 97 1HD LYS 97 10.575 -0.581 -0.581 75 1HE LYS 97 2HE LYS 97 11.305 1.325 1.325 76 2HE LYS 97 1HE LYS 97 9.515 1.087 1.087 77 1HZ LYS 97 2HZ LYS 97 9.211 2.860 2.860 78 2HZ LYS 97 1HZ LYS 97 10.890 3.094 3.094 79 3HZ LYS 97 3HZ LYS 97 10.083 3.383 3.383 80 H PHE 98 H PHE 98 6.282 -2.204 -2.204 81 HA PHE 98 HA PHE 98 5.982 -4.766 -4.766 82 1HB PHE 98 2HB PHE 98 3.822 -3.213 -3.213 83 2HB PHE 98 1HB PHE 98 3.764 -4.941 -4.941 84 HD1 PHE 98 1HD PHE 98 4.507 -5.579 -5.579 85 HD2 PHE 98 2HD PHE 98 2.015 -3.064 -3.064 86 HE1 PHE 98 1HE PHE 98 3.231 -5.210 -5.210 87 HE2 PHE 98 2HE PHE 98 0.649 -2.588 -2.588 88 HZ PHE 98 HZ PHE 98 1.157 -3.900 -3.900 89 H ARG 99 H ARG 99 6.712 -6.374 -6.374 90 HA ARG 99 HA ARG 99 8.143 -5.256 -5.256 91 1HB ARG 99 2HB ARG 99 8.463 -7.742 -7.742 92 2HB ARG 99 1HB ARG 99 9.478 -7.325 -7.325 93 1HG ARG 99 2HG ARG 99 9.287 -5.610 -5.610 94 2HG ARG 99 1HG ARG 99 10.599 -6.779 -6.779 95 1HD ARG 99 2HD ARG 99 11.246 -5.476 -5.476 96 2HD ARG 99 1HD ARG 99 9.931 -4.265 -4.265 97 HE ARG 99 HE ARG 99 11.299 -4.323 -4.323 98 1HH1 ARG 99 1HH1 ARG 99 12.264 -3.915 -3.915 99 2HH1 ARG 99 2HH1 ARG 99 13.577 -2.844 -2.844 100 1HH2 ARG 99 1HH2 ARG 99 13.090 -2.864 -2.864 101 2HH2 ARG 99 2HH2 ARG 99 14.050 -2.240 -2.240 102 HA PRO 100 HA PRO 100 6.024 -7.893 -7.893 103 1HB PRO 100 2HB PRO 100 8.682 -9.337 -9.337 104 2HB PRO 100 1HB PRO 100 7.566 -8.675 -8.675 105 1HG PRO 100 2HG PRO 100 9.940 -7.458 -7.458 106 2HG PRO 100 1HG PRO 100 8.608 -6.558 -6.558 107 1HD PRO 100 2HD PRO 100 9.418 -6.342 -6.342 108 2HD PRO 100 1HD PRO 100 8.022 -5.522 -5.522 109 H GLY 101 H GLY 101 4.927 -9.678 -9.678 110 1HA GLY 101 2HA GLY 101 3.861 -11.168 -11.168 111 2HA GLY 101 1HA GLY 101 5.105 -12.194 -12.194 112 H THR 102 H THR 102 3.659 -10.993 -10.993 113 HA THR 102 HA THR 102 5.817 -11.565 -11.565 114 HB THR 102 HB THR 102 3.368 -10.180 -10.180 115 HG1 THR 102 1HG THR 102 5.111 -9.077 -9.077 116 1HG2 THR 102 3HG2 THR 102 6.410 -9.527 -9.527 117 2HG2 THR 102 2HG2 THR 102 5.134 -8.681 -8.681 118 3HG2 THR 102 1HG2 THR 102 5.543 -10.396 -10.396 119 H ASP 103 H ASP 103 4.013 -11.594 -11.594 120 HA ASP 103 HA ASP 103 3.939 -14.530 -14.530 121 1HB ASP 103 2HB ASP 103 5.613 -12.547 -12.547 122 2HB ASP 103 1HB ASP 103 4.660 -12.825 -12.825 123 H GLU 104 H GLU 104 3.217 -15.295 -15.295 124 HA GLU 104 HA GLU 104 0.702 -14.088 -14.088 125 1HB GLU 104 2HB GLU 104 2.215 -16.350 -16.350 126 2HB GLU 104 1HB GLU 104 0.580 -15.767 -15.767 127 1HG GLU 104 2HG GLU 104 -0.312 -16.426 -16.426 128 2HG GLU 104 1HG GLU 104 1.336 -16.990 -16.990 129 H GLY 105 H GLY 105 3.383 -15.002 -15.002 130 1HA GLY 105 2HA GLY 105 2.920 -12.386 -12.386 131 2HA GLY 105 1HA GLY 105 3.502 -13.875 -13.875 132 H ASP 106 H ASP 106 4.444 -12.478 -12.478 133 HA ASP 106 HA ASP 106 6.555 -11.062 -11.062 134 1HB ASP 106 2HB ASP 106 7.195 -12.310 -12.310 135 2HB ASP 106 1HB ASP 106 6.261 -11.092 -11.092 136 H TYR 107 H TYR 107 3.739 -11.103 -11.103 137 HA TYR 107 HA TYR 107 4.031 -8.255 -8.255 138 1HB TYR 107 2HB TYR 107 3.328 -10.145 -10.145 139 2HB TYR 107 1HB TYR 107 1.857 -10.290 -10.290 140 HD1 TYR 107 1HD TYR 107 2.047 -6.871 -6.871 141 HD2 TYR 107 2HD TYR 107 1.397 -10.528 -10.528 142 HE1 TYR 107 1HE TYR 107 -0.107 -6.013 -6.013 143 HE2 TYR 107 2HE TYR 107 -0.486 -9.486 -9.486 144 HH TYR 107 HH TYR 107 -1.722 -6.331 -6.331 145 H GLN 108 H GLN 108 1.095 -10.174 -10.174 146 HA GLN 108 HA GLN 108 -0.002 -8.134 -8.134 147 1HB GLN 108 2HB GLN 108 -0.896 -10.649 -10.649 148 2HB GLN 108 1HB GLN 108 -1.747 -9.319 -9.319 149 1HG GLN 108 2HG GLN 108 -0.114 -11.244 -11.244 150 2HG GLN 108 1HG GLN 108 -1.571 -11.756 -11.756 151 1HE2 GLN 108 1HE2 GLN 108 -0.450 -8.549 -8.549 152 2HE2 GLN 108 2HE2 GLN 108 -1.768 -8.347 -8.347 153 H VAL 109 H VAL 109 2.544 -9.648 -9.648 154 HA VAL 109 HA VAL 109 2.108 -8.876 -8.876 155 HB VAL 109 HB VAL 109 4.680 -9.112 -9.112 156 1HG1 VAL 109 1HG1 VAL 109 4.286 -8.499 -8.499 157 2HG1 VAL 109 3HG1 VAL 109 5.811 -9.139 -9.139 158 3HG1 VAL 109 2HG1 VAL 109 5.231 -7.524 -7.524 159 1HG2 VAL 109 3HG2 VAL 109 3.311 -11.209 -11.209 160 2HG2 VAL 109 2HG2 VAL 109 4.946 -11.210 -11.210 161 3HG2 VAL 109 1HG2 VAL 109 3.481 -10.866 -10.866 162 H LYS 110 H LYS 110 3.453 -7.212 -7.212 163 HA LYS 110 HA LYS 110 3.501 -4.717 -4.717 164 1HB LYS 110 2HB LYS 110 4.459 -5.586 -5.586 165 2HB LYS 110 1HB LYS 110 4.485 -3.900 -3.900 166 1HG LYS 110 2HG LYS 110 6.057 -6.292 -6.292 167 2HG LYS 110 1HG LYS 110 6.576 -4.602 -4.602 168 1HD LYS 110 2HD LYS 110 5.693 -3.681 -3.681 169 2HD LYS 110 1HD LYS 110 5.236 -5.325 -5.325 170 1HE LYS 110 2HE LYS 110 8.121 -4.392 -4.392 171 2HE LYS 110 1HE LYS 110 7.407 -4.575 -4.575 172 1HZ LYS 110 3HZ LYS 110 7.721 -6.740 -6.740 173 2HZ LYS 110 2HZ LYS 110 8.711 -6.474 -6.474 174 3HZ LYS 110 1HZ LYS 110 7.082 -6.902 -6.902 175 H LEU 111 H LEU 111 1.183 -6.359 -6.359 176 HA LEU 111 HA LEU 111 -0.175 -3.954 -3.954 177 1HB LEU 111 2HB LEU 111 -0.479 -6.267 -6.267 178 2HB LEU 111 1HB LEU 111 -1.392 -6.723 -6.723 179 HG LEU 111 HG LEU 111 -2.131 -4.279 -4.279 180 1HD1 LEU 111 1HD1 LEU 111 -1.832 -6.231 -6.231 181 2HD1 LEU 111 3HD1 LEU 111 -2.984 -7.191 -7.191 182 3HD1 LEU 111 2HD1 LEU 111 -3.563 -5.727 -5.727 183 1HD2 LEU 111 2HD2 LEU 111 -3.670 -6.257 -6.257 184 2HD2 LEU 111 1HD2 LEU 111 -3.452 -4.484 -4.484 185 3HD2 LEU 111 3HD2 LEU 111 -4.503 -5.090 -5.090 186 H ARG 112 H ARG 112 0.407 -6.179 -6.179 187 HA ARG 112 HA ARG 112 -1.410 -4.999 -4.999 188 1HB ARG 112 2HB ARG 112 -0.050 -7.142 -7.142 189 2HB ARG 112 1HB ARG 112 1.168 -6.024 -6.024 190 1HG ARG 112 2HG ARG 112 -0.576 -5.119 -5.119 191 2HG ARG 112 1HG ARG 112 -1.783 -6.246 -6.246 192 1HD ARG 112 2HD ARG 112 -0.424 -8.208 -8.208 193 2HD ARG 112 1HD ARG 112 0.805 -7.060 -7.060 194 HE ARG 112 HE ARG 112 -1.825 -6.373 -6.373 195 1HH1 ARG 112 1HH2 ARG 112 0.696 -8.883 -8.883 196 2HH1 ARG 112 2HH2 ARG 112 0.314 -9.332 -9.332 197 1HH2 ARG 112 1HH1 ARG 112 -2.342 -6.987 -6.987 198 2HH2 ARG 112 2HH1 ARG 112 -1.441 -8.239 -8.239 199 H SER 113 H SER 113 2.139 -4.083 -4.083 200 HA SER 113 HA SER 113 2.142 -2.057 -2.057 201 1HB SER 113 2HB SER 113 3.652 -2.222 -2.222 202 2HB SER 113 1HB SER 113 3.813 -0.920 -0.920 203 HG SER 113 HG SER 113 4.074 -3.702 -3.702 204 H LEU 114 H LEU 114 0.862 -2.031 -2.031 205 HA LEU 114 HA LEU 114 0.265 0.736 0.736 206 1HB LEU 114 2HB LEU 114 -1.083 -1.791 -1.791 207 2HB LEU 114 1HB LEU 114 -1.566 -0.124 -0.124 208 HG LEU 114 HG LEU 114 1.263 -1.272 -1.272 209 1HD1 LEU 114 1HD1 LEU 114 -0.508 -2.434 -2.434 210 2HD1 LEU 114 3HD1 LEU 114 -1.100 -0.847 -0.847 211 3HD1 LEU 114 2HD1 LEU 114 0.540 -1.436 -1.436 212 1HD2 LEU 114 3HD2 LEU 114 -0.188 1.325 1.325 213 2HD2 LEU 114 2HD2 LEU 114 1.250 1.138 1.138 214 3HD2 LEU 114 1HD2 LEU 114 1.401 0.898 0.898 215 H ILE 115 H ILE 115 -1.695 -2.026 -2.026 216 HA ILE 115 HA ILE 115 -4.021 -0.566 -0.566 217 HB ILE 115 HB ILE 115 -3.200 -2.108 -2.108 218 1HG1 ILE 115 2HG1 ILE 115 -2.700 -3.689 -3.689 219 2HG1 ILE 115 1HG1 ILE 115 -4.154 -4.171 -4.171 220 1HG2 ILE 115 2HG2 ILE 115 -5.722 -1.319 -1.319 221 2HG2 ILE 115 1HG2 ILE 115 -5.757 -2.467 -2.467 222 3HG2 ILE 115 3HG2 ILE 115 -5.194 -0.780 -0.780 223 1HD1 ILE 115 3HD1 ILE 115 -5.561 -3.286 -3.286 224 2HD1 ILE 115 2HD1 ILE 115 -3.975 -2.989 -2.989 225 3HD1 ILE 115 1HD1 ILE 115 -4.485 -4.674 -4.674 226 H ARG 116 H ARG 116 -1.311 -0.856 -0.856 227 HA ARG 116 HA ARG 116 -2.060 0.719 0.719 228 1HB ARG 116 2HB ARG 116 0.013 -0.760 -0.760 229 2HB ARG 116 1HB ARG 116 0.842 0.629 0.629 230 1HG ARG 116 2HG ARG 116 -0.547 0.891 0.891 231 2HG ARG 116 1HG ARG 116 1.053 0.091 0.091 232 1HD ARG 116 2HD ARG 116 0.543 3.013 3.013 233 2HD ARG 116 1HD ARG 116 1.295 2.467 2.467 234 HE ARG 116 HE ARG 116 2.744 1.188 1.188 235 1HH1 ARG 116 1HH2 ARG 116 1.972 4.496 4.496 236 2HH1 ARG 116 2HH2 ARG 116 3.497 5.165 5.165 237 1HH2 ARG 116 1HH1 ARG 116 4.814 2.115 2.115 238 2HH2 ARG 116 2HH1 ARG 116 5.129 3.798 3.798 239 H PHE 117 H PHE 117 -0.375 1.736 1.736 240 HA PHE 117 HA PHE 117 0.011 4.316 4.316 241 1HB PHE 117 2HB PHE 117 -0.602 2.980 2.980 242 2HB PHE 117 1HB PHE 117 0.157 4.587 4.587 243 HD1 PHE 117 2HD PHE 117 1.641 2.739 2.739 244 HD2 PHE 117 1HD PHE 117 1.227 3.009 3.009 245 HE1 PHE 117 2HE PHE 117 3.920 1.856 1.856 246 HE2 PHE 117 1HE PHE 117 3.525 2.018 2.018 247 HZ PHE 117 HZ PHE 117 4.879 1.481 1.481 248 H LEU 118 H LEU 118 -2.728 2.946 2.946 249 HA LEU 118 HA LEU 118 -4.145 5.372 5.372 250 1HB LEU 118 2HB LEU 118 -4.609 2.502 2.502 251 2HB LEU 118 1HB LEU 118 -5.966 3.700 3.700 252 HG LEU 118 HG LEU 118 -3.389 4.795 4.795 253 1HD1 LEU 118 2HD1 LEU 118 -3.302 2.312 2.312 254 2HD1 LEU 118 1HD1 LEU 118 -4.532 2.802 2.802 255 3HD1 LEU 118 3HD1 LEU 118 -2.923 3.652 3.652 256 1HD2 LEU 118 3HD2 LEU 118 -5.713 5.709 5.709 257 2HD2 LEU 118 2HD2 LEU 118 -4.811 5.629 5.629 258 3HD2 LEU 118 1HD2 LEU 118 -6.112 4.415 4.415 259 H GLU 119 H GLU 119 -4.318 2.904 2.904 260 HA GLU 119 HA GLU 119 -6.702 4.010 4.010 261 1HB GLU 119 2HB GLU 119 -6.844 2.241 2.241 262 2HB GLU 119 1HB GLU 119 -5.994 1.594 1.594 263 1HG GLU 119 2HG GLU 119 -3.823 1.782 1.782 264 2HG GLU 119 1HG GLU 119 -4.672 2.270 2.270 265 H GLU 120 H GLU 120 -3.294 4.724 4.724 266 HA GLU 120 HA GLU 120 -3.710 6.261 6.261 267 1HB GLU 120 2HB GLU 120 -1.676 6.820 6.820 268 2HB GLU 120 1HB GLU 120 -1.748 7.628 7.628 269 1HG GLU 120 2HG GLU 120 -1.403 5.136 5.136 270 2HG GLU 120 1HG GLU 120 -0.658 4.899 4.899 271 H GLY 121 H GLY 121 -4.321 6.525 6.525 272 1HA GLY 121 2HA GLY 121 -5.601 7.996 7.996 273 2HA GLY 121 1HA GLY 121 -5.411 9.159 9.159 274 H ASP 122 H ASP 122 -3.433 7.277 7.277 275 HA ASP 122 HA ASP 122 -2.095 9.760 9.760 276 1HB ASP 122 2HB ASP 122 -0.747 7.009 7.009 277 2HB ASP 122 1HB ASP 122 -0.006 8.599 8.599 278 H LYS 123 H LYS 123 -1.196 9.156 9.156 279 HA LYS 123 HA LYS 123 -3.146 7.430 7.430 280 1HB LYS 123 2HB LYS 123 -3.269 9.825 9.825 281 2HB LYS 123 1HB LYS 123 -1.474 9.868 9.868 282 1HG LYS 123 2HG LYS 123 -2.427 7.773 7.773 283 2HG LYS 123 1HG LYS 123 -3.215 9.339 9.339 284 1HD LYS 123 2HD LYS 123 -0.190 8.762 8.762 285 2HD LYS 123 1HD LYS 123 -1.234 9.229 9.229 286 1HE LYS 123 2HE LYS 123 -1.823 11.336 11.336 287 2HE LYS 123 1HE LYS 123 -0.254 10.869 10.869 288 1HZ LYS 123 2HZ LYS 123 0.845 10.980 10.980 289 2HZ LYS 123 1HZ LYS 123 -0.603 11.390 11.390 290 3HZ LYS 123 3HZ LYS 123 0.089 12.464 12.464 291 H ALA 124 H ALA 124 -2.066 5.517 5.517 292 HA ALA 124 HA ALA 124 0.842 5.766 5.766 293 1HB ALA 124 2HB ALA 124 -0.403 3.637 3.637 294 2HB ALA 124 1HB ALA 124 -0.691 3.379 3.379 295 3HB ALA 124 3HB ALA 124 0.996 3.432 3.432 296 H LYS 125 H LYS 125 2.195 5.441 5.441 297 HA LYS 125 HA LYS 125 0.460 5.219 5.219 298 1HB LYS 125 2HB LYS 125 1.350 7.527 7.527 299 2HB LYS 125 1HB LYS 125 3.009 6.885 6.885 300 1HG LYS 125 2HG LYS 125 3.317 6.440 6.440 301 2HG LYS 125 1HG LYS 125 1.541 6.338 6.338 302 1HD LYS 125 2HD LYS 125 2.566 8.399 8.399 303 2HD LYS 125 1HD LYS 125 1.241 8.732 8.732 304 1HE LYS 125 2HE LYS 125 2.855 9.390 9.390 305 2HE LYS 125 1HE LYS 125 4.250 8.932 8.932 306 1HZ LYS 125 1HZ LYS 125 3.490 10.604 10.604 307 2HZ LYS 125 3HZ LYS 125 2.213 11.034 11.034 308 3HZ LYS 125 2HZ LYS 125 3.820 11.276 11.276 309 H ILE 126 H ILE 126 0.779 3.287 3.287 310 HA ILE 126 HA ILE 126 3.006 1.679 1.679 311 HB ILE 126 HB ILE 126 1.070 1.292 1.292 312 1HG1 ILE 126 2HG1 ILE 126 -0.445 1.925 1.925 313 2HG1 ILE 126 1HG1 ILE 126 -0.493 0.140 0.140 314 1HG2 ILE 126 1HG2 ILE 126 2.643 -0.480 -0.480 315 2HG2 ILE 126 3HG2 ILE 126 1.371 -1.114 -1.114 316 3HG2 ILE 126 2HG2 ILE 126 2.884 -0.385 -0.385 317 1HD1 ILE 126 1HD1 ILE 126 0.982 -0.009 -0.009 318 2HD1 ILE 126 3HD1 ILE 126 0.734 1.767 1.767 319 3HD1 ILE 126 2HD1 ILE 126 -0.688 0.637 0.637 320 H THR 127 H THR 127 4.844 1.347 1.347 321 HA THR 127 HA THR 127 4.655 2.451 2.451 322 HB THR 127 HB THR 127 6.988 2.571 2.571 323 HG1 THR 127 1HG THR 127 5.431 4.537 4.537 324 1HG2 THR 127 1HG2 THR 127 6.753 3.248 3.248 325 2HG2 THR 127 3HG2 THR 127 8.049 3.910 3.910 326 3HG2 THR 127 2HG2 THR 127 7.951 2.144 2.144 327 H LEU 128 H LEU 128 4.975 0.913 0.913 328 HA LEU 128 HA LEU 128 5.906 -1.729 -1.729 329 1HB LEU 128 2HB LEU 128 4.722 -0.281 -0.281 330 2HB LEU 128 1HB LEU 128 6.213 -1.062 -1.062 331 HG LEU 128 HG LEU 128 4.347 -2.497 -2.497 332 1HD1 LEU 128 2HD1 LEU 128 6.287 -3.770 -3.770 333 2HD1 LEU 128 1HD1 LEU 128 5.418 -3.769 -3.769 334 3HD1 LEU 128 3HD1 LEU 128 4.684 -4.578 -4.578 335 1HD2 LEU 128 3HD2 LEU 128 3.388 -1.798 -1.798 336 2HD2 LEU 128 2HD2 LEU 128 2.711 -1.379 -1.379 337 3HD2 LEU 128 1HD2 LEU 128 2.652 -3.089 -3.089 338 H ARG 129 H ARG 129 7.999 -2.475 -2.475 339 HA ARG 129 HA ARG 129 9.492 -0.458 -0.458 340 1HB ARG 129 2HB ARG 129 10.100 -0.100 -0.100 341 2HB ARG 129 1HB ARG 129 10.500 -1.838 -1.838 342 1HG ARG 129 2HG ARG 129 12.404 -1.555 -1.555 343 2HG ARG 129 1HG ARG 129 11.622 -0.123 -0.123 344 1HD ARG 129 2HD ARG 129 12.122 1.242 1.242 345 2HD ARG 129 1HD ARG 129 13.093 -0.138 -0.138 346 HE ARG 129 HE ARG 129 13.696 1.566 1.566 347 1HH1 ARG 129 1HH2 ARG 129 14.555 -1.283 -1.283 348 2HH1 ARG 129 2HH2 ARG 129 16.134 -1.454 -1.454 349 1HH2 ARG 129 1HH1 ARG 129 15.822 1.315 1.315 350 2HH2 ARG 129 2HH1 ARG 129 16.863 0.039 0.039 351 H PHE 130 H PHE 130 9.266 -1.539 -1.539 352 HA PHE 130 HA PHE 130 8.739 -4.290 -4.290 353 1HB PHE 130 2HB PHE 130 9.638 -2.029 -2.029 354 2HB PHE 130 1HB PHE 130 9.117 -3.723 -3.723 355 HD1 PHE 130 2HD PHE 130 6.996 -4.617 -4.617 356 HD2 PHE 130 1HD PHE 130 8.053 -0.499 -0.499 357 HE1 PHE 130 2HE PHE 130 4.645 -3.958 -3.958 358 HE2 PHE 130 1HE PHE 130 5.683 0.112 0.112 359 HZ PHE 130 HZ PHE 130 3.972 -1.649 -1.649 360 H ARG 131 H ARG 131 10.164 -5.911 -5.911 361 HA ARG 131 HA ARG 131 12.988 -5.235 -5.235 362 1HB ARG 131 2HB ARG 131 12.279 -6.642 -6.642 363 2HB ARG 131 1HB ARG 131 11.927 -7.970 -7.970 364 1HG ARG 131 2HG ARG 131 14.305 -8.062 -8.062 365 2HG ARG 131 1HG ARG 131 14.680 -6.579 -6.579 366 1HD ARG 131 2HD ARG 131 13.614 -9.164 -9.164 367 2HD ARG 131 1HD ARG 131 15.367 -8.825 -8.825 368 HE ARG 131 HE ARG 131 15.269 -6.924 -6.924 369 1HH1 ARG 131 1HH1 ARG 131 12.223 -8.817 -8.817 370 2HH1 ARG 131 2HH1 ARG 131 11.740 -8.265 -8.265 371 1HH2 ARG 131 1HH2 ARG 131 14.592 -6.217 -6.217 372 2HH2 ARG 131 2HH2 ARG 131 13.098 -6.772 -6.772 373 H GLY 132 H GLY 132 10.783 -5.162 -5.162 374 1HA GLY 132 2HA GLY 132 11.871 -6.839 -6.839 375 2HA GLY 132 1HA GLY 132 10.584 -5.564 -5.564 376 H ARG 133 H ARG 133 11.432 -3.846 -3.846 377 HA ARG 133 HA ARG 133 12.521 -1.990 -1.990 378 1HB ARG 133 2HB ARG 133 14.085 -3.810 -3.810 379 2HB ARG 133 1HB ARG 133 15.173 -3.442 -3.442 380 1HG ARG 133 2HG ARG 133 15.666 -1.255 -1.255 381 2HG ARG 133 1HG ARG 133 14.156 -1.211 -1.211 382 1HD ARG 133 2HD ARG 133 16.450 -3.155 -3.155 383 2HD ARG 133 1HD ARG 133 16.267 -1.495 -1.495 384 HE ARG 133 HE ARG 133 13.744 -2.693 -2.693 385 1HH1 ARG 133 1HH1 ARG 133 17.077 -3.439 -3.439 386 2HH1 ARG 133 2HH1 ARG 133 16.580 -4.285 -4.285 387 1HH2 ARG 133 1HH2 ARG 133 13.096 -3.833 -3.833 388 2HH2 ARG 133 2HH2 ARG 133 14.286 -4.514 -4.514 389 H GLU 134 H GLU 134 11.681 -2.440 -2.440 390 HA GLU 134 HA GLU 134 12.537 -0.209 -0.209 391 1HB GLU 134 2HB GLU 134 14.706 -1.464 -1.464 392 2HB GLU 134 1HB GLU 134 13.712 -2.830 -2.830 393 1HG GLU 134 2HG GLU 134 12.857 -1.380 -1.380 394 2HG GLU 134 1HG GLU 134 13.737 0.035 0.035 395 H MET 135 H MET 135 11.689 -3.624 -3.624 396 HA MET 135 HA MET 135 9.878 -3.469 -3.469 397 1HB MET 135 2HB MET 135 10.247 -5.712 -5.712 398 2HB MET 135 1HB MET 135 9.354 -5.821 -5.821 399 1HG MET 135 2HG MET 135 11.509 -5.197 -5.197 400 2HG MET 135 1HG MET 135 12.379 -5.358 -5.358 401 1HE MET 135 1HE MET 135 12.702 -7.499 -7.499 402 2HE MET 135 3HE MET 135 10.942 -7.854 -7.854 403 3HE MET 135 2HE MET 135 12.085 -9.130 -9.130 404 H ALA 136 H ALA 136 9.653 -3.135 -3.135 405 HA ALA 136 HA ALA 136 7.885 -3.409 -3.409 406 1HB ALA 136 1HB ALA 136 9.020 -1.189 -1.189 407 2HB ALA 136 3HB ALA 136 7.870 -0.640 -0.640 408 3HB ALA 136 2HB ALA 136 7.268 -1.013 -1.013 409 H HIS 137 H HIS 137 5.903 -4.235 -4.235 410 HA HIS 137 HA HIS 137 4.261 -3.885 -3.885 411 1HB HIS 137 2HB HIS 137 4.123 -6.166 -6.166 412 2HB HIS 137 1HB HIS 137 3.284 -5.964 -5.964 413 HD1 HIS 137 1HD HIS 137 4.285 -7.981 -7.981 414 HD2 HIS 137 2HD HIS 137 7.226 -5.437 -5.437 415 HE1 HIS 137 1HE HIS 137 6.549 -8.787 -8.787 416 H GLN 138 H GLN 138 1.873 -4.337 -4.337 417 HA GLN 138 HA GLN 138 0.839 -3.150 -3.150 418 1HB GLN 138 2HB GLN 138 -1.383 -3.094 -3.094 419 2HB GLN 138 1HB GLN 138 -0.122 -2.132 -2.132 420 1HG GLN 138 2HG GLN 138 0.225 -3.979 -3.979 421 2HG GLN 138 1HG GLN 138 -1.016 -4.991 -4.991 422 1HE2 GLN 138 1HE2 GLN 138 -3.046 -4.856 -4.856 423 2HE2 GLN 138 2HE2 GLN 138 -3.749 -3.542 -3.542 424 H GLN 139 H GLN 139 1.771 -5.953 -5.953 425 HA GLN 139 HA GLN 139 -0.319 -7.618 -7.618 426 1HB GLN 139 2HB GLN 139 2.529 -8.577 -8.577 427 2HB GLN 139 1HB GLN 139 1.030 -9.529 -9.529 428 1HG GLN 139 2HG GLN 139 0.199 -8.131 -8.131 429 2HG GLN 139 1HG GLN 139 1.900 -7.476 -7.476 430 1HE2 GLN 139 1HE2 GLN 139 2.910 -8.440 -8.440 431 2HE2 GLN 139 2HE2 GLN 139 2.962 -10.141 -10.141 432 H ILE 140 H ILE 140 3.171 -6.821 -6.821 433 HA ILE 140 HA ILE 140 3.643 -7.906 -7.906 434 HB ILE 140 HB ILE 140 4.970 -5.781 -5.781 435 1HG1 ILE 140 2HG1 ILE 140 5.498 -8.786 -8.786 436 2HG1 ILE 140 1HG1 ILE 140 4.767 -8.092 -8.092 437 1HG2 ILE 140 2HG2 ILE 140 5.576 -7.387 -7.387 438 2HG2 ILE 140 1HG2 ILE 140 6.864 -6.531 -6.531 439 3HG2 ILE 140 3HG2 ILE 140 5.568 -5.585 -5.585 440 1HD1 ILE 140 2HD1 ILE 140 6.848 -6.622 -6.622 441 2HD1 ILE 140 1HD1 ILE 140 7.633 -7.659 -7.659 442 3HD1 ILE 140 3HD1 ILE 140 7.076 -8.390 -8.390 443 H GLY 141 H GLY 141 2.583 -4.615 -4.615 444 1HA GLY 141 2HA GLY 141 2.673 -3.928 -3.928 445 2HA GLY 141 1HA GLY 141 1.882 -2.997 -2.997 446 H MET 142 H MET 142 -0.164 -4.490 -4.490 447 HA MET 142 HA MET 142 -1.781 -4.032 -4.032 448 1HB MET 142 2HB MET 142 -2.397 -3.992 -3.992 449 2HB MET 142 1HB MET 142 -3.633 -3.682 -3.682 450 1HG MET 142 2HG MET 142 -1.993 -1.891 -1.891 451 2HG MET 142 1HG MET 142 -1.170 -1.961 -1.961 452 1HE MET 142 3HE MET 142 -1.874 -1.097 -1.097 453 2HE MET 142 2HE MET 142 -3.165 -2.346 -2.346 454 3HE MET 142 1HE MET 142 -3.542 -0.638 -0.638 455 H GLU 143 H GLU 143 -0.494 -6.920 -6.920 456 HA GLU 143 HA GLU 143 -2.891 -7.913 -7.913 457 1HB GLU 143 2HB GLU 143 -0.783 -9.416 -9.416 458 2HB GLU 143 1HB GLU 143 -0.135 -8.993 -8.993 459 1HG GLU 143 2HG GLU 143 -1.207 -10.953 -10.953 460 2HG GLU 143 1HG GLU 143 -2.581 -9.891 -9.891 461 H VAL 144 H VAL 144 0.208 -6.813 -6.813 462 HA VAL 144 HA VAL 144 -0.318 -7.457 -7.457 463 HB VAL 144 HB VAL 144 1.728 -5.535 -5.535 464 1HG1 VAL 144 1HG1 VAL 144 1.239 -7.117 -7.117 465 2HG1 VAL 144 3HG1 VAL 144 2.864 -6.534 -6.534 466 3HG1 VAL 144 2HG1 VAL 144 1.543 -5.344 -5.344 467 1HG2 VAL 144 1HG2 VAL 144 1.151 -8.524 -8.524 468 2HG2 VAL 144 3HG2 VAL 144 1.746 -7.691 -7.691 469 3HG2 VAL 144 2HG2 VAL 144 2.885 -7.960 -7.960 470 H LEU 145 H LEU 145 -0.091 -4.257 -4.257 471 HA LEU 145 HA LEU 145 -1.002 -2.703 -2.703 472 1HB LEU 145 2HB LEU 145 -1.655 -2.529 -2.529 473 2HB LEU 145 1HB LEU 145 -1.907 -1.186 -1.186 474 HG LEU 145 HG LEU 145 0.732 -2.450 -2.450 475 1HD1 LEU 145 2HD1 LEU 145 -0.594 0.254 0.254 476 2HD1 LEU 145 1HD1 LEU 145 1.159 -0.052 -0.052 477 3HD1 LEU 145 3HD1 LEU 145 -0.061 -1.039 -1.039 478 1HD2 LEU 145 1HD2 LEU 145 -0.040 -0.559 -0.559 479 2HD2 LEU 145 3HD2 LEU 145 0.987 -2.014 -2.014 480 3HD2 LEU 145 2HD2 LEU 145 1.638 -0.507 -0.507 481 H ASN 146 H ASN 146 -2.943 -4.110 -4.110 482 HA ASN 146 HA ASN 146 -5.564 -3.326 -3.326 483 1HB ASN 146 2HB ASN 146 -4.141 -4.833 -4.833 484 2HB ASN 146 1HB ASN 146 -5.342 -5.923 -5.923 485 1HD2 ASN 146 1HD2 ASN 146 -5.623 -5.947 -5.947 486 2HD2 ASN 146 2HD2 ASN 146 -6.860 -4.972 -4.972 487 H ARG 147 H ARG 147 -3.620 -6.290 -6.290 488 HA ARG 147 HA ARG 147 -5.896 -7.119 -7.119 489 1HB ARG 147 2HB ARG 147 -4.544 -8.647 -8.647 490 2HB ARG 147 1HB ARG 147 -3.033 -7.836 -7.836 491 1HG ARG 147 2HG ARG 147 -3.103 -8.971 -8.971 492 2HG ARG 147 1HG ARG 147 -4.932 -9.052 -9.052 493 1HD ARG 147 2HD ARG 147 -3.801 -11.341 -11.341 494 2HD ARG 147 1HD ARG 147 -4.636 -10.888 -10.888 495 HE ARG 147 HE ARG 147 -2.055 -9.805 -9.805 496 1HH1 ARG 147 1HH2 ARG 147 -3.425 -13.039 -13.039 497 2HH1 ARG 147 2HH2 ARG 147 -2.046 -13.897 -13.897 498 1HH2 ARG 147 1HH1 ARG 147 -0.192 -10.969 -10.969 499 2HH2 ARG 147 2HH1 ARG 147 -0.180 -12.701 -12.701 500 H VAL 148 H VAL 148 -3.306 -4.700 -4.700 501 HA VAL 148 HA VAL 148 -3.326 -5.147 -5.147 502 HB VAL 148 HB VAL 148 -2.832 -2.520 -2.520 503 1HG1 VAL 148 2HG1 VAL 148 -2.867 -3.260 -3.260 504 2HG1 VAL 148 1HG1 VAL 148 -1.365 -4.181 -4.181 505 3HG1 VAL 148 3HG1 VAL 148 -1.402 -2.369 -2.369 506 1HG2 VAL 148 2HG2 VAL 148 -1.575 -3.971 -3.971 507 2HG2 VAL 148 1HG2 VAL 148 -0.480 -3.059 -3.059 508 3HG2 VAL 148 3HG2 VAL 148 -0.845 -4.801 -4.801 509 H LYS 149 H LYS 149 -5.065 -2.795 -2.795 510 HA LYS 149 HA LYS 149 -6.596 -1.575 -1.575 511 1HB LYS 149 2HB LYS 149 -6.650 -0.845 -0.845 512 2HB LYS 149 1HB LYS 149 -7.183 -2.484 -2.484 513 1HG LYS 149 2HG LYS 149 -9.254 -2.334 -2.334 514 2HG LYS 149 1HG LYS 149 -8.965 -0.931 -0.931 515 1HD LYS 149 2HD LYS 149 -9.811 -1.107 -1.107 516 2HD LYS 149 1HD LYS 149 -10.401 -0.101 -0.101 517 1HE LYS 149 2HE LYS 149 -9.192 1.690 1.690 518 2HE LYS 149 1HE LYS 149 -7.886 0.714 0.714 519 1HZ LYS 149 1HZ LYS 149 -9.498 0.345 0.345 520 2HZ LYS 149 3HZ LYS 149 -10.669 1.259 1.259 521 3HZ LYS 149 2HZ LYS 149 -9.250 2.003 2.003 522 H ASP 150 H ASP 150 -7.156 -4.797 -4.797 523 HA ASP 150 HA ASP 150 -9.780 -4.854 -4.854 524 1HB ASP 150 2HB ASP 150 -7.701 -6.831 -6.831 525 2HB ASP 150 1HB ASP 150 -9.343 -7.298 -7.298 526 H ASP 151 H ASP 151 -6.689 -6.223 -6.223 527 HA ASP 151 HA ASP 151 -8.361 -7.323 -7.323 528 1HB ASP 151 2HB ASP 151 -5.994 -8.035 -8.035 529 2HB ASP 151 1HB ASP 151 -5.432 -6.566 -6.566 530 H LEU 152 H LEU 152 -6.607 -4.121 -4.121 531 HA LEU 152 HA LEU 152 -7.278 -3.704 -3.704 532 1HB LEU 152 2HB LEU 152 -5.707 -2.578 -2.578 533 2HB LEU 152 1HB LEU 152 -6.801 -1.330 -1.330 534 HG LEU 152 HG LEU 152 -5.263 -3.227 -3.227 535 1HD1 LEU 152 1HD1 LEU 152 -3.865 -2.502 -2.502 536 2HD1 LEU 152 3HD1 LEU 152 -4.060 -0.763 -0.763 537 3HD1 LEU 152 2HD1 LEU 152 -3.230 -1.909 -1.909 538 1HD2 LEU 152 3HD2 LEU 152 -6.224 -0.358 -0.358 539 2HD2 LEU 152 2HD2 LEU 152 -6.887 -1.907 -1.907 540 3HD2 LEU 152 1HD2 LEU 152 -5.292 -1.327 -1.327 541 H GLN 153 H GLN 153 -8.910 -2.812 -2.812 542 HA GLN 153 HA GLN 153 -10.446 -1.025 -1.025 543 1HB GLN 153 2HB GLN 153 -10.450 -3.498 -3.498 544 2HB GLN 153 1HB GLN 153 -11.763 -3.724 -3.724 545 1HG GLN 153 2HG GLN 153 -12.921 -1.726 -1.726 546 2HG GLN 153 1HG GLN 153 -11.349 -1.659 -1.659 547 1HE2 GLN 153 1HE2 GLN 153 -11.482 -2.594 -2.594 548 2HE2 GLN 153 2HE2 GLN 153 -12.369 -4.026 -4.026 549 H GLU 154 H GLU 154 -10.644 -3.176 -3.176 550 HA GLU 154 HA GLU 154 -13.098 -2.656 -2.656 551 1HB GLU 154 2HB GLU 154 -10.665 -3.054 -3.054 552 2HB GLU 154 1HB GLU 154 -12.285 -3.772 -3.772 553 1HG GLU 154 2HG GLU 154 -11.638 -5.227 -5.227 554 2HG GLU 154 1HG GLU 154 -10.026 -4.381 -4.381 555 H LEU 155 H LEU 155 -9.993 -1.340 -1.340 556 HA LEU 155 HA LEU 155 -11.097 0.682 0.682 557 1HB LEU 155 2HB LEU 155 -9.546 -1.085 -1.085 558 2HB LEU 155 1HB LEU 155 -8.274 -0.501 -0.501 559 HG LEU 155 HG LEU 155 -9.476 1.605 1.605 560 1HD1 LEU 155 2HD1 LEU 155 -9.605 -0.343 -0.343 561 2HD1 LEU 155 1HD1 LEU 155 -7.861 -0.702 -0.702 562 3HD1 LEU 155 3HD1 LEU 155 -8.347 0.831 0.831 563 1HD2 LEU 155 2HD2 LEU 155 -7.396 1.947 1.947 564 2HD2 LEU 155 1HD2 LEU 155 -7.145 2.273 2.273 565 3HD2 LEU 155 3HD2 LEU 155 -6.537 0.736 0.736 566 H ALA 156 H ALA 156 -8.652 0.090 0.090 567 HA ALA 156 HA ALA 156 -8.025 3.027 3.027 568 1HB ALA 156 3HB ALA 156 -6.742 0.678 0.678 569 2HB ALA 156 2HB ALA 156 -6.369 2.413 2.413 570 3HB ALA 156 1HB ALA 156 -6.006 1.624 1.624 571 H VAL 157 H VAL 157 -8.906 4.087 4.087 572 HA VAL 157 HA VAL 157 -8.541 1.915 1.915 573 HB VAL 157 HB VAL 157 -10.176 2.846 2.846 574 1HG1 VAL 157 2HG1 VAL 157 -11.328 2.799 2.799 575 2HG1 VAL 157 1HG1 VAL 157 -12.299 2.740 2.740 576 3HG1 VAL 157 3HG1 VAL 157 -11.139 1.391 1.391 577 1HG2 VAL 157 3HG2 VAL 157 -9.622 5.409 5.409 578 2HG2 VAL 157 2HG2 VAL 157 -11.240 4.928 4.928 579 3HG2 VAL 157 1HG2 VAL 157 -10.929 5.076 5.076 580 H VAL 158 H VAL 158 -8.672 3.228 3.228 581 HA VAL 158 HA VAL 158 -6.057 4.362 4.362 582 HB VAL 158 HB VAL 158 -7.891 3.229 3.229 583 1HG1 VAL 158 3HG1 VAL 158 -4.889 3.210 3.210 584 2HG1 VAL 158 2HG1 VAL 158 -5.730 2.479 2.479 585 3HG1 VAL 158 1HG1 VAL 158 -5.721 4.255 4.255 586 1HG2 VAL 158 1HG2 VAL 158 -6.275 1.712 1.712 587 2HG2 VAL 158 3HG2 VAL 158 -7.953 1.368 1.368 588 3HG2 VAL 158 2HG2 VAL 158 -6.512 1.049 1.049 589 H GLU 159 H GLU 159 -5.794 6.005 6.005 590 HA GLU 159 HA GLU 159 -7.955 7.869 7.869 591 1HB GLU 159 2HB GLU 159 -5.607 8.500 8.500 592 2HB GLU 159 1HB GLU 159 -5.233 7.751 7.751 593 1HG GLU 159 2HG GLU 159 -6.711 9.527 9.527 594 2HG GLU 159 1HG GLU 159 -7.139 10.150 10.150 595 H SER 160 H SER 160 -5.996 5.578 5.578 596 HA SER 160 HA SER 160 -7.850 5.736 5.736 597 1HB SER 160 2HB SER 160 -5.867 7.518 7.518 598 2HB SER 160 1HB SER 160 -5.054 6.000 6.000 599 HG SER 160 HG SER 160 -6.701 5.814 5.814 600 H PHE 161 H PHE 161 -7.541 3.818 3.818 601 HA PHE 161 HA PHE 161 -5.264 2.183 2.183 602 1HB PHE 161 2HB PHE 161 -7.955 1.505 1.505 603 2HB PHE 161 1HB PHE 161 -7.070 0.777 0.777 604 HD1 PHE 161 1HD PHE 161 -7.114 1.359 1.359 605 HD2 PHE 161 2HD PHE 161 -5.461 -0.987 -0.987 606 HE1 PHE 161 1HE PHE 161 -5.702 0.267 0.267 607 HE2 PHE 161 2HE PHE 161 -3.707 -1.729 -1.729 608 HZ PHE 161 HZ PHE 161 -3.813 -0.932 -0.932 609 HA PRO 162 HA PRO 162 -5.164 4.311 4.311 610 1HB PRO 162 2HB PRO 162 -2.517 5.294 5.294 611 2HB PRO 162 1HB PRO 162 -3.917 6.010 6.010 612 1HG PRO 162 2HG PRO 162 -1.637 4.669 4.669 613 2HG PRO 162 1HG PRO 162 -3.066 5.484 5.484 614 1HD PRO 162 2HD PRO 162 -2.616 2.599 2.599 615 2HD PRO 162 1HD PRO 162 -3.621 3.229 3.229 616 H THR 163 H THR 163 -1.840 3.710 3.710 617 HA THR 163 HA THR 163 -1.921 1.587 1.587 618 HB THR 163 HB THR 163 -3.063 4.306 4.306 619 HG1 THR 163 1HG THR 163 -3.093 1.881 1.881 620 1HG2 THR 163 3HG2 THR 163 -0.975 3.081 3.081 621 2HG2 THR 163 2HG2 THR 163 -2.167 4.336 4.336 622 3HG2 THR 163 1HG2 THR 163 -1.066 4.752 4.752 623 H LYS 164 H LYS 164 -0.764 4.828 4.828 624 HA LYS 164 HA LYS 164 1.182 4.734 4.734 625 1HB LYS 164 2HB LYS 164 1.852 6.988 6.988 626 2HB LYS 164 1HB LYS 164 0.186 6.827 6.827 627 1HG LYS 164 2HG LYS 164 -0.732 6.483 6.483 628 2HG LYS 164 1HG LYS 164 0.907 6.639 6.639 629 1HD LYS 164 2HD LYS 164 1.089 8.955 8.955 630 2HD LYS 164 1HD LYS 164 -0.586 8.813 8.813 631 1HE LYS 164 2HE LYS 164 0.206 8.617 8.617 632 2HE LYS 164 1HE LYS 164 -0.543 10.057 10.057 633 1HZ LYS 164 1HZ LYS 164 -1.751 7.349 7.349 634 2HZ LYS 164 3HZ LYS 164 -2.157 8.716 8.716 635 3HZ LYS 164 2HZ LYS 164 -2.451 8.702 8.702 636 H ILE 165 H ILE 165 2.837 3.425 3.425 637 HA ILE 165 HA ILE 165 4.503 3.382 3.382 638 HB ILE 165 HB ILE 165 5.203 2.584 2.584 639 1HG1 ILE 165 2HG1 ILE 165 3.524 1.092 1.092 640 2HG1 ILE 165 1HG1 ILE 165 3.100 1.433 1.433 641 1HG2 ILE 165 3HG2 ILE 165 7.065 2.740 2.740 642 2HG2 ILE 165 2HG2 ILE 165 6.240 1.535 1.535 643 3HG2 ILE 165 1HG2 ILE 165 6.829 1.083 1.083 644 1HD1 ILE 165 1HD1 ILE 165 4.872 -0.211 -0.211 645 2HD1 ILE 165 3HD1 ILE 165 5.182 -0.623 -0.623 646 3HD1 ILE 165 2HD1 ILE 165 3.586 -0.958 -0.958 647 H GLU 166 H GLU 166 6.089 4.587 4.587 648 HA GLU 166 HA GLU 166 6.707 6.759 6.759 649 1HB GLU 166 2HB GLU 166 6.384 6.955 6.955 650 2HB GLU 166 1HB GLU 166 7.065 8.264 8.264 651 1HG GLU 166 2HG GLU 166 4.884 8.500 8.500 652 2HG GLU 166 1HG GLU 166 4.185 7.143 7.143 653 H GLY 167 H GLY 167 8.682 5.889 5.889 654 1HA GLY 167 2HA GLY 167 10.905 5.339 5.339 655 2HA GLY 167 1HA GLY 167 10.626 5.363 5.363 656 H ARG 168 H ARG 168 11.363 3.505 3.505 657 HA ARG 168 HA ARG 168 10.340 1.102 1.102 658 1HB ARG 168 2HB ARG 168 12.169 -0.091 -0.091 659 2HB ARG 168 1HB ARG 168 12.773 1.087 1.087 660 1HG ARG 168 2HG ARG 168 12.545 1.894 1.894 661 2HG ARG 168 1HG ARG 168 13.888 0.877 0.877 662 1HD ARG 168 2HD ARG 168 14.615 2.595 2.595 663 2HD ARG 168 1HD ARG 168 13.278 3.700 3.700 664 HE ARG 168 HE ARG 168 15.666 2.872 2.872 665 1HH1 ARG 168 1HH2 ARG 168 12.552 4.622 4.622 666 2HH1 ARG 168 2HH2 ARG 168 12.822 5.504 5.504 667 1HH2 ARG 168 1HH1 ARG 168 16.005 4.063 4.063 668 2HH2 ARG 168 2HH1 ARG 168 14.809 5.182 5.182 669 H GLN 169 H GLN 169 8.501 2.475 2.475 670 HA GLN 169 HA GLN 169 7.983 0.792 0.792 671 1HB GLN 169 2HB GLN 169 8.009 2.944 2.944 672 2HB GLN 169 1HB GLN 169 9.395 1.802 1.802 673 1HG GLN 169 2HG GLN 169 10.690 3.014 3.014 674 2HG GLN 169 1HG GLN 169 9.361 4.093 4.093 675 1HE2 GLN 169 1HE2 GLN 169 8.244 5.483 5.483 676 2HE2 GLN 169 2HE2 GLN 169 9.129 6.148 6.148 677 H MET 170 H MET 170 5.928 1.089 1.089 678 HA MET 170 HA MET 170 4.330 3.115 3.115 679 1HB MET 170 2HB MET 170 3.792 0.782 0.782 680 2HB MET 170 1HB MET 170 3.313 0.271 0.271 681 1HG MET 170 2HG MET 170 1.562 2.143 2.143 682 2HG MET 170 1HG MET 170 2.068 2.402 2.402 683 1HE MET 170 3HE MET 170 1.707 0.005 0.005 684 2HE MET 170 2HE MET 170 2.063 -1.239 -1.239 685 3HE MET 170 1HE MET 170 0.492 -1.242 -1.242 686 H ILE 171 H ILE 171 3.243 4.573 4.573 687 HA ILE 171 HA ILE 171 3.010 3.486 3.486 688 HB ILE 171 HB ILE 171 1.660 5.932 5.932 689 1HG1 ILE 171 2HG1 ILE 171 4.686 5.562 5.562 690 2HG1 ILE 171 1HG1 ILE 171 3.803 6.225 6.225 691 1HG2 ILE 171 1HG2 ILE 171 1.580 4.970 4.970 692 2HG2 ILE 171 3HG2 ILE 171 3.304 5.381 5.381 693 3HG2 ILE 171 2HG2 ILE 171 2.038 6.662 6.662 694 1HD1 ILE 171 3HD1 ILE 171 2.734 7.868 7.868 695 2HD1 ILE 171 2HD1 ILE 171 4.091 7.430 7.430 696 3HD1 ILE 171 1HD1 ILE 171 4.469 8.186 8.186 697 H MET 172 H MET 172 1.095 2.918 2.918 698 HA MET 172 HA MET 172 -1.467 3.635 3.635 699 1HB MET 172 2HB MET 172 -1.744 1.199 1.199 700 2HB MET 172 1HB MET 172 -0.871 1.270 1.270 701 1HG MET 172 2HG MET 172 -3.340 2.975 2.975 702 2HG MET 172 1HG MET 172 -3.630 1.269 1.269 703 1HE MET 172 3HE MET 172 -2.351 -0.510 -0.510 704 2HE MET 172 2HE MET 172 -3.069 -0.423 -0.423 705 3HE MET 172 1HE MET 172 -4.130 -0.209 -0.209 706 H VAL 173 H VAL 173 -2.330 5.245 5.245 707 HA VAL 173 HA VAL 173 -0.753 5.956 5.956 708 HB VAL 173 HB VAL 173 -3.147 7.402 7.402 709 1HG1 VAL 173 3HG1 VAL 173 -1.081 7.630 7.630 710 2HG1 VAL 173 2HG1 VAL 173 -1.473 9.185 9.185 711 3HG1 VAL 173 1HG1 VAL 173 -2.772 8.253 8.253 712 1HG2 VAL 173 1HG2 VAL 173 -0.162 7.587 7.587 713 2HG2 VAL 173 3HG2 VAL 173 -1.576 7.261 7.261 714 3HG2 VAL 173 2HG2 VAL 173 -1.376 8.880 8.880 715 H LEU 174 H LEU 174 -1.642 5.509 5.509 716 HA LEU 174 HA LEU 174 -4.248 4.221 4.221 717 1HB LEU 174 2HB LEU 174 -2.318 2.855 2.855 718 2HB LEU 174 1HB LEU 174 -1.769 3.660 3.660 719 HG LEU 174 HG LEU 174 -4.198 3.085 3.085 720 1HD1 LEU 174 2HD1 LEU 174 -5.126 2.554 2.554 721 2HD1 LEU 174 1HD1 LEU 174 -4.138 1.026 1.026 722 3HD1 LEU 174 3HD1 LEU 174 -5.343 1.269 1.269 723 1HD2 LEU 174 2HD2 LEU 174 -1.991 1.948 1.948 724 2HD2 LEU 174 1HD2 LEU 174 -3.615 1.155 1.155 725 3HD2 LEU 174 3HD2 LEU 174 -2.571 0.582 0.582 726 H ALA 175 H ALA 175 -5.647 6.204 6.204 727 HA ALA 175 HA ALA 175 -4.888 7.440 7.440 728 1HB ALA 175 3HB ALA 175 -5.564 8.737 8.737 729 2HB ALA 175 2HB ALA 175 -7.160 7.802 7.802 730 3HB ALA 175 1HB ALA 175 -6.719 9.122 9.122 731 HA PRO 176 HA PRO 176 -7.805 5.808 5.808 732 1HB PRO 176 2HB PRO 176 -8.818 7.886 7.886 733 2HB PRO 176 1HB PRO 176 -7.164 7.167 7.167 734 1HG PRO 176 2HG PRO 176 -7.971 9.707 9.707 735 2HG PRO 176 1HG PRO 176 -6.556 9.452 9.452 736 1HD PRO 176 2HD PRO 176 -6.258 9.344 9.344 737 2HD PRO 176 1HD PRO 176 -5.391 8.151 8.151 738 H LYS 177 H LYS 177 -9.774 4.972 4.972 739 HA LYS 177 HA LYS 177 -11.668 6.095 6.095 740 1HB LYS 177 2HB LYS 177 -11.328 3.569 3.569 741 2HB LYS 177 1HB LYS 177 -12.176 3.952 3.952 742 1HG LYS 177 2HG LYS 177 -14.233 4.597 4.597 743 2HG LYS 177 1HG LYS 177 -13.336 4.339 4.339 744 1HD LYS 177 2HD LYS 177 -14.876 2.468 2.468 745 2HD LYS 177 1HD LYS 177 -13.165 1.929 1.929 746 1HE LYS 177 2HE LYS 177 -14.405 0.861 0.861 747 2HE LYS 177 1HE LYS 177 -12.996 1.835 1.835 748 1HZ LYS 177 2HZ LYS 177 -15.849 2.699 2.699 749 2HZ LYS 177 1HZ LYS 177 -14.955 2.203 2.203 750 3HZ LYS 177 3HZ LYS 177 -14.533 3.629 3.629 751 H LYS 178 H LYS 178 -13.641 7.008 7.008 752 HA LYS 178 HA LYS 178 -13.907 8.482 8.482 753 1HB LYS 178 2HB LYS 178 -14.868 9.173 9.173 754 2HB LYS 178 1HB LYS 178 -16.031 7.816 7.816 755 1HG LYS 178 2HG LYS 178 -16.958 8.923 8.923 756 2HG LYS 178 1HG LYS 178 -15.757 10.233 10.233 757 1HD LYS 178 2HD LYS 178 -17.917 10.989 10.989 758 2HD LYS 178 1HD LYS 178 -16.810 10.816 10.816 759 1HE LYS 178 2HE LYS 178 -19.120 9.993 9.993 760 2HE LYS 178 1HE LYS 178 -17.939 8.627 8.627 761 1HZ LYS 178 3HZ LYS 178 -19.683 9.291 9.291 762 2HZ LYS 178 2HZ LYS 178 -19.950 8.058 8.058 763 3HZ LYS 178 1HZ LYS 178 -18.601 7.986 7.986 764 H LYS 179 H LYS 179 -14.386 7.571 7.571 765 HA LYS 179 HA LYS 179 -15.793 5.100 5.100 766 1HB LYS 179 2HB LYS 179 -13.995 5.796 5.796 767 2HB LYS 179 1HB LYS 179 -15.116 7.075 7.075 768 1HG LYS 179 2HG LYS 179 -15.124 5.146 5.146 769 2HG LYS 179 1HG LYS 179 -16.739 5.298 5.298 770 1HD LYS 179 2HD LYS 179 -16.163 3.454 3.454 771 2HD LYS 179 1HD LYS 179 -14.514 3.351 3.351 772 1HE LYS 179 2HE LYS 179 -15.521 2.671 2.671 773 2HE LYS 179 1HE LYS 179 -17.178 2.792 2.792 774 1HZ LYS 179 3HZ LYS 179 -14.987 1.003 1.003 775 2HZ LYS 179 2HZ LYS 179 -16.342 0.550 0.550 776 3HZ LYS 179 1HZ LYS 179 -16.542 1.115 1.115 777 H GLN 180 H GLN 180 -17.978 4.847 4.847 778 HA GLN 180 HA GLN 180 -19.611 7.146 7.146 779 1HB GLN 180 2HB GLN 180 -20.351 4.233 4.233 780 2HB GLN 180 1HB GLN 180 -21.523 5.534 5.534 781 1HG GLN 180 2HG GLN 180 -20.505 5.741 5.741 782 2HG GLN 180 1HG GLN 180 -19.293 4.462 4.462 783 1HE2 GLN 180 1HE2 GLN 180 -19.833 2.346 2.346 784 2HE2 GLN 180 2HE2 GLN 180 -21.420 1.736 1.736 Start of MODEL 11 1 HA VAL 90 HA VAL 90 -3.626 16.493 16.493 2 HB VAL 90 HB VAL 90 -5.094 16.245 16.245 3 1HG1 VAL 90 2HG1 VAL 90 -6.323 17.741 17.741 4 2HG1 VAL 90 1HG1 VAL 90 -7.149 16.255 16.255 5 3HG1 VAL 90 3HG1 VAL 90 -7.445 16.791 16.791 6 1HG2 VAL 90 1HG2 VAL 90 -6.459 13.926 13.926 7 2HG2 VAL 90 3HG2 VAL 90 -5.306 13.762 13.762 8 3HG2 VAL 90 2HG2 VAL 90 -6.912 14.506 14.506 9 H ILE 91 H ILE 91 -4.781 14.846 14.846 10 HA ILE 91 HA ILE 91 -3.618 12.208 12.208 11 HB ILE 91 HB ILE 91 -5.128 13.271 13.271 12 1HG1 ILE 91 2HG1 ILE 91 -6.606 13.270 13.270 13 2HG1 ILE 91 1HG1 ILE 91 -7.030 11.896 11.896 14 1HG2 ILE 91 2HG2 ILE 91 -3.629 11.278 11.278 15 2HG2 ILE 91 1HG2 ILE 91 -4.369 10.381 10.381 16 3HG2 ILE 91 3HG2 ILE 91 -5.367 10.852 10.852 17 1HD1 ILE 91 1HD1 ILE 91 -5.720 10.336 10.336 18 2HD1 ILE 91 3HD1 ILE 91 -5.373 11.711 11.711 19 3HD1 ILE 91 2HD1 ILE 91 -7.075 11.168 11.168 20 H GLN 92 H GLN 92 -1.637 11.765 11.765 21 HA GLN 92 HA GLN 92 -0.069 13.704 13.704 22 1HB GLN 92 2HB GLN 92 0.794 11.506 11.506 23 2HB GLN 92 1HB GLN 92 1.780 12.925 12.925 24 1HG GLN 92 2HG GLN 92 0.415 14.439 14.439 25 2HG GLN 92 1HG GLN 92 -0.912 13.277 13.277 26 1HE2 GLN 92 1HE2 GLN 92 -1.228 12.264 12.264 27 2HE2 GLN 92 2HE2 GLN 92 -0.057 11.914 11.914 28 H VAL 93 H VAL 93 1.799 12.704 12.704 29 HA VAL 93 HA VAL 93 0.936 10.102 10.102 30 HB VAL 93 HB VAL 93 3.060 11.992 11.992 31 1HG1 VAL 93 3HG1 VAL 93 2.200 9.084 9.084 32 2HG1 VAL 93 2HG1 VAL 93 3.087 10.083 10.083 33 3HG1 VAL 93 1HG1 VAL 93 3.924 9.615 9.615 34 1HG2 VAL 93 1HG2 VAL 93 0.515 12.278 12.278 35 2HG2 VAL 93 3HG2 VAL 93 1.562 11.902 11.902 36 3HG2 VAL 93 2HG2 VAL 93 0.635 10.568 10.568 37 H LYS 94 H LYS 94 1.507 8.535 8.535 38 HA LYS 94 HA LYS 94 4.470 8.373 8.373 39 1HB LYS 94 2HB LYS 94 2.500 6.330 6.330 40 2HB LYS 94 1HB LYS 94 4.192 6.580 6.580 41 1HG LYS 94 2HG LYS 94 1.893 8.584 8.584 42 2HG LYS 94 1HG LYS 94 2.451 7.402 7.402 43 1HD LYS 94 2HD LYS 94 4.721 8.421 8.421 44 2HD LYS 94 1HD LYS 94 4.161 9.682 9.682 45 1HE LYS 94 2HE LYS 94 2.426 10.431 10.431 46 2HE LYS 94 1HE LYS 94 3.027 9.185 9.185 47 1HZ LYS 94 1HZ LYS 94 4.622 11.405 11.405 48 2HZ LYS 94 3HZ LYS 94 3.977 11.345 11.345 49 3HZ LYS 94 2HZ LYS 94 5.181 10.242 10.242 50 H GLU 95 H GLU 95 5.196 5.929 5.929 51 HA GLU 95 HA GLU 95 4.043 5.239 5.239 52 1HB GLU 95 2HB GLU 95 6.093 6.798 6.798 53 2HB GLU 95 1HB GLU 95 6.929 5.324 5.324 54 1HG GLU 95 2HG GLU 95 6.470 4.185 4.185 55 2HG GLU 95 1HG GLU 95 5.635 5.688 5.688 56 H ILE 96 H ILE 96 4.509 3.037 3.037 57 HA ILE 96 HA ILE 96 6.253 1.406 1.406 58 HB ILE 96 HB ILE 96 3.538 1.068 1.068 59 1HG1 ILE 96 2HG1 ILE 96 4.052 -1.433 -1.433 60 2HG1 ILE 96 1HG1 ILE 96 5.744 -1.092 -1.092 61 1HG2 ILE 96 1HG2 ILE 96 3.163 0.760 0.760 62 2HG2 ILE 96 3HG2 ILE 96 4.077 -0.832 -0.832 63 3HG2 ILE 96 2HG2 ILE 96 2.650 -0.637 -0.637 64 1HD1 ILE 96 1HD1 ILE 96 4.199 0.264 0.264 65 2HD1 ILE 96 3HD1 ILE 96 5.447 -1.019 -1.019 66 3HD1 ILE 96 2HD1 ILE 96 5.913 0.609 0.609 67 H LYS 97 H LYS 97 6.911 -0.530 -0.530 68 HA LYS 97 HA LYS 97 6.203 0.171 0.171 69 1HB LYS 97 2HB LYS 97 8.737 -1.321 -1.321 70 2HB LYS 97 1HB LYS 97 8.023 -1.008 -1.008 71 1HG LYS 97 2HG LYS 97 8.223 1.468 1.468 72 2HG LYS 97 1HG LYS 97 9.093 1.126 1.126 73 1HD LYS 97 2HD LYS 97 10.936 0.051 0.051 74 2HD LYS 97 1HD LYS 97 10.004 0.111 0.111 75 1HE LYS 97 2HE LYS 97 11.749 1.901 1.901 76 2HE LYS 97 1HE LYS 97 10.086 2.623 2.623 77 1HZ LYS 97 3HZ LYS 97 11.782 2.219 2.219 78 2HZ LYS 97 2HZ LYS 97 11.512 3.687 3.687 79 3HZ LYS 97 1HZ LYS 97 10.226 2.898 2.898 80 H PHE 98 H PHE 98 5.816 -1.634 -1.634 81 HA PHE 98 HA PHE 98 5.717 -4.226 -4.226 82 1HB PHE 98 2HB PHE 98 3.539 -2.948 -2.948 83 2HB PHE 98 1HB PHE 98 3.740 -4.723 -4.723 84 HD1 PHE 98 1HD PHE 98 4.177 -5.554 -5.554 85 HD2 PHE 98 2HD PHE 98 1.741 -2.440 -2.440 86 HE1 PHE 98 1HE PHE 98 3.057 -5.535 -5.535 87 HE2 PHE 98 2HE PHE 98 0.505 -2.459 -2.459 88 HZ PHE 98 HZ PHE 98 1.026 -4.157 -4.157 89 H ARG 99 H ARG 99 6.234 -5.959 -5.959 90 HA ARG 99 HA ARG 99 7.893 -4.957 -4.957 91 1HB ARG 99 2HB ARG 99 8.420 -6.713 -6.713 92 2HB ARG 99 1HB ARG 99 9.349 -6.899 -6.899 93 1HG ARG 99 2HG ARG 99 10.147 -4.606 -4.606 94 2HG ARG 99 1HG ARG 99 9.137 -4.251 -4.251 95 1HD ARG 99 2HD ARG 99 10.500 -5.818 -5.818 96 2HD ARG 99 1HD ARG 99 11.463 -6.281 -6.281 97 HE ARG 99 HE ARG 99 12.560 -4.193 -4.193 98 1HH1 ARG 99 1HH1 ARG 99 9.868 -4.220 -4.220 99 2HH1 ARG 99 2HH1 ARG 99 10.359 -2.751 -2.751 100 1HH2 ARG 99 1HH2 ARG 99 13.204 -2.225 -2.225 101 2HH2 ARG 99 2HH2 ARG 99 12.273 -1.605 -1.605 102 HA PRO 100 HA PRO 100 6.032 -8.277 -8.277 103 1HB PRO 100 2HB PRO 100 8.166 -9.283 -9.283 104 2HB PRO 100 1HB PRO 100 7.379 -7.693 -7.693 105 1HG PRO 100 2HG PRO 100 9.935 -8.161 -8.161 106 2HG PRO 100 1HG PRO 100 9.592 -6.958 -6.958 107 1HD PRO 100 2HD PRO 100 9.429 -6.234 -6.234 108 2HD PRO 100 1HD PRO 100 8.140 -5.661 -5.661 109 H GLY 101 H GLY 101 5.586 -10.448 -10.448 110 1HA GLY 101 2HA GLY 101 5.935 -12.608 -12.608 111 2HA GLY 101 1HA GLY 101 7.690 -12.193 -12.193 112 H THR 102 H THR 102 5.719 -10.319 -10.319 113 HA THR 102 HA THR 102 6.561 -11.561 -11.561 114 HB THR 102 HB THR 102 5.636 -8.662 -8.662 115 HG1 THR 102 1HG THR 102 8.227 -9.871 -9.871 116 1HG2 THR 102 2HG2 THR 102 6.896 -10.606 -10.606 117 2HG2 THR 102 1HG2 THR 102 7.026 -8.798 -8.798 118 3HG2 THR 102 3HG2 THR 102 5.423 -9.617 -9.617 119 H ASP 103 H ASP 103 5.139 -12.887 -12.887 120 HA ASP 103 HA ASP 103 2.596 -11.929 -11.929 121 1HB ASP 103 2HB ASP 103 2.834 -13.378 -13.378 122 2HB ASP 103 1HB ASP 103 3.227 -14.690 -14.690 123 H GLU 104 H GLU 104 3.910 -15.248 -15.248 124 HA GLU 104 HA GLU 104 1.295 -14.142 -14.142 125 1HB GLU 104 2HB GLU 104 2.627 -16.460 -16.460 126 2HB GLU 104 1HB GLU 104 0.914 -15.941 -15.941 127 1HG GLU 104 2HG GLU 104 0.433 -16.393 -16.393 128 2HG GLU 104 1HG GLU 104 2.140 -16.935 -16.935 129 H GLY 105 H GLY 105 3.420 -15.182 -15.182 130 1HA GLY 105 2HA GLY 105 2.613 -12.688 -12.688 131 2HA GLY 105 1HA GLY 105 3.175 -14.212 -14.212 132 H ASP 106 H ASP 106 4.599 -12.570 -12.570 133 HA ASP 106 HA ASP 106 6.442 -11.177 -11.177 134 1HB ASP 106 2HB ASP 106 7.314 -12.400 -12.400 135 2HB ASP 106 1HB ASP 106 6.465 -11.204 -11.204 136 H TYR 107 H TYR 107 3.983 -11.142 -11.142 137 HA TYR 107 HA TYR 107 3.912 -8.336 -8.336 138 1HB TYR 107 2HB TYR 107 3.362 -10.133 -10.133 139 2HB TYR 107 1HB TYR 107 2.042 -10.737 -10.737 140 HD1 TYR 107 1HD TYR 107 2.087 -7.122 -7.122 141 HD2 TYR 107 2HD TYR 107 0.922 -10.744 -10.744 142 HE1 TYR 107 1HE TYR 107 -0.046 -6.107 -6.107 143 HE2 TYR 107 2HE TYR 107 -0.853 -9.571 -9.571 144 HH TYR 107 HH TYR 107 -1.779 -6.301 -6.301 145 H GLN 108 H GLN 108 1.090 -10.386 -10.386 146 HA GLN 108 HA GLN 108 -0.081 -8.467 -8.467 147 1HB GLN 108 2HB GLN 108 -0.810 -11.043 -11.043 148 2HB GLN 108 1HB GLN 108 -1.750 -9.730 -9.730 149 1HG GLN 108 2HG GLN 108 -0.074 -11.523 -11.523 150 2HG GLN 108 1HG GLN 108 -1.493 -12.120 -12.120 151 1HE2 GLN 108 1HE2 GLN 108 -0.551 -8.805 -8.805 152 2HE2 GLN 108 2HE2 GLN 108 -1.883 -8.633 -8.633 153 H VAL 109 H VAL 109 2.553 -9.903 -9.903 154 HA VAL 109 HA VAL 109 2.079 -9.168 -9.168 155 HB VAL 109 HB VAL 109 4.659 -9.521 -9.521 156 1HG1 VAL 109 3HG1 VAL 109 4.246 -8.683 -8.683 157 2HG1 VAL 109 2HG1 VAL 109 5.750 -9.446 -9.446 158 3HG1 VAL 109 1HG1 VAL 109 5.264 -7.845 -7.845 159 1HG2 VAL 109 1HG2 VAL 109 3.240 -11.540 -11.540 160 2HG2 VAL 109 3HG2 VAL 109 4.803 -11.531 -11.531 161 3HG2 VAL 109 2HG2 VAL 109 3.276 -11.067 -11.067 162 H LYS 110 H LYS 110 3.422 -7.424 -7.424 163 HA LYS 110 HA LYS 110 3.448 -4.972 -4.972 164 1HB LYS 110 2HB LYS 110 4.410 -5.740 -5.740 165 2HB LYS 110 1HB LYS 110 4.419 -4.070 -4.070 166 1HG LYS 110 2HG LYS 110 6.021 -6.480 -6.480 167 2HG LYS 110 1HG LYS 110 6.516 -4.776 -4.776 168 1HD LYS 110 2HD LYS 110 5.655 -3.899 -3.899 169 2HD LYS 110 1HD LYS 110 5.210 -5.560 -5.560 170 1HE LYS 110 2HE LYS 110 7.625 -6.240 -6.240 171 2HE LYS 110 1HE LYS 110 8.077 -4.576 -4.576 172 1HZ LYS 110 1HZ LYS 110 7.121 -3.707 -3.707 173 2HZ LYS 110 3HZ LYS 110 6.743 -5.276 -5.276 174 3HZ LYS 110 2HZ LYS 110 8.364 -4.821 -4.821 175 H LEU 111 H LEU 111 1.161 -6.611 -6.611 176 HA LEU 111 HA LEU 111 -0.241 -4.251 -4.251 177 1HB LEU 111 2HB LEU 111 -0.514 -6.562 -6.562 178 2HB LEU 111 1HB LEU 111 -1.336 -7.064 -7.064 179 HG LEU 111 HG LEU 111 -2.275 -4.629 -4.629 180 1HD1 LEU 111 3HD1 LEU 111 -1.898 -6.458 -6.458 181 2HD1 LEU 111 2HD1 LEU 111 -3.017 -7.521 -7.521 182 3HD1 LEU 111 1HD1 LEU 111 -3.636 -6.008 -6.008 183 1HD2 LEU 111 1HD2 LEU 111 -3.651 -6.911 -6.911 184 2HD2 LEU 111 3HD2 LEU 111 -3.450 -5.203 -5.203 185 3HD2 LEU 111 2HD2 LEU 111 -4.565 -5.599 -5.599 186 H ARG 112 H ARG 112 0.323 -6.475 -6.475 187 HA ARG 112 HA ARG 112 -1.502 -5.289 -5.289 188 1HB ARG 112 2HB ARG 112 -0.183 -7.474 -7.474 189 2HB ARG 112 1HB ARG 112 1.088 -6.394 -6.394 190 1HG ARG 112 2HG ARG 112 -0.560 -5.462 -5.462 191 2HG ARG 112 1HG ARG 112 -1.826 -6.553 -6.553 192 1HD ARG 112 2HD ARG 112 -0.478 -8.553 -8.553 193 2HD ARG 112 1HD ARG 112 0.822 -7.444 -7.444 194 HE ARG 112 HE ARG 112 -1.720 -6.699 -6.699 195 1HH1 ARG 112 1HH1 ARG 112 0.758 -9.262 -9.262 196 2HH1 ARG 112 2HH1 ARG 112 0.475 -9.720 -9.720 197 1HH2 ARG 112 1HH2 ARG 112 -2.102 -7.331 -7.331 198 2HH2 ARG 112 2HH2 ARG 112 -1.174 -8.610 -8.610 199 H SER 113 H SER 113 2.084 -4.420 -4.420 200 HA SER 113 HA SER 113 2.046 -2.397 -2.397 201 1HB SER 113 2HB SER 113 3.636 -2.575 -2.575 202 2HB SER 113 1HB SER 113 3.778 -1.291 -1.291 203 HG SER 113 HG SER 113 5.195 -3.043 -3.043 204 H LEU 114 H LEU 114 0.738 -2.430 -2.430 205 HA LEU 114 HA LEU 114 0.255 0.299 0.299 206 1HB LEU 114 2HB LEU 114 -1.043 -2.037 -2.037 207 2HB LEU 114 1HB LEU 114 -1.561 -0.340 -0.340 208 HG LEU 114 HG LEU 114 1.362 -1.274 -1.274 209 1HD1 LEU 114 3HD1 LEU 114 -0.189 -2.505 -2.505 210 2HD1 LEU 114 2HD1 LEU 114 -0.884 -0.935 -0.935 211 3HD1 LEU 114 1HD1 LEU 114 0.832 -1.343 -1.343 212 1HD2 LEU 114 1HD2 LEU 114 -0.227 1.189 1.189 213 2HD2 LEU 114 3HD2 LEU 114 1.034 1.192 1.192 214 3HD2 LEU 114 2HD2 LEU 114 1.465 0.962 0.962 215 H ILE 115 H ILE 115 -1.828 -2.291 -2.291 216 HA ILE 115 HA ILE 115 -4.065 -0.723 -0.723 217 HB ILE 115 HB ILE 115 -3.358 -2.393 -2.393 218 1HG1 ILE 115 2HG1 ILE 115 -2.770 -3.909 -3.909 219 2HG1 ILE 115 1HG1 ILE 115 -4.223 -4.432 -4.432 220 1HG2 ILE 115 3HG2 ILE 115 -5.774 -1.576 -1.576 221 2HG2 ILE 115 2HG2 ILE 115 -5.887 -2.741 -2.741 222 3HG2 ILE 115 1HG2 ILE 115 -5.326 -1.052 -1.052 223 1HD1 ILE 115 2HD1 ILE 115 -5.668 -3.502 -3.502 224 2HD1 ILE 115 1HD1 ILE 115 -4.121 -3.089 -3.089 225 3HD1 ILE 115 3HD1 ILE 115 -4.567 -4.818 -4.818 226 H ARG 116 H ARG 116 -1.337 -1.185 -1.185 227 HA ARG 116 HA ARG 116 -1.775 0.300 0.300 228 1HB ARG 116 2HB ARG 116 0.310 -1.181 -1.181 229 2HB ARG 116 1HB ARG 116 0.963 0.389 0.389 230 1HG ARG 116 2HG ARG 116 0.756 1.350 1.350 231 2HG ARG 116 1HG ARG 116 0.118 -0.239 -0.239 232 1HD ARG 116 2HD ARG 116 2.575 -0.002 -0.002 233 2HD ARG 116 1HD ARG 116 2.264 -1.344 -1.344 234 HE ARG 116 HE ARG 116 2.840 1.358 1.358 235 1HH1 ARG 116 1HH1 ARG 116 4.091 -1.867 -1.867 236 2HH1 ARG 116 2HH1 ARG 116 5.442 -1.794 -1.794 237 1HH2 ARG 116 1HH2 ARG 116 4.663 1.425 1.425 238 2HH2 ARG 116 2HH2 ARG 116 5.772 0.096 0.096 239 H PHE 117 H PHE 117 -0.316 1.465 1.465 240 HA PHE 117 HA PHE 117 0.068 4.149 4.149 241 1HB PHE 117 2HB PHE 117 -0.417 2.888 2.888 242 2HB PHE 117 1HB PHE 117 -0.236 4.697 4.697 243 HD1 PHE 117 1HD PHE 117 1.541 5.544 5.544 244 HD2 PHE 117 2HD PHE 117 1.377 1.533 1.533 245 HE1 PHE 117 1HE PHE 117 4.005 5.340 5.340 246 HE2 PHE 117 2HE PHE 117 3.815 1.219 1.219 247 HZ PHE 117 HZ PHE 117 5.119 3.160 3.160 248 H LEU 118 H LEU 118 -2.743 2.670 2.670 249 HA LEU 118 HA LEU 118 -4.282 5.036 5.036 250 1HB LEU 118 2HB LEU 118 -4.707 2.117 2.117 251 2HB LEU 118 1HB LEU 118 -6.083 3.298 3.298 252 HG LEU 118 HG LEU 118 -3.608 4.378 4.378 253 1HD1 LEU 118 2HD1 LEU 118 -4.047 1.656 1.656 254 2HD1 LEU 118 1HD1 LEU 118 -4.497 2.719 2.719 255 3HD1 LEU 118 3HD1 LEU 118 -2.864 2.916 2.916 256 1HD2 LEU 118 1HD2 LEU 118 -5.933 5.283 5.283 257 2HD2 LEU 118 3HD2 LEU 118 -5.043 5.068 5.068 258 3HD2 LEU 118 2HD2 LEU 118 -6.377 3.929 3.929 259 H GLU 119 H GLU 119 -3.846 2.737 2.737 260 HA GLU 119 HA GLU 119 -6.189 3.283 3.283 261 1HB GLU 119 2HB GLU 119 -3.585 1.844 1.844 262 2HB GLU 119 1HB GLU 119 -4.472 2.484 2.484 263 1HG GLU 119 2HG GLU 119 -5.757 0.591 0.591 264 2HG GLU 119 1HG GLU 119 -4.912 0.035 0.035 265 H GLU 120 H GLU 120 -2.803 4.503 4.503 266 HA GLU 120 HA GLU 120 -3.173 6.294 6.294 267 1HB GLU 120 2HB GLU 120 -1.426 6.891 6.891 268 2HB GLU 120 1HB GLU 120 -1.261 7.569 7.569 269 1HG GLU 120 2HG GLU 120 -0.614 5.202 5.202 270 2HG GLU 120 1HG GLU 120 -0.622 4.711 4.711 271 H GLY 121 H GLY 121 -4.126 6.247 6.247 272 1HA GLY 121 2HA GLY 121 -5.545 7.539 7.539 273 2HA GLY 121 1HA GLY 121 -5.418 8.783 8.783 274 H ASP 122 H ASP 122 -3.501 7.077 7.077 275 HA ASP 122 HA ASP 122 -2.502 9.681 9.681 276 1HB ASP 122 2HB ASP 122 -0.815 7.120 7.120 277 2HB ASP 122 1HB ASP 122 -0.276 8.766 8.766 278 H LYS 123 H LYS 123 -1.577 9.144 9.144 279 HA LYS 123 HA LYS 123 -3.193 7.056 7.056 280 1HB LYS 123 2HB LYS 123 -1.109 9.137 9.137 281 2HB LYS 123 1HB LYS 123 -1.590 7.807 7.807 282 1HG LYS 123 2HG LYS 123 -3.612 8.743 8.743 283 2HG LYS 123 1HG LYS 123 -3.752 9.688 9.688 284 1HD LYS 123 2HD LYS 123 -1.289 10.219 10.219 285 2HD LYS 123 1HD LYS 123 -2.816 10.744 10.744 286 1HE LYS 123 2HE LYS 123 -3.476 11.883 11.883 287 2HE LYS 123 1HE LYS 123 -1.764 11.531 11.531 288 1HZ LYS 123 1HZ LYS 123 -2.561 13.135 13.135 289 2HZ LYS 123 3HZ LYS 123 -2.039 13.764 13.764 290 3HZ LYS 123 2HZ LYS 123 -0.976 12.843 12.843 291 H ALA 124 H ALA 124 -1.939 5.177 5.177 292 HA ALA 124 HA ALA 124 0.938 5.637 5.637 293 1HB ALA 124 3HB ALA 124 -0.632 3.090 3.090 294 2HB ALA 124 2HB ALA 124 1.192 3.237 3.237 295 3HB ALA 124 1HB ALA 124 0.279 3.715 3.715 296 H LYS 125 H LYS 125 1.994 5.790 5.790 297 HA LYS 125 HA LYS 125 0.439 5.315 5.315 298 1HB LYS 125 2HB LYS 125 1.317 7.653 7.653 299 2HB LYS 125 1HB LYS 125 2.975 7.004 7.004 300 1HG LYS 125 2HG LYS 125 3.155 6.563 6.563 301 2HG LYS 125 1HG LYS 125 1.418 6.974 6.974 302 1HD LYS 125 2HD LYS 125 1.874 9.282 9.282 303 2HD LYS 125 1HD LYS 125 3.625 8.874 8.874 304 1HE LYS 125 2HE LYS 125 3.675 8.596 8.596 305 2HE LYS 125 1HE LYS 125 1.900 8.970 8.970 306 1HZ LYS 125 3HZ LYS 125 4.023 10.764 10.764 307 2HZ LYS 125 2HZ LYS 125 3.262 10.882 10.882 308 3HZ LYS 125 1HZ LYS 125 2.363 11.113 11.113 309 H ILE 126 H ILE 126 0.880 3.448 3.448 310 HA ILE 126 HA ILE 126 3.247 2.052 2.052 311 HB ILE 126 HB ILE 126 1.487 1.458 1.458 312 1HG1 ILE 126 2HG1 ILE 126 -0.222 1.926 1.926 313 2HG1 ILE 126 1HG1 ILE 126 -0.056 0.147 0.147 314 1HG2 ILE 126 1HG2 ILE 126 3.746 0.251 0.251 315 2HG2 ILE 126 3HG2 ILE 126 2.613 -0.463 -0.463 316 3HG2 ILE 126 2HG2 ILE 126 2.372 -0.726 -0.726 317 1HD1 ILE 126 3HD1 ILE 126 1.170 0.140 0.140 318 2HD1 ILE 126 2HD1 ILE 126 0.848 1.898 1.898 319 3HD1 ILE 126 1HD1 ILE 126 -0.536 0.729 0.729 320 H THR 127 H THR 127 5.157 2.357 2.357 321 HA THR 127 HA THR 127 4.914 3.137 3.137 322 HB THR 127 HB THR 127 7.401 2.743 2.743 323 HG1 THR 127 1HG THR 127 7.472 5.009 5.009 324 1HG2 THR 127 3HG2 THR 127 6.669 3.886 3.886 325 2HG2 THR 127 2HG2 THR 127 8.269 4.216 4.216 326 3HG2 THR 127 1HG2 THR 127 7.805 2.521 2.521 327 H LEU 128 H LEU 128 4.559 1.459 1.459 328 HA LEU 128 HA LEU 128 5.525 -1.167 -1.167 329 1HB LEU 128 2HB LEU 128 3.579 -0.347 -0.347 330 2HB LEU 128 1HB LEU 128 4.946 -0.685 -0.685 331 HG LEU 128 HG LEU 128 3.728 -2.541 -2.541 332 1HD1 LEU 128 2HD1 LEU 128 2.796 -1.686 -1.686 333 2HD1 LEU 128 1HD1 LEU 128 3.177 -3.467 -3.467 334 3HD1 LEU 128 3HD1 LEU 128 2.022 -2.815 -2.815 335 1HD2 LEU 128 1HD2 LEU 128 5.813 -3.167 -3.167 336 2HD2 LEU 128 3HD2 LEU 128 5.947 -3.414 -3.414 337 3HD2 LEU 128 2HD2 LEU 128 4.816 -4.437 -4.437 338 H ARG 129 H ARG 129 7.334 -2.237 -2.237 339 HA ARG 129 HA ARG 129 9.178 -0.495 -0.495 340 1HB ARG 129 2HB ARG 129 9.671 -0.138 -0.138 341 2HB ARG 129 1HB ARG 129 9.737 -1.926 -1.926 342 1HG ARG 129 2HG ARG 129 11.518 -1.571 -1.571 343 2HG ARG 129 1HG ARG 129 11.673 0.035 0.035 344 1HD ARG 129 2HD ARG 129 12.382 -0.991 -0.991 345 2HD ARG 129 1HD ARG 129 12.016 -2.651 -2.651 346 HE ARG 129 HE ARG 129 13.857 -1.298 -1.298 347 1HH1 ARG 129 1HH2 ARG 129 13.619 -2.816 -2.816 348 2HH1 ARG 129 2HH2 ARG 129 15.261 -3.370 -3.370 349 1HH2 ARG 129 1HH1 ARG 129 16.082 -2.054 -2.054 350 2HH2 ARG 129 2HH1 ARG 129 16.677 -2.931 -2.931 351 H PHE 130 H PHE 130 8.928 -1.708 -1.708 352 HA PHE 130 HA PHE 130 8.571 -4.604 -4.604 353 1HB PHE 130 2HB PHE 130 9.238 -2.564 -2.564 354 2HB PHE 130 1HB PHE 130 8.704 -4.340 -4.340 355 HD1 PHE 130 1HD PHE 130 6.569 -5.091 -5.091 356 HD2 PHE 130 2HD PHE 130 7.686 -0.953 -0.953 357 HE1 PHE 130 1HE PHE 130 4.315 -4.374 -4.374 358 HE2 PHE 130 2HE PHE 130 5.333 -0.370 -0.370 359 HZ PHE 130 HZ PHE 130 3.578 -2.102 -2.102 360 H ARG 131 H ARG 131 10.695 -5.826 -5.826 361 HA ARG 131 HA ARG 131 13.163 -4.241 -4.241 362 1HB ARG 131 2HB ARG 131 12.697 -7.163 -7.163 363 2HB ARG 131 1HB ARG 131 14.248 -6.609 -6.609 364 1HG ARG 131 2HG ARG 131 14.576 -6.624 -6.624 365 2HG ARG 131 1HG ARG 131 14.551 -4.922 -4.922 366 1HD ARG 131 2HD ARG 131 13.350 -5.162 -5.162 367 2HD ARG 131 1HD ARG 131 12.192 -4.675 -4.675 368 HE ARG 131 HE ARG 131 11.185 -6.812 -6.812 369 1HH1 ARG 131 1HH1 ARG 131 14.131 -6.740 -6.740 370 2HH1 ARG 131 2HH1 ARG 131 13.754 -8.214 -8.214 371 1HH2 ARG 131 1HH2 ARG 131 10.704 -8.792 -8.792 372 2HH2 ARG 131 2HH2 ARG 131 11.786 -9.393 -9.393 373 H GLY 132 H GLY 132 12.761 -3.558 -3.558 374 1HA GLY 132 2HA GLY 132 12.358 -5.647 -5.647 375 2HA GLY 132 1HA GLY 132 10.917 -4.821 -4.821 376 H ARG 133 H ARG 133 10.125 -3.594 -3.594 377 HA ARG 133 HA ARG 133 9.788 -2.562 -2.562 378 1HB ARG 133 2HB ARG 133 11.397 -0.726 -0.726 379 2HB ARG 133 1HB ARG 133 12.626 -1.550 -1.550 380 1HG ARG 133 2HG ARG 133 11.140 -1.262 -1.262 381 2HG ARG 133 1HG ARG 133 9.812 -0.676 -0.676 382 1HD ARG 133 2HD ARG 133 11.178 1.372 1.372 383 2HD ARG 133 1HD ARG 133 12.502 0.766 0.766 384 HE ARG 133 HE ARG 133 11.215 1.313 1.313 385 1HH1 ARG 133 1HH1 ARG 133 9.194 1.618 1.618 386 2HH1 ARG 133 2HH1 ARG 133 7.907 2.443 2.443 387 1HH2 ARG 133 1HH2 ARG 133 9.462 2.414 2.414 388 2HH2 ARG 133 2HH2 ARG 133 8.062 2.901 2.901 389 H GLU 134 H GLU 134 10.057 -5.042 -5.042 390 HA GLU 134 HA GLU 134 10.224 -6.224 -6.224 391 1HB GLU 134 2HB GLU 134 12.026 -7.934 -7.934 392 2HB GLU 134 1HB GLU 134 12.700 -6.307 -6.307 393 1HG GLU 134 2HG GLU 134 13.175 -5.992 -5.992 394 2HG GLU 134 1HG GLU 134 12.558 -7.659 -7.659 395 H MET 135 H MET 135 10.393 -5.907 -5.907 396 HA MET 135 HA MET 135 8.423 -8.039 -8.039 397 1HB MET 135 2HB MET 135 10.124 -6.848 -6.848 398 2HB MET 135 1HB MET 135 8.851 -8.096 -8.096 399 1HG MET 135 2HG MET 135 11.503 -8.417 -8.417 400 2HG MET 135 1HG MET 135 11.100 -9.094 -9.094 401 1HE MET 135 3HE MET 135 12.297 -10.523 -10.523 402 2HE MET 135 2HE MET 135 12.051 -11.301 -11.301 403 3HE MET 135 1HE MET 135 11.483 -12.123 -12.123 404 H ALA 136 H ALA 136 8.925 -4.700 -4.700 405 HA ALA 136 HA ALA 136 6.645 -3.986 -3.986 406 1HB ALA 136 2HB ALA 136 7.933 -2.507 -2.507 407 2HB ALA 136 1HB ALA 136 6.647 -1.884 -1.884 408 3HB ALA 136 3HB ALA 136 8.291 -2.183 -2.183 409 H HIS 137 H HIS 137 4.791 -4.990 -4.990 410 HA HIS 137 HA HIS 137 4.297 -5.443 -5.443 411 1HB HIS 137 2HB HIS 137 3.122 -7.026 -7.026 412 2HB HIS 137 1HB HIS 137 2.709 -7.137 -7.137 413 HD1 HIS 137 1HD HIS 137 3.409 -9.665 -9.665 414 HD2 HIS 137 2HD HIS 137 6.463 -6.809 -6.809 415 HE1 HIS 137 1HE HIS 137 5.597 -10.866 -10.866 416 H GLN 138 H GLN 138 1.466 -6.202 -6.202 417 HA GLN 138 HA GLN 138 0.635 -3.822 -3.822 418 1HB GLN 138 2HB GLN 138 -1.550 -3.614 -3.614 419 2HB GLN 138 1HB GLN 138 -0.125 -3.138 -3.138 420 1HG GLN 138 2HG GLN 138 -0.131 -5.414 -5.414 421 2HG GLN 138 1HG GLN 138 -1.642 -5.825 -5.825 422 1HE2 GLN 138 1HE2 GLN 138 -0.300 -4.315 -4.315 423 2HE2 GLN 138 2HE2 GLN 138 -1.713 -3.494 -3.494 424 H GLN 139 H GLN 139 1.202 -6.838 -6.838 425 HA GLN 139 HA GLN 139 -1.027 -8.078 -8.078 426 1HB GLN 139 2HB GLN 139 1.796 -9.261 -9.261 427 2HB GLN 139 1HB GLN 139 0.305 -10.131 -10.131 428 1HG GLN 139 2HG GLN 139 1.170 -8.493 -8.493 429 2HG GLN 139 1HG GLN 139 1.176 -10.297 -10.297 430 1HE2 GLN 139 1HE2 GLN 139 -0.420 -7.974 -7.974 431 2HE2 GLN 139 2HE2 GLN 139 -2.049 -8.562 -8.562 432 H ILE 140 H ILE 140 2.559 -7.284 -7.284 433 HA ILE 140 HA ILE 140 2.647 -7.304 -7.304 434 HB ILE 140 HB ILE 140 4.458 -6.679 -6.679 435 1HG1 ILE 140 2HG1 ILE 140 4.015 -9.504 -9.504 436 2HG1 ILE 140 1HG1 ILE 140 3.658 -9.013 -9.013 437 1HG2 ILE 140 1HG2 ILE 140 4.976 -6.292 -6.292 438 2HG2 ILE 140 3HG2 ILE 140 5.059 -8.073 -8.073 439 3HG2 ILE 140 2HG2 ILE 140 6.229 -7.191 -7.191 440 1HD1 ILE 140 1HD1 ILE 140 6.020 -8.570 -8.570 441 2HD1 ILE 140 3HD1 ILE 140 6.469 -9.148 -9.148 442 3HD1 ILE 140 2HD1 ILE 140 5.722 -10.288 -10.288 443 H GLY 141 H GLY 141 1.472 -6.008 -6.008 444 1HA GLY 141 2HA GLY 141 1.789 -3.168 -3.168 445 2HA GLY 141 1HA GLY 141 0.768 -3.743 -3.743 446 H MET 142 H MET 142 -0.877 -4.585 -4.585 447 HA MET 142 HA MET 142 -2.690 -3.666 -3.666 448 1HB MET 142 2HB MET 142 -3.114 -5.131 -5.131 449 2HB MET 142 1HB MET 142 -4.499 -4.481 -4.481 450 1HG MET 142 2HG MET 142 -3.498 -2.225 -2.225 451 2HG MET 142 1HG MET 142 -2.477 -2.772 -2.772 452 1HE MET 142 3HE MET 142 -5.797 -1.541 -1.541 453 2HE MET 142 2HE MET 142 -7.056 -2.103 -2.103 454 3HE MET 142 1HE MET 142 -6.289 -3.269 -3.269 455 H GLU 143 H GLU 143 -1.131 -6.781 -6.781 456 HA GLU 143 HA GLU 143 -3.463 -7.815 -7.815 457 1HB GLU 143 2HB GLU 143 -1.240 -9.280 -9.280 458 2HB GLU 143 1HB GLU 143 -0.783 -8.983 -8.983 459 1HG GLU 143 2HG GLU 143 -1.862 -11.017 -11.017 460 2HG GLU 143 1HG GLU 143 -3.199 -9.915 -9.915 461 H VAL 144 H VAL 144 -0.420 -6.369 -6.369 462 HA VAL 144 HA VAL 144 -0.346 -7.157 -7.157 463 HB VAL 144 HB VAL 144 1.131 -4.916 -4.916 464 1HG1 VAL 144 1HG1 VAL 144 1.367 -6.528 -6.528 465 2HG1 VAL 144 3HG1 VAL 144 2.787 -5.706 -5.706 466 3HG1 VAL 144 2HG1 VAL 144 1.374 -4.736 -4.736 467 1HG2 VAL 144 3HG2 VAL 144 1.071 -7.949 -7.949 468 2HG2 VAL 144 2HG2 VAL 144 1.248 -6.998 -6.998 469 3HG2 VAL 144 1HG2 VAL 144 2.663 -7.131 -7.131 470 H LEU 145 H LEU 145 -0.420 -4.030 -4.030 471 HA LEU 145 HA LEU 145 -1.198 -2.518 -2.518 472 1HB LEU 145 2HB LEU 145 -1.413 -2.325 -2.325 473 2HB LEU 145 1HB LEU 145 -2.197 -1.015 -1.015 474 HG LEU 145 HG LEU 145 -0.209 -0.097 -0.097 475 1HD1 LEU 145 1HD1 LEU 145 1.179 -2.767 -2.767 476 2HD1 LEU 145 3HD1 LEU 145 2.008 -1.178 -1.178 477 3HD1 LEU 145 2HD1 LEU 145 0.750 -1.767 -1.767 478 1HD2 LEU 145 1HD2 LEU 145 0.282 -1.470 -1.470 479 2HD2 LEU 145 3HD2 LEU 145 -0.462 0.134 0.134 480 3HD2 LEU 145 2HD2 LEU 145 1.291 -0.105 -0.105 481 H ASN 146 H ASN 146 -3.261 -3.829 -3.829 482 HA ASN 146 HA ASN 146 -5.739 -2.884 -2.884 483 1HB ASN 146 2HB ASN 146 -4.501 -4.221 -4.221 484 2HB ASN 146 1HB ASN 146 -5.645 -5.455 -5.455 485 1HD2 ASN 146 2HD2 ASN 146 -6.603 -5.811 -5.811 486 2HD2 ASN 146 1HD2 ASN 146 -7.354 -4.687 -4.687 487 H ARG 147 H ARG 147 -3.836 -5.980 -5.980 488 HA ARG 147 HA ARG 147 -6.153 -6.809 -6.809 489 1HB ARG 147 2HB ARG 147 -4.885 -8.430 -8.430 490 2HB ARG 147 1HB ARG 147 -3.333 -7.717 -7.717 491 1HG ARG 147 2HG ARG 147 -3.441 -8.816 -8.816 492 2HG ARG 147 1HG ARG 147 -5.276 -8.782 -8.782 493 1HD ARG 147 2HD ARG 147 -4.306 -11.142 -11.142 494 2HD ARG 147 1HD ARG 147 -5.165 -10.670 -10.670 495 HE ARG 147 HE ARG 147 -2.583 -9.787 -9.787 496 1HH1 ARG 147 1HH2 ARG 147 -3.918 -12.897 -12.897 497 2HH1 ARG 147 2HH2 ARG 147 -2.597 -13.842 -13.842 498 1HH2 ARG 147 1HH1 ARG 147 -0.808 -11.077 -11.077 499 2HH2 ARG 147 2HH1 ARG 147 -0.804 -12.793 -12.793 500 H VAL 148 H VAL 148 -3.452 -4.516 -4.516 501 HA VAL 148 HA VAL 148 -3.380 -5.178 -5.178 502 HB VAL 148 HB VAL 148 -2.806 -2.482 -2.482 503 1HG1 VAL 148 3HG1 VAL 148 -2.789 -3.586 -3.586 504 2HG1 VAL 148 2HG1 VAL 148 -1.272 -4.370 -4.370 505 3HG1 VAL 148 1HG1 VAL 148 -1.410 -2.558 -2.558 506 1HG2 VAL 148 2HG2 VAL 148 -1.752 -3.853 -3.853 507 2HG2 VAL 148 1HG2 VAL 148 -0.530 -3.104 -3.104 508 3HG2 VAL 148 3HG2 VAL 148 -0.963 -4.855 -4.855 509 H LYS 149 H LYS 149 -5.048 -2.647 -2.647 510 HA LYS 149 HA LYS 149 -6.442 -1.210 -1.210 511 1HB LYS 149 2HB LYS 149 -6.231 -1.210 -1.210 512 2HB LYS 149 1HB LYS 149 -7.312 -2.630 -2.630 513 1HG LYS 149 2HG LYS 149 -9.160 -1.556 -1.556 514 2HG LYS 149 1HG LYS 149 -8.366 0.067 0.067 515 1HD LYS 149 2HD LYS 149 -8.011 -1.358 -1.358 516 2HD LYS 149 1HD LYS 149 -9.785 -0.826 -0.826 517 1HE LYS 149 2HE LYS 149 -8.866 1.538 1.538 518 2HE LYS 149 1HE LYS 149 -7.279 0.785 0.785 519 1HZ LYS 149 1HZ LYS 149 -8.415 -0.191 -0.191 520 2HZ LYS 149 3HZ LYS 149 -9.894 0.493 0.493 521 3HZ LYS 149 2HZ LYS 149 -8.609 1.496 1.496 522 H ASP 150 H ASP 150 -7.343 -4.368 -4.368 523 HA ASP 150 HA ASP 150 -9.932 -4.394 -4.394 524 1HB ASP 150 2HB ASP 150 -8.023 -6.145 -6.145 525 2HB ASP 150 1HB ASP 150 -9.466 -6.842 -6.842 526 H ASP 151 H ASP 151 -6.834 -6.115 -6.115 527 HA ASP 151 HA ASP 151 -8.409 -7.192 -7.192 528 1HB ASP 151 2HB ASP 151 -6.280 -8.142 -8.142 529 2HB ASP 151 1HB ASP 151 -5.398 -6.934 -6.934 530 H LEU 152 H LEU 152 -6.847 -3.988 -3.988 531 HA LEU 152 HA LEU 152 -6.763 -3.568 -3.568 532 1HB LEU 152 2HB LEU 152 -5.998 -2.069 -2.069 533 2HB LEU 152 1HB LEU 152 -7.200 -1.168 -1.168 534 HG LEU 152 HG LEU 152 -4.921 -0.481 -0.481 535 1HD1 LEU 152 1HD1 LEU 152 -6.556 -0.359 -0.359 536 2HD1 LEU 152 3HD1 LEU 152 -6.046 -1.955 -1.955 537 3HD1 LEU 152 2HD1 LEU 152 -4.873 -0.611 -0.611 538 1HD2 LEU 152 1HD2 LEU 152 -3.816 -2.490 -2.490 539 2HD2 LEU 152 3HD2 LEU 152 -3.281 -2.088 -2.088 540 3HD2 LEU 152 2HD2 LEU 152 -4.479 -3.416 -3.416 541 H GLN 153 H GLN 153 -9.019 -2.986 -2.986 542 HA GLN 153 HA GLN 153 -10.531 -1.170 -1.170 543 1HB GLN 153 2HB GLN 153 -10.511 -3.460 -3.460 544 2HB GLN 153 1HB GLN 153 -11.932 -3.793 -3.793 545 1HG GLN 153 2HG GLN 153 -12.939 -1.612 -1.612 546 2HG GLN 153 1HG GLN 153 -11.313 -1.406 -1.406 547 1HE2 GLN 153 1HE2 GLN 153 -13.668 -4.164 -4.164 548 2HE2 GLN 153 2HE2 GLN 153 -13.673 -4.673 -4.673 549 H GLU 154 H GLU 154 -10.503 -3.247 -3.247 550 HA GLU 154 HA GLU 154 -12.940 -2.773 -2.773 551 1HB GLU 154 2HB GLU 154 -10.329 -2.912 -2.912 552 2HB GLU 154 1HB GLU 154 -11.909 -3.641 -3.641 553 1HG GLU 154 2HG GLU 154 -11.463 -5.281 -5.281 554 2HG GLU 154 1HG GLU 154 -9.853 -4.460 -4.460 555 H LEU 155 H LEU 155 -9.788 -1.313 -1.313 556 HA LEU 155 HA LEU 155 -10.813 0.922 0.922 557 1HB LEU 155 2HB LEU 155 -8.222 -0.558 -0.558 558 2HB LEU 155 1HB LEU 155 -8.026 1.211 1.211 559 HG LEU 155 HG LEU 155 -9.608 1.294 1.294 560 1HD1 LEU 155 3HD1 LEU 155 -9.900 -1.182 -1.182 561 2HD1 LEU 155 2HD1 LEU 155 -8.113 -1.395 -1.395 562 3HD1 LEU 155 1HD1 LEU 155 -9.006 -0.521 -0.521 563 1HD2 LEU 155 2HD2 LEU 155 -7.397 2.332 2.332 564 2HD2 LEU 155 1HD2 LEU 155 -7.537 1.572 1.572 565 3HD2 LEU 155 3HD2 LEU 155 -6.575 0.760 0.760 566 H ALA 156 H ALA 156 -8.717 0.047 0.047 567 HA ALA 156 HA ALA 156 -8.286 2.946 2.946 568 1HB ALA 156 2HB ALA 156 -6.268 1.733 1.733 569 2HB ALA 156 1HB ALA 156 -6.665 0.735 0.735 570 3HB ALA 156 3HB ALA 156 -6.457 2.493 2.493 571 H VAL 157 H VAL 157 -9.263 3.679 3.679 572 HA VAL 157 HA VAL 157 -8.083 1.772 1.772 573 HB VAL 157 HB VAL 157 -9.647 2.409 2.409 574 1HG1 VAL 157 3HG1 VAL 157 -11.193 1.980 1.980 575 2HG1 VAL 157 2HG1 VAL 157 -11.859 1.759 1.759 576 3HG1 VAL 157 1HG1 VAL 157 -10.502 0.694 0.694 577 1HG2 VAL 157 2HG2 VAL 157 -9.789 5.015 5.015 578 2HG2 VAL 157 1HG2 VAL 157 -11.252 4.200 4.200 579 3HG2 VAL 157 3HG2 VAL 157 -11.016 4.388 4.388 580 H VAL 158 H VAL 158 -7.748 2.225 2.225 581 HA VAL 158 HA VAL 158 -5.776 4.204 4.204 582 HB VAL 158 HB VAL 158 -7.468 2.571 2.571 583 1HG1 VAL 158 2HG1 VAL 158 -4.877 3.825 3.825 584 2HG1 VAL 158 1HG1 VAL 158 -5.371 2.252 2.252 585 3HG1 VAL 158 3HG1 VAL 158 -6.446 3.677 3.677 586 1HG2 VAL 158 1HG2 VAL 158 -6.514 0.990 0.990 587 2HG2 VAL 158 3HG2 VAL 158 -5.789 0.661 0.661 588 3HG2 VAL 158 2HG2 VAL 158 -4.866 1.593 1.593 589 H GLU 159 H GLU 159 -5.759 5.763 5.763 590 HA GLU 159 HA GLU 159 -8.090 7.420 7.420 591 1HB GLU 159 2HB GLU 159 -5.881 8.181 8.181 592 2HB GLU 159 1HB GLU 159 -5.226 7.776 7.776 593 1HG GLU 159 2HG GLU 159 -6.603 9.666 9.666 594 2HG GLU 159 1HG GLU 159 -7.365 9.942 9.942 595 H SER 160 H SER 160 -5.786 5.810 5.810 596 HA SER 160 HA SER 160 -7.420 6.217 6.217 597 1HB SER 160 2HB SER 160 -5.757 8.234 8.234 598 2HB SER 160 1HB SER 160 -4.640 6.993 6.993 599 HG SER 160 HG SER 160 -7.083 7.930 7.930 600 H PHE 161 H PHE 161 -6.807 4.626 4.626 601 HA PHE 161 HA PHE 161 -4.466 3.004 3.004 602 1HB PHE 161 2HB PHE 161 -6.842 1.879 1.879 603 2HB PHE 161 1HB PHE 161 -6.415 1.920 1.920 604 HD1 PHE 161 2HD PHE 161 -4.190 1.214 1.214 605 HD2 PHE 161 1HD PHE 161 -6.071 0.078 0.078 606 HE1 PHE 161 2HE PHE 161 -2.381 -0.461 -0.461 607 HE2 PHE 161 1HE PHE 161 -4.367 -1.244 -1.244 608 HZ PHE 161 HZ PHE 161 -2.501 -1.748 -1.748 609 HA PRO 162 HA PRO 162 -4.488 6.172 6.172 610 1HB PRO 162 2HB PRO 162 -1.981 7.373 7.373 611 2HB PRO 162 1HB PRO 162 -3.347 7.419 7.419 612 1HG PRO 162 2HG PRO 162 -0.824 5.867 5.867 613 2HG PRO 162 1HG PRO 162 -2.051 6.271 6.271 614 1HD PRO 162 2HD PRO 162 -1.724 3.769 3.769 615 2HD PRO 162 1HD PRO 162 -2.841 4.088 4.088 616 H THR 163 H THR 163 -0.839 5.333 5.333 617 HA THR 163 HA THR 163 -1.730 6.670 6.670 618 HB THR 163 HB THR 163 1.114 6.607 6.607 619 HG1 THR 163 1HG THR 163 1.002 7.160 7.160 620 1HG2 THR 163 1HG2 THR 163 -1.204 8.449 8.449 621 2HG2 THR 163 3HG2 THR 163 0.532 8.950 8.950 622 3HG2 THR 163 2HG2 THR 163 -0.370 8.543 8.543 623 H LYS 164 H LYS 164 1.279 5.041 5.041 624 HA LYS 164 HA LYS 164 0.695 2.808 2.808 625 1HB LYS 164 2HB LYS 164 0.739 4.764 4.764 626 2HB LYS 164 1HB LYS 164 2.370 5.169 5.169 627 1HG LYS 164 2HG LYS 164 3.189 2.908 2.908 628 2HG LYS 164 1HG LYS 164 1.543 2.540 2.540 629 1HD LYS 164 2HD LYS 164 1.698 4.433 4.433 630 2HD LYS 164 1HD LYS 164 3.293 4.914 4.914 631 1HE LYS 164 2HE LYS 164 2.730 2.211 2.211 632 2HE LYS 164 1HE LYS 164 3.523 3.649 3.649 633 1HZ LYS 164 3HZ LYS 164 5.247 3.518 3.518 634 2HZ LYS 164 2HZ LYS 164 4.512 2.167 2.167 635 3HZ LYS 164 1HZ LYS 164 5.118 2.064 2.064 636 H ILE 165 H ILE 165 2.973 1.667 1.667 637 HA ILE 165 HA ILE 165 4.389 2.561 2.561 638 HB ILE 165 HB ILE 165 5.404 0.705 0.705 639 1HG1 ILE 165 2HG1 ILE 165 3.301 0.334 0.334 640 2HG1 ILE 165 1HG1 ILE 165 3.110 -0.094 -0.094 641 1HG2 ILE 165 3HG2 ILE 165 6.974 1.476 1.476 642 2HG2 ILE 165 2HG2 ILE 165 5.742 0.977 0.977 643 3HG2 ILE 165 1HG2 ILE 165 6.610 -0.251 -0.251 644 1HD1 ILE 165 2HD1 ILE 165 5.016 -1.578 -1.578 645 2HD1 ILE 165 1HD1 ILE 165 3.291 -2.009 -2.009 646 3HD1 ILE 165 3HD1 ILE 165 4.451 -2.116 -2.116 647 H GLU 166 H GLU 166 5.943 3.752 3.752 648 HA GLU 166 HA GLU 166 6.999 5.034 5.034 649 1HB GLU 166 2HB GLU 166 6.568 6.278 6.278 650 2HB GLU 166 1HB GLU 166 7.447 7.077 7.077 651 1HG GLU 166 2HG GLU 166 5.361 7.045 7.045 652 2HG GLU 166 1HG GLU 166 4.464 6.256 6.256 653 H GLY 167 H GLY 167 8.968 4.075 4.075 654 1HA GLY 167 2HA GLY 167 11.065 3.383 3.383 655 2HA GLY 167 1HA GLY 167 10.780 4.031 4.031 656 H ARG 168 H ARG 168 11.445 2.368 2.368 657 HA ARG 168 HA ARG 168 10.293 -0.231 -0.231 658 1HB ARG 168 2HB ARG 168 12.491 0.574 0.574 659 2HB ARG 168 1HB ARG 168 12.061 -1.109 -1.109 660 1HG ARG 168 2HG ARG 168 12.976 -0.714 -0.714 661 2HG ARG 168 1HG ARG 168 13.269 1.019 1.019 662 1HD ARG 168 2HD ARG 168 15.375 -0.335 -0.335 663 2HD ARG 168 1HD ARG 168 14.934 0.416 0.416 664 HE ARG 168 HE ARG 168 13.756 -2.188 -2.188 665 1HH1 ARG 168 1HH2 ARG 168 16.958 -0.612 -0.612 666 2HH1 ARG 168 2HH2 ARG 168 17.751 -1.901 -1.901 667 1HH2 ARG 168 1HH1 ARG 168 14.847 -3.933 -3.933 668 2HH2 ARG 168 2HH1 ARG 168 16.537 -3.811 -3.811 669 H GLN 169 H GLN 169 8.528 1.725 1.725 670 HA GLN 169 HA GLN 169 8.003 0.613 0.613 671 1HB GLN 169 2HB GLN 169 9.261 3.276 3.276 672 2HB GLN 169 1HB GLN 169 8.010 3.099 3.099 673 1HG GLN 169 2HG GLN 169 9.458 1.662 1.662 674 2HG GLN 169 1HG GLN 169 10.634 1.481 1.481 675 1HE2 GLN 169 1HE2 GLN 169 8.898 4.368 4.368 676 2HE2 GLN 169 2HE2 GLN 169 10.320 5.305 5.305 677 H MET 170 H MET 170 5.837 1.003 1.003 678 HA MET 170 HA MET 170 4.421 3.057 3.057 679 1HB MET 170 2HB MET 170 3.681 0.776 0.776 680 2HB MET 170 1HB MET 170 3.346 0.306 0.306 681 1HG MET 170 2HG MET 170 1.633 2.225 2.225 682 2HG MET 170 1HG MET 170 2.033 2.392 2.392 683 1HE MET 170 1HE MET 170 1.065 0.847 0.847 684 2HE MET 170 3HE MET 170 1.767 -0.708 -0.708 685 3HE MET 170 2HE MET 170 0.018 -0.603 -0.603 686 H ILE 171 H ILE 171 3.766 4.684 4.684 687 HA ILE 171 HA ILE 171 3.366 3.981 3.981 688 HB ILE 171 HB ILE 171 2.687 6.429 6.429 689 1HG1 ILE 171 2HG1 ILE 171 5.140 5.781 5.781 690 2HG1 ILE 171 1HG1 ILE 171 4.608 7.468 7.468 691 1HG2 ILE 171 3HG2 ILE 171 2.247 5.844 5.844 692 2HG2 ILE 171 2HG2 ILE 171 2.449 7.541 7.541 693 3HG2 ILE 171 1HG2 ILE 171 1.047 6.582 6.582 694 1HD1 ILE 171 2HD1 ILE 171 4.200 6.591 6.591 695 2HD1 ILE 171 1HD1 ILE 171 4.720 5.007 5.007 696 3HD1 ILE 171 3HD1 ILE 171 5.913 6.357 6.357 697 H MET 172 H MET 172 1.445 3.453 3.453 698 HA MET 172 HA MET 172 -1.058 4.439 4.439 699 1HB MET 172 2HB MET 172 -1.298 1.977 1.977 700 2HB MET 172 1HB MET 172 -0.491 1.800 1.800 701 1HG MET 172 2HG MET 172 -3.007 3.418 3.418 702 2HG MET 172 1HG MET 172 -3.236 1.693 1.693 703 1HE MET 172 2HE MET 172 -3.143 -0.117 -0.117 704 2HE MET 172 1HE MET 172 -1.370 -0.115 -0.115 705 3HE MET 172 3HE MET 172 -2.549 -0.228 -0.228 706 H VAL 173 H VAL 173 -2.017 5.854 5.854 707 HA VAL 173 HA VAL 173 -0.492 6.097 6.097 708 HB VAL 173 HB VAL 173 -3.055 7.516 7.516 709 1HG1 VAL 173 2HG1 VAL 173 -1.987 7.529 7.529 710 2HG1 VAL 173 1HG1 VAL 173 -0.459 8.025 8.025 711 3HG1 VAL 173 3HG1 VAL 173 -1.868 9.171 9.171 712 1HG2 VAL 173 1HG2 VAL 173 -0.225 8.059 8.059 713 2HG2 VAL 173 3HG2 VAL 173 -1.780 7.904 7.904 714 3HG2 VAL 173 2HG2 VAL 173 -1.497 9.340 9.340 715 H LEU 174 H LEU 174 -1.581 5.204 5.204 716 HA LEU 174 HA LEU 174 -4.323 3.986 3.986 717 1HB LEU 174 2HB LEU 174 -3.238 2.104 2.104 718 2HB LEU 174 1HB LEU 174 -1.952 2.782 2.782 719 HG LEU 174 HG LEU 174 -4.148 3.082 3.082 720 1HD1 LEU 174 2HD1 LEU 174 -5.446 2.196 2.196 721 2HD1 LEU 174 1HD1 LEU 174 -4.491 0.655 0.655 722 3HD1 LEU 174 3HD1 LEU 174 -5.511 1.071 1.071 723 1HD2 LEU 174 2HD2 LEU 174 -2.487 0.552 0.552 724 2HD2 LEU 174 1HD2 LEU 174 -2.037 2.044 2.044 725 3HD2 LEU 174 3HD2 LEU 174 -3.560 1.087 1.087 726 H ALA 175 H ALA 175 -5.858 4.969 4.969 727 HA ALA 175 HA ALA 175 -4.759 6.757 6.757 728 1HB ALA 175 1HB ALA 175 -5.391 7.808 7.808 729 2HB ALA 175 3HB ALA 175 -7.001 6.966 6.966 730 3HB ALA 175 2HB ALA 175 -6.538 8.418 8.418 731 HA PRO 176 HA PRO 176 -8.149 5.768 5.768 732 1HB PRO 176 2HB PRO 176 -9.139 8.664 8.664 733 2HB PRO 176 1HB PRO 176 -9.025 7.633 7.633 734 1HG PRO 176 2HG PRO 176 -7.089 9.502 9.502 735 2HG PRO 176 1HG PRO 176 -6.636 7.881 7.881 736 1HD PRO 176 2HD PRO 176 -6.225 8.865 8.865 737 2HD PRO 176 1HD PRO 176 -5.427 7.546 7.546 738 H LYS 177 H LYS 177 -10.091 4.743 4.743 739 HA LYS 177 HA LYS 177 -11.511 5.404 5.404 740 1HB LYS 177 2HB LYS 177 -11.282 3.028 3.028 741 2HB LYS 177 1HB LYS 177 -12.320 3.580 3.580 742 1HG LYS 177 2HG LYS 177 -14.213 3.934 3.934 743 2HG LYS 177 1HG LYS 177 -13.112 3.504 3.504 744 1HD LYS 177 2HD LYS 177 -14.593 1.623 1.623 745 2HD LYS 177 1HD LYS 177 -12.867 1.210 1.210 746 1HE LYS 177 2HE LYS 177 -14.377 0.364 0.364 747 2HE LYS 177 1HE LYS 177 -13.172 1.550 1.550 748 1HZ LYS 177 1HZ LYS 177 -16.003 2.124 2.124 749 2HZ LYS 177 3HZ LYS 177 -15.383 1.936 1.936 750 3HZ LYS 177 2HZ LYS 177 -14.882 3.244 3.244 751 H LYS 178 H LYS 178 -13.472 6.426 6.426 752 HA LYS 178 HA LYS 178 -14.146 8.103 8.103 753 1HB LYS 178 2HB LYS 178 -15.185 7.836 7.836 754 2HB LYS 178 1HB LYS 178 -15.971 8.919 8.919 755 1HG LYS 178 2HG LYS 178 -13.746 10.064 10.064 756 2HG LYS 178 1HG LYS 178 -13.054 9.094 9.094 757 1HD LYS 178 2HD LYS 178 -14.697 10.120 10.120 758 2HD LYS 178 1HD LYS 178 -15.448 11.028 11.028 759 1HE LYS 178 2HE LYS 178 -13.266 12.232 12.232 760 2HE LYS 178 1HE LYS 178 -12.548 11.365 11.365 761 1HZ LYS 178 1HZ LYS 178 -14.920 13.158 13.158 762 2HZ LYS 178 3HZ LYS 178 -13.350 13.544 13.544 763 3HZ LYS 178 2HZ LYS 178 -14.245 12.353 12.353 764 H LYS 179 H LYS 179 -15.985 8.066 8.066 765 HA LYS 179 HA LYS 179 -17.529 7.214 7.214 766 1HB LYS 179 2HB LYS 179 -18.484 5.626 5.626 767 2HB LYS 179 1HB LYS 179 -19.364 5.805 5.805 768 1HG LYS 179 2HG LYS 179 -19.576 8.255 8.255 769 2HG LYS 179 1HG LYS 179 -18.584 8.127 8.127 770 1HD LYS 179 2HD LYS 179 -20.804 8.339 8.339 771 2HD LYS 179 1HD LYS 179 -20.368 6.621 6.621 772 1HE LYS 179 2HE LYS 179 -21.958 7.570 7.570 773 2HE LYS 179 1HE LYS 179 -22.743 7.120 7.120 774 1HZ LYS 179 3HZ LYS 179 -21.769 4.947 4.947 775 2HZ LYS 179 2HZ LYS 179 -21.021 5.348 5.348 776 3HZ LYS 179 1HZ LYS 179 -22.717 5.303 5.303 777 H GLN 180 H GLN 180 -15.343 6.227 6.227 778 HA GLN 180 HA GLN 180 -15.644 3.314 3.314 779 1HB GLN 180 2HB GLN 180 -13.487 4.205 4.205 780 2HB GLN 180 1HB GLN 180 -13.163 5.014 5.014 781 1HG GLN 180 2HG GLN 180 -13.640 1.962 1.962 782 2HG GLN 180 1HG GLN 180 -12.032 2.728 2.728 783 1HE2 GLN 180 1HE2 GLN 180 -11.255 4.271 4.271 784 2HE2 GLN 180 2HE2 GLN 180 -11.464 3.746 3.746 Start of MODEL 12 1 HA VAL 90 HA VAL 90 -2.584 16.223 16.223 2 HB VAL 90 HB VAL 90 -4.609 16.249 16.249 3 1HG1 VAL 90 3HG1 VAL 90 -4.701 18.300 18.300 4 2HG1 VAL 90 2HG1 VAL 90 -5.628 17.310 17.310 5 3HG1 VAL 90 1HG1 VAL 90 -6.336 17.665 17.665 6 1HG2 VAL 90 1HG2 VAL 90 -5.949 14.806 14.806 7 2HG2 VAL 90 3HG2 VAL 90 -5.458 14.046 14.046 8 3HG2 VAL 90 2HG2 VAL 90 -6.759 15.267 15.267 9 H ILE 91 H ILE 91 -3.354 15.403 15.403 10 HA ILE 91 HA ILE 91 -3.046 12.477 12.477 11 HB ILE 91 HB ILE 91 -3.675 14.270 14.270 12 1HG1 ILE 91 2HG1 ILE 91 -5.554 14.349 14.349 13 2HG1 ILE 91 1HG1 ILE 91 -5.976 13.236 13.236 14 1HG2 ILE 91 2HG2 ILE 91 -3.553 11.196 11.196 15 2HG2 ILE 91 1HG2 ILE 91 -4.352 12.029 12.029 16 3HG2 ILE 91 3HG2 ILE 91 -2.587 12.215 12.215 17 1HD1 ILE 91 3HD1 ILE 91 -5.404 11.264 11.264 18 2HD1 ILE 91 2HD1 ILE 91 -5.042 12.403 12.403 19 3HD1 ILE 91 1HD1 ILE 91 -6.719 12.292 12.292 20 H GLN 92 H GLN 92 -1.084 11.541 11.541 21 HA GLN 92 HA GLN 92 1.085 13.246 13.246 22 1HB GLN 92 2HB GLN 92 1.177 10.388 10.388 23 2HB GLN 92 1HB GLN 92 2.510 11.597 11.597 24 1HG GLN 92 2HG GLN 92 -0.106 11.574 11.574 25 2HG GLN 92 1HG GLN 92 1.536 11.160 11.160 26 1HE2 GLN 92 1HE2 GLN 92 -0.843 13.563 13.563 27 2HE2 GLN 92 2HE2 GLN 92 0.110 14.960 14.960 28 H VAL 93 H VAL 93 2.786 12.029 12.029 29 HA VAL 93 HA VAL 93 1.398 10.062 10.062 30 HB VAL 93 HB VAL 93 3.931 11.613 11.613 31 1HG1 VAL 93 1HG1 VAL 93 2.483 9.216 9.216 32 2HG1 VAL 93 3HG1 VAL 93 3.655 10.241 10.241 33 3HG1 VAL 93 2HG1 VAL 93 4.251 9.249 9.249 34 1HG2 VAL 93 1HG2 VAL 93 1.474 12.564 12.564 35 2HG2 VAL 93 3HG2 VAL 93 2.607 12.441 12.441 36 3HG2 VAL 93 2HG2 VAL 93 1.405 11.138 11.138 37 H LYS 94 H LYS 94 1.715 7.896 7.896 38 HA LYS 94 HA LYS 94 4.572 7.494 7.494 39 1HB LYS 94 2HB LYS 94 2.411 5.420 5.420 40 2HB LYS 94 1HB LYS 94 3.998 5.372 5.372 41 1HG LYS 94 2HG LYS 94 1.712 7.318 7.318 42 2HG LYS 94 1HG LYS 94 2.004 5.803 5.803 43 1HD LYS 94 2HD LYS 94 4.052 8.106 8.106 44 2HD LYS 94 1HD LYS 94 2.850 7.925 7.925 45 1HE LYS 94 2HE LYS 94 5.017 5.819 5.819 46 2HE LYS 94 1HE LYS 94 5.096 7.048 7.048 47 1HZ LYS 94 3HZ LYS 94 3.104 6.105 6.105 48 2HZ LYS 94 2HZ LYS 94 3.011 4.955 4.955 49 3HZ LYS 94 1HZ LYS 94 4.317 4.926 4.926 50 H GLU 95 H GLU 95 5.289 5.266 5.266 51 HA GLU 95 HA GLU 95 4.018 4.947 4.947 52 1HB GLU 95 2HB GLU 95 5.970 6.608 6.608 53 2HB GLU 95 1HB GLU 95 6.935 5.193 5.193 54 1HG GLU 95 2HG GLU 95 6.553 4.054 4.054 55 2HG GLU 95 1HG GLU 95 5.451 5.399 5.399 56 H ILE 96 H ILE 96 4.543 2.858 2.858 57 HA ILE 96 HA ILE 96 6.129 1.074 1.074 58 HB ILE 96 HB ILE 96 3.400 0.895 0.895 59 1HG1 ILE 96 2HG1 ILE 96 3.666 -1.602 -1.602 60 2HG1 ILE 96 1HG1 ILE 96 5.347 -1.497 -1.497 61 1HG2 ILE 96 2HG2 ILE 96 3.080 0.755 0.755 62 2HG2 ILE 96 1HG2 ILE 96 3.878 -0.891 -0.891 63 3HG2 ILE 96 3HG2 ILE 96 2.425 -0.634 -0.634 64 1HD1 ILE 96 3HD1 ILE 96 4.193 -0.062 -0.062 65 2HD1 ILE 96 2HD1 ILE 96 5.271 -1.507 -1.507 66 3HD1 ILE 96 1HD1 ILE 96 5.901 0.079 0.079 67 H LYS 97 H LYS 97 6.889 -0.814 -0.814 68 HA LYS 97 HA LYS 97 6.250 -0.139 -0.139 69 1HB LYS 97 2HB LYS 97 8.855 -1.517 -1.517 70 2HB LYS 97 1HB LYS 97 8.125 -1.234 -1.234 71 1HG LYS 97 2HG LYS 97 8.222 1.247 1.247 72 2HG LYS 97 1HG LYS 97 9.145 0.943 0.943 73 1HD LYS 97 2HD LYS 97 10.980 -0.090 -0.090 74 2HD LYS 97 1HD LYS 97 9.992 -0.062 -0.062 75 1HE LYS 97 2HE LYS 97 11.675 1.757 1.757 76 2HE LYS 97 1HE LYS 97 10.009 2.462 2.462 77 1HZ LYS 97 1HZ LYS 97 11.878 2.076 2.076 78 2HZ LYS 97 3HZ LYS 97 11.539 3.539 3.539 79 3HZ LYS 97 2HZ LYS 97 10.319 2.744 2.744 80 H PHE 98 H PHE 98 5.922 -1.857 -1.857 81 HA PHE 98 HA PHE 98 5.800 -4.470 -4.470 82 1HB PHE 98 2HB PHE 98 3.698 -3.157 -3.157 83 2HB PHE 98 1HB PHE 98 3.787 -4.925 -4.925 84 HD1 PHE 98 1HD PHE 98 4.152 -5.562 -5.562 85 HD2 PHE 98 2HD PHE 98 2.141 -2.292 -2.292 86 HE1 PHE 98 1HE PHE 98 3.007 -5.245 -5.245 87 HE2 PHE 98 2HE PHE 98 0.820 -2.011 -2.011 88 HZ PHE 98 HZ PHE 98 1.159 -3.675 -3.675 89 H ARG 99 H ARG 99 5.814 -6.188 -6.188 90 HA ARG 99 HA ARG 99 7.811 -5.485 -5.485 91 1HB ARG 99 2HB ARG 99 7.165 -8.055 -8.055 92 2HB ARG 99 1HB ARG 99 8.629 -7.718 -7.718 93 1HG ARG 99 2HG ARG 99 9.629 -7.439 -7.439 94 2HG ARG 99 1HG ARG 99 8.962 -5.782 -5.782 95 1HD ARG 99 2HD ARG 99 6.853 -6.747 -6.747 96 2HD ARG 99 1HD ARG 99 7.929 -8.143 -8.143 97 HE ARG 99 HE ARG 99 9.465 -5.923 -5.923 98 1HH1 ARG 99 1HH2 ARG 99 6.120 -6.943 -6.943 99 2HH1 ARG 99 2HH2 ARG 99 6.050 -6.107 -6.107 100 1HH2 ARG 99 1HH1 ARG 99 9.348 -4.793 -4.793 101 2HH2 ARG 99 2HH1 ARG 99 7.903 -4.870 -4.870 102 HA PRO 100 HA PRO 100 5.358 -7.831 -7.831 103 1HB PRO 100 2HB PRO 100 7.808 -9.697 -9.697 104 2HB PRO 100 1HB PRO 100 6.945 -9.188 -9.188 105 1HG PRO 100 2HG PRO 100 9.318 -8.023 -8.023 106 2HG PRO 100 1HG PRO 100 8.098 -7.107 -7.107 107 1HD PRO 100 2HD PRO 100 8.770 -6.660 -6.660 108 2HD PRO 100 1HD PRO 100 7.571 -5.790 -5.790 109 H GLY 101 H GLY 101 4.039 -9.548 -9.548 110 1HA GLY 101 2HA GLY 101 2.664 -10.489 -10.489 111 2HA GLY 101 1HA GLY 101 3.178 -11.651 -11.651 112 H THR 102 H THR 102 2.847 -10.900 -10.900 113 HA THR 102 HA THR 102 5.325 -12.034 -12.034 114 HB THR 102 HB THR 102 3.679 -10.343 -10.343 115 HG1 THR 102 1HG THR 102 4.207 -8.537 -8.537 116 1HG2 THR 102 1HG2 THR 102 6.586 -10.215 -10.215 117 2HG2 THR 102 3HG2 THR 102 5.905 -9.242 -9.242 118 3HG2 THR 102 2HG2 THR 102 6.115 -11.019 -11.019 119 H ASP 103 H ASP 103 4.340 -11.838 -11.838 120 HA ASP 103 HA ASP 103 3.991 -14.704 -14.704 121 1HB ASP 103 2HB ASP 103 5.775 -12.790 -12.790 122 2HB ASP 103 1HB ASP 103 4.904 -12.892 -12.892 123 H GLU 104 H GLU 104 3.378 -15.312 -15.312 124 HA GLU 104 HA GLU 104 0.944 -13.978 -13.978 125 1HB GLU 104 2HB GLU 104 1.119 -16.450 -16.450 126 2HB GLU 104 1HB GLU 104 2.368 -16.227 -16.227 127 1HG GLU 104 2HG GLU 104 0.662 -15.099 -15.099 128 2HG GLU 104 1HG GLU 104 -0.554 -15.207 -15.207 129 H GLY 105 H GLY 105 3.772 -14.867 -14.867 130 1HA GLY 105 2HA GLY 105 3.378 -12.218 -12.218 131 2HA GLY 105 1HA GLY 105 4.023 -13.680 -13.680 132 H ASP 106 H ASP 106 4.760 -12.383 -12.383 133 HA ASP 106 HA ASP 106 6.949 -10.890 -10.890 134 1HB ASP 106 2HB ASP 106 7.453 -12.299 -12.299 135 2HB ASP 106 1HB ASP 106 6.477 -11.142 -11.142 136 H TYR 107 H TYR 107 4.014 -11.043 -11.043 137 HA TYR 107 HA TYR 107 4.278 -8.199 -8.199 138 1HB TYR 107 2HB TYR 107 3.560 -10.180 -10.180 139 2HB TYR 107 1HB TYR 107 2.111 -10.296 -10.296 140 HD1 TYR 107 1HD TYR 107 2.126 -6.952 -6.952 141 HD2 TYR 107 2HD TYR 107 1.641 -10.619 -10.619 142 HE1 TYR 107 1HE TYR 107 0.033 -6.139 -6.139 143 HE2 TYR 107 2HE TYR 107 -0.237 -9.609 -9.609 144 HH TYR 107 HH TYR 107 -1.521 -6.454 -6.454 145 H GLN 108 H GLN 108 1.412 -10.119 -10.119 146 HA GLN 108 HA GLN 108 0.356 -8.060 -8.060 147 1HB GLN 108 2HB GLN 108 -0.497 -10.572 -10.572 148 2HB GLN 108 1HB GLN 108 -1.388 -9.264 -9.264 149 1HG GLN 108 2HG GLN 108 0.222 -11.225 -11.225 150 2HG GLN 108 1HG GLN 108 -1.229 -11.697 -11.697 151 1HE2 GLN 108 1HE2 GLN 108 -0.141 -8.488 -8.488 152 2HE2 GLN 108 2HE2 GLN 108 -1.449 -8.310 -8.310 153 H VAL 109 H VAL 109 2.947 -9.498 -9.498 154 HA VAL 109 HA VAL 109 2.634 -8.674 -8.674 155 HB VAL 109 HB VAL 109 5.109 -8.828 -8.828 156 1HG1 VAL 109 3HG1 VAL 109 4.867 -8.088 -8.088 157 2HG1 VAL 109 2HG1 VAL 109 6.374 -8.704 -8.704 158 3HG1 VAL 109 1HG1 VAL 109 5.707 -7.137 -7.137 159 1HG2 VAL 109 3HG2 VAL 109 3.870 -10.961 -10.961 160 2HG2 VAL 109 2HG2 VAL 109 5.555 -10.855 -10.855 161 3HG2 VAL 109 1HG2 VAL 109 4.156 -10.522 -10.522 162 H LYS 110 H LYS 110 3.783 -7.018 -7.018 163 HA LYS 110 HA LYS 110 3.720 -4.473 -4.473 164 1HB LYS 110 2HB LYS 110 4.625 -5.406 -5.406 165 2HB LYS 110 1HB LYS 110 4.558 -3.699 -3.699 166 1HG LYS 110 2HG LYS 110 6.318 -5.927 -5.927 167 2HG LYS 110 1HG LYS 110 6.692 -4.220 -4.220 168 1HD LYS 110 2HD LYS 110 5.844 -3.309 -3.309 169 2HD LYS 110 1HD LYS 110 5.497 -4.970 -4.970 170 1HE LYS 110 2HE LYS 110 7.628 -4.155 -4.155 171 2HE LYS 110 1HE LYS 110 7.968 -5.523 -5.523 172 1HZ LYS 110 1HZ LYS 110 8.523 -3.891 -3.891 173 2HZ LYS 110 3HZ LYS 110 8.222 -2.619 -2.619 174 3HZ LYS 110 2HZ LYS 110 9.489 -3.709 -3.709 175 H LEU 111 H LEU 111 1.455 -6.248 -6.248 176 HA LEU 111 HA LEU 111 -0.030 -3.922 -3.922 177 1HB LEU 111 2HB LEU 111 -0.285 -6.278 -6.278 178 2HB LEU 111 1HB LEU 111 -1.117 -6.722 -6.722 179 HG LEU 111 HG LEU 111 -2.033 -4.336 -4.336 180 1HD1 LEU 111 2HD1 LEU 111 -1.683 -6.272 -6.272 181 2HD1 LEU 111 1HD1 LEU 111 -2.806 -7.260 -7.260 182 3HD1 LEU 111 3HD1 LEU 111 -3.412 -5.784 -5.784 183 1HD2 LEU 111 2HD2 LEU 111 -3.376 -6.357 -6.357 184 2HD2 LEU 111 1HD2 LEU 111 -3.257 -4.557 -4.557 185 3HD2 LEU 111 3HD2 LEU 111 -4.336 -5.299 -5.299 186 H ARG 112 H ARG 112 0.663 -6.069 -6.069 187 HA ARG 112 HA ARG 112 -1.189 -4.960 -4.960 188 1HB ARG 112 2HB ARG 112 0.261 -7.061 -7.061 189 2HB ARG 112 1HB ARG 112 1.437 -5.892 -5.892 190 1HG ARG 112 2HG ARG 112 -0.340 -5.065 -5.065 191 2HG ARG 112 1HG ARG 112 -1.482 -6.276 -6.276 192 1HD ARG 112 2HD ARG 112 0.018 -8.135 -8.135 193 2HD ARG 112 1HD ARG 112 1.192 -6.906 -6.906 194 HE ARG 112 HE ARG 112 -1.416 -6.349 -6.349 195 1HH1 ARG 112 1HH1 ARG 112 1.182 -8.787 -8.787 196 2HH1 ARG 112 2HH1 ARG 112 0.859 -9.289 -9.289 197 1HH2 ARG 112 1HH2 ARG 112 -1.852 -7.036 -7.036 198 2HH2 ARG 112 2HH2 ARG 112 -0.889 -8.278 -8.278 199 H SER 113 H SER 113 2.336 -3.917 -3.917 200 HA SER 113 HA SER 113 2.292 -1.972 -1.972 201 1HB SER 113 2HB SER 113 3.788 -2.011 -2.011 202 2HB SER 113 1HB SER 113 3.948 -0.762 -0.762 203 HG SER 113 HG SER 113 4.391 -2.421 -2.421 204 H LEU 114 H LEU 114 1.002 -1.857 -1.857 205 HA LEU 114 HA LEU 114 0.370 0.903 0.903 206 1HB LEU 114 2HB LEU 114 -0.895 -1.605 -1.605 207 2HB LEU 114 1HB LEU 114 -1.524 0.046 0.046 208 HG LEU 114 HG LEU 114 1.352 -0.848 -0.848 209 1HD1 LEU 114 2HD1 LEU 114 -1.179 -0.480 -0.480 210 2HD1 LEU 114 1HD1 LEU 114 0.460 -0.866 -0.866 211 3HD1 LEU 114 3HD1 LEU 114 -0.389 -2.042 -2.042 212 1HD2 LEU 114 1HD2 LEU 114 -0.291 1.713 1.713 213 2HD2 LEU 114 3HD2 LEU 114 1.175 1.548 1.548 214 3HD2 LEU 114 2HD2 LEU 114 1.299 1.451 1.451 215 H ILE 115 H ILE 115 -1.555 -1.937 -1.937 216 HA ILE 115 HA ILE 115 -3.900 -0.505 -0.505 217 HB ILE 115 HB ILE 115 -3.356 -2.026 -2.026 218 1HG1 ILE 115 2HG1 ILE 115 -2.430 -3.562 -3.562 219 2HG1 ILE 115 1HG1 ILE 115 -3.876 -4.188 -4.188 220 1HG2 ILE 115 2HG2 ILE 115 -5.559 -1.507 -1.507 221 2HG2 ILE 115 1HG2 ILE 115 -5.740 -2.623 -2.623 222 3HG2 ILE 115 3HG2 ILE 115 -5.345 -0.886 -0.886 223 1HD1 ILE 115 2HD1 ILE 115 -5.308 -3.460 -3.460 224 2HD1 ILE 115 1HD1 ILE 115 -3.770 -2.908 -2.908 225 3HD1 ILE 115 3HD1 ILE 115 -4.052 -4.673 -4.673 226 H ARG 116 H ARG 116 -1.306 -0.887 -0.887 227 HA ARG 116 HA ARG 116 -2.183 0.580 0.580 228 1HB ARG 116 2HB ARG 116 -0.142 -0.876 -0.876 229 2HB ARG 116 1HB ARG 116 0.744 0.345 0.345 230 1HG ARG 116 2HG ARG 116 1.330 0.494 0.494 231 2HG ARG 116 1HG ARG 116 0.558 2.010 2.010 232 1HD ARG 116 2HD ARG 116 -1.618 1.269 1.269 233 2HD ARG 116 1HD ARG 116 -0.775 -0.232 -0.232 234 HE ARG 116 HE ARG 116 0.836 1.964 1.964 235 1HH1 ARG 116 1HH1 ARG 116 -2.503 0.801 0.801 236 2HH1 ARG 116 2HH1 ARG 116 -2.687 1.517 1.517 237 1HH2 ARG 116 1HH2 ARG 116 0.579 2.932 2.932 238 2HH2 ARG 116 2HH2 ARG 116 -0.909 2.747 2.747 239 H PHE 117 H PHE 117 -0.350 1.752 1.752 240 HA PHE 117 HA PHE 117 -0.027 4.312 4.312 241 1HB PHE 117 2HB PHE 117 -0.606 3.112 3.112 242 2HB PHE 117 1HB PHE 117 0.123 4.722 4.722 243 HD1 PHE 117 2HD PHE 117 1.636 2.760 2.760 244 HD2 PHE 117 1HD PHE 117 1.224 3.241 3.241 245 HE1 PHE 117 2HE PHE 117 3.959 2.006 2.006 246 HE2 PHE 117 1HE PHE 117 3.555 2.339 2.339 247 HZ PHE 117 HZ PHE 117 4.928 1.768 1.768 248 H LEU 118 H LEU 118 -2.736 2.909 2.909 249 HA LEU 118 HA LEU 118 -4.270 5.247 5.247 250 1HB LEU 118 2HB LEU 118 -4.671 2.322 2.322 251 2HB LEU 118 1HB LEU 118 -6.002 3.514 3.514 252 HG LEU 118 HG LEU 118 -3.335 4.375 4.375 253 1HD1 LEU 118 2HD1 LEU 118 -4.020 1.681 1.681 254 2HD1 LEU 118 1HD1 LEU 118 -4.474 2.630 2.630 255 3HD1 LEU 118 3HD1 LEU 118 -2.781 2.761 2.761 256 1HD2 LEU 118 2HD2 LEU 118 -5.505 5.530 5.530 257 2HD2 LEU 118 1HD2 LEU 118 -4.706 4.994 4.994 258 3HD2 LEU 118 3HD2 LEU 118 -6.120 4.085 4.085 259 H GLU 119 H GLU 119 -4.022 2.931 2.931 260 HA GLU 119 HA GLU 119 -6.499 3.495 3.495 261 1HB GLU 119 2HB GLU 119 -3.911 2.174 2.174 262 2HB GLU 119 1HB GLU 119 -5.148 2.641 2.641 263 1HG GLU 119 2HG GLU 119 -6.811 1.145 1.145 264 2HG GLU 119 1HG GLU 119 -5.702 0.769 0.769 265 H GLU 120 H GLU 120 -3.129 4.730 4.730 266 HA GLU 120 HA GLU 120 -3.672 6.567 6.567 267 1HB GLU 120 2HB GLU 120 -1.677 7.046 7.046 268 2HB GLU 120 1HB GLU 120 -1.699 7.813 7.813 269 1HG GLU 120 2HG GLU 120 -1.194 5.473 5.473 270 2HG GLU 120 1HG GLU 120 -0.918 4.925 4.925 271 H GLY 121 H GLY 121 -4.443 6.344 6.344 272 1HA GLY 121 2HA GLY 121 -5.742 7.557 7.557 273 2HA GLY 121 1HA GLY 121 -5.739 8.874 8.874 274 H ASP 122 H ASP 122 -3.546 7.051 7.051 275 HA ASP 122 HA ASP 122 -2.359 9.657 9.657 276 1HB ASP 122 2HB ASP 122 -0.830 7.041 7.041 277 2HB ASP 122 1HB ASP 122 -0.188 8.693 8.693 278 H LYS 123 H LYS 123 -1.359 9.467 9.467 279 HA LYS 123 HA LYS 123 -3.136 7.998 7.998 280 1HB LYS 123 2HB LYS 123 -3.402 10.415 10.415 281 2HB LYS 123 1HB LYS 123 -1.611 10.659 10.659 282 1HG LYS 123 2HG LYS 123 -2.902 9.093 9.093 283 2HG LYS 123 1HG LYS 123 -3.111 10.870 10.870 284 1HD LYS 123 2HD LYS 123 -1.120 11.192 11.192 285 2HD LYS 123 1HD LYS 123 -0.388 10.515 10.515 286 1HE LYS 123 2HE LYS 123 0.144 8.496 8.496 287 2HE LYS 123 1HE LYS 123 -1.325 8.520 8.520 288 1HZ LYS 123 2HZ LYS 123 -0.250 10.237 10.237 289 2HZ LYS 123 1HZ LYS 123 1.119 10.207 10.207 290 3HZ LYS 123 3HZ LYS 123 0.718 8.844 8.844 291 H ALA 124 H ALA 124 -2.148 6.149 6.149 292 HA ALA 124 HA ALA 124 0.747 6.144 6.144 293 1HB ALA 124 2HB ALA 124 -1.169 3.821 3.821 294 2HB ALA 124 1HB ALA 124 0.627 3.771 3.771 295 3HB ALA 124 3HB ALA 124 -0.506 4.343 4.343 296 H LYS 125 H LYS 125 2.001 6.125 6.125 297 HA LYS 125 HA LYS 125 0.577 5.825 5.825 298 1HB LYS 125 2HB LYS 125 2.138 7.874 7.874 299 2HB LYS 125 1HB LYS 125 3.478 6.722 6.722 300 1HG LYS 125 2HG LYS 125 3.366 6.135 6.135 301 2HG LYS 125 1HG LYS 125 2.063 7.363 7.363 302 1HD LYS 125 2HD LYS 125 4.891 7.938 7.938 303 2HD LYS 125 1HD LYS 125 4.439 8.097 8.097 304 1HE LYS 125 2HE LYS 125 2.748 9.839 9.839 305 2HE LYS 125 1HE LYS 125 3.239 9.757 9.757 306 1HZ LYS 125 2HZ LYS 125 5.010 10.423 10.423 307 2HZ LYS 125 1HZ LYS 125 4.347 11.519 11.519 308 3HZ LYS 125 3HZ LYS 125 5.467 10.353 10.353 309 H ILE 126 H ILE 126 0.648 3.845 3.845 310 HA ILE 126 HA ILE 126 2.726 2.045 2.045 311 HB ILE 126 HB ILE 126 0.877 1.878 1.878 312 1HG1 ILE 126 2HG1 ILE 126 -0.748 2.277 2.277 313 2HG1 ILE 126 1HG1 ILE 126 -0.632 0.500 0.500 314 1HG2 ILE 126 2HG2 ILE 126 2.442 -0.037 -0.037 315 2HG2 ILE 126 1HG2 ILE 126 1.178 -0.578 -0.578 316 3HG2 ILE 126 3HG2 ILE 126 2.682 0.222 0.222 317 1HD1 ILE 126 2HD1 ILE 126 0.989 0.621 0.621 318 2HD1 ILE 126 1HD1 ILE 126 0.277 2.258 2.258 319 3HD1 ILE 126 3HD1 ILE 126 -0.802 0.800 0.800 320 H THR 127 H THR 127 4.636 1.816 1.816 321 HA THR 127 HA THR 127 4.739 3.025 3.025 322 HB THR 127 HB THR 127 7.076 2.545 2.545 323 HG1 THR 127 1HG THR 127 5.741 4.939 4.939 324 1HG2 THR 127 1HG2 THR 127 6.629 3.847 3.847 325 2HG2 THR 127 3HG2 THR 127 8.151 4.063 4.063 326 3HG2 THR 127 2HG2 THR 127 7.679 2.421 2.421 327 H LEU 128 H LEU 128 4.525 1.465 1.465 328 HA LEU 128 HA LEU 128 5.373 -1.231 -1.231 329 1HB LEU 128 2HB LEU 128 3.452 -0.599 -0.599 330 2HB LEU 128 1HB LEU 128 4.730 -0.107 -0.107 331 HG LEU 128 HG LEU 128 5.580 -2.252 -2.252 332 1HD1 LEU 128 1HD1 LEU 128 3.590 -3.295 -3.295 333 2HD1 LEU 128 3HD1 LEU 128 4.427 -4.320 -4.320 334 3HD1 LEU 128 2HD1 LEU 128 5.398 -3.458 -3.458 335 1HD2 LEU 128 1HD2 LEU 128 3.437 -1.146 -1.146 336 2HD2 LEU 128 3HD2 LEU 128 3.781 -2.902 -2.902 337 3HD2 LEU 128 2HD2 LEU 128 2.537 -2.365 -2.365 338 H ARG 129 H ARG 129 7.177 -2.313 -2.313 339 HA ARG 129 HA ARG 129 9.080 -0.707 -0.707 340 1HB ARG 129 2HB ARG 129 9.749 -0.398 -0.398 341 2HB ARG 129 1HB ARG 129 9.671 -2.184 -2.184 342 1HG ARG 129 2HG ARG 129 11.560 -2.471 -2.471 343 2HG ARG 129 1HG ARG 129 11.395 -0.769 -0.769 344 1HD ARG 129 2HD ARG 129 13.403 -1.087 -1.087 345 2HD ARG 129 1HD ARG 129 12.170 -0.015 -0.015 346 HE ARG 129 HE ARG 129 11.677 -2.794 -2.794 347 1HH1 ARG 129 1HH1 ARG 129 13.916 -0.080 -0.080 348 2HH1 ARG 129 2HH1 ARG 129 14.348 -0.593 -0.593 349 1HH2 ARG 129 1HH2 ARG 129 12.270 -3.483 -3.483 350 2HH2 ARG 129 2HH2 ARG 129 13.401 -2.555 -2.555 351 H PHE 130 H PHE 130 8.836 -1.821 -1.821 352 HA PHE 130 HA PHE 130 8.025 -4.569 -4.569 353 1HB PHE 130 2HB PHE 130 9.047 -2.299 -2.299 354 2HB PHE 130 1HB PHE 130 8.663 -3.965 -3.965 355 HD1 PHE 130 1HD PHE 130 6.539 -4.927 -4.927 356 HD2 PHE 130 2HD PHE 130 7.381 -0.843 -0.843 357 HE1 PHE 130 1HE PHE 130 4.257 -4.257 -4.257 358 HE2 PHE 130 2HE PHE 130 5.054 -0.279 -0.279 359 HZ PHE 130 HZ PHE 130 3.472 -2.013 -2.013 360 H ARG 131 H ARG 131 9.429 -6.228 -6.228 361 HA ARG 131 HA ARG 131 12.226 -5.564 -5.564 362 1HB ARG 131 2HB ARG 131 11.074 -8.257 -8.257 363 2HB ARG 131 1HB ARG 131 12.749 -8.044 -8.044 364 1HG ARG 131 2HG ARG 131 11.565 -6.684 -6.684 365 2HG ARG 131 1HG ARG 131 12.578 -8.167 -8.167 366 1HD ARG 131 2HD ARG 131 13.531 -5.384 -5.384 367 2HD ARG 131 1HD ARG 131 13.944 -6.181 -6.181 368 HE ARG 131 HE ARG 131 14.552 -7.973 -7.973 369 1HH1 ARG 131 1HH1 ARG 131 15.629 -4.948 -4.948 370 2HH1 ARG 131 2HH1 ARG 131 17.290 -5.137 -5.137 371 1HH2 ARG 131 1HH2 ARG 131 16.807 -8.219 -8.219 372 2HH2 ARG 131 2HH2 ARG 131 17.969 -7.022 -7.022 373 H GLY 132 H GLY 132 9.801 -5.194 -5.194 374 1HA GLY 132 2HA GLY 132 9.469 -7.294 -7.294 375 2HA GLY 132 1HA GLY 132 8.666 -5.697 -5.697 376 H ARG 133 H ARG 133 8.908 -4.592 -4.592 377 HA ARG 133 HA ARG 133 11.226 -4.900 -4.900 378 1HB ARG 133 2HB ARG 133 8.962 -2.976 -2.976 379 2HB ARG 133 1HB ARG 133 10.070 -3.797 -3.797 380 1HG ARG 133 2HG ARG 133 8.909 -5.973 -5.973 381 2HG ARG 133 1HG ARG 133 7.878 -5.136 -5.136 382 1HD ARG 133 2HD ARG 133 6.948 -3.639 -3.639 383 2HD ARG 133 1HD ARG 133 7.791 -4.646 -4.646 384 HE ARG 133 HE ARG 133 6.544 -6.581 -6.581 385 1HH1 ARG 133 1HH1 ARG 133 5.311 -3.447 -3.447 386 2HH1 ARG 133 2HH1 ARG 133 3.660 -3.968 -3.968 387 1HH2 ARG 133 1HH2 ARG 133 4.314 -7.259 -7.259 388 2HH2 ARG 133 2HH2 ARG 133 3.086 -6.158 -6.158 389 H GLU 134 H GLU 134 11.206 -2.323 -2.323 390 HA GLU 134 HA GLU 134 12.474 -0.662 -0.662 391 1HB GLU 134 2HB GLU 134 11.386 -0.026 -0.026 392 2HB GLU 134 1HB GLU 134 12.316 1.131 1.131 393 1HG GLU 134 2HG GLU 134 13.344 -1.580 -1.580 394 2HG GLU 134 1HG GLU 134 13.756 0.055 0.055 395 H MET 135 H MET 135 9.797 0.694 0.694 396 HA MET 135 HA MET 135 8.341 1.243 1.243 397 1HB MET 135 2HB MET 135 7.604 1.767 1.767 398 2HB MET 135 1HB MET 135 6.493 2.017 2.017 399 1HG MET 135 2HG MET 135 8.238 3.522 3.522 400 2HG MET 135 1HG MET 135 9.187 3.426 3.426 401 1HE MET 135 1HE MET 135 8.336 5.973 5.973 402 2HE MET 135 3HE MET 135 9.275 5.968 5.968 403 3HE MET 135 2HE MET 135 7.860 7.062 7.062 404 H ALA 136 H ALA 136 7.340 -0.357 -0.357 405 HA ALA 136 HA ALA 136 7.622 -2.838 -2.838 406 1HB ALA 136 3HB ALA 136 8.312 -2.275 -2.275 407 2HB ALA 136 2HB ALA 136 6.581 -2.123 -2.123 408 3HB ALA 136 1HB ALA 136 7.263 -3.723 -3.723 409 H HIS 137 H HIS 137 5.617 -3.981 -3.981 410 HA HIS 137 HA HIS 137 4.186 -4.812 -4.812 411 1HB HIS 137 2HB HIS 137 3.839 -5.745 -5.745 412 2HB HIS 137 1HB HIS 137 3.026 -6.392 -6.392 413 HD1 HIS 137 1HD HIS 137 4.111 -8.429 -8.429 414 HD2 HIS 137 2HD HIS 137 6.895 -5.448 -5.448 415 HE1 HIS 137 1HE HIS 137 6.415 -9.256 -9.256 416 H GLN 138 H GLN 138 2.757 -3.812 -3.812 417 HA GLN 138 HA GLN 138 0.802 -3.190 -3.190 418 1HB GLN 138 2HB GLN 138 0.722 -1.521 -1.521 419 2HB GLN 138 1HB GLN 138 -0.294 -2.755 -2.755 420 1HG GLN 138 2HG GLN 138 -1.940 -2.587 -2.587 421 2HG GLN 138 1HG GLN 138 -0.922 -1.261 -1.261 422 1HE2 GLN 138 1HE2 GLN 138 -3.740 -1.312 -1.312 423 2HE2 GLN 138 2HE2 GLN 138 -3.805 -0.119 -0.119 424 H GLN 139 H GLN 139 1.815 -5.812 -5.812 425 HA GLN 139 HA GLN 139 -0.727 -7.229 -7.229 426 1HB GLN 139 2HB GLN 139 1.881 -8.454 -8.454 427 2HB GLN 139 1HB GLN 139 0.254 -9.182 -9.182 428 1HG GLN 139 2HG GLN 139 -0.452 -7.289 -7.289 429 2HG GLN 139 1HG GLN 139 1.302 -6.814 -6.814 430 1HE2 GLN 139 1HE2 GLN 139 2.910 -8.507 -8.507 431 2HE2 GLN 139 2HE2 GLN 139 2.482 -9.690 -9.690 432 H ILE 140 H ILE 140 2.864 -7.132 -7.132 433 HA ILE 140 HA ILE 140 3.273 -8.359 -8.359 434 HB ILE 140 HB ILE 140 4.823 -6.449 -6.449 435 1HG1 ILE 140 2HG1 ILE 140 4.906 -9.453 -9.453 436 2HG1 ILE 140 1HG1 ILE 140 4.341 -8.778 -8.778 437 1HG2 ILE 140 2HG2 ILE 140 5.340 -7.907 -7.907 438 2HG2 ILE 140 1HG2 ILE 140 6.630 -7.100 -7.100 439 3HG2 ILE 140 3HG2 ILE 140 5.356 -6.112 -6.112 440 1HD1 ILE 140 2HD1 ILE 140 6.612 -7.623 -7.623 441 2HD1 ILE 140 1HD1 ILE 140 7.192 -8.742 -8.742 442 3HD1 ILE 140 3HD1 ILE 140 6.581 -9.414 -9.414 443 H GLY 141 H GLY 141 2.344 -5.071 -5.071 444 1HA GLY 141 2HA GLY 141 2.492 -4.332 -4.332 445 2HA GLY 141 1HA GLY 141 1.728 -3.399 -3.399 446 H MET 142 H MET 142 -0.416 -4.859 -4.859 447 HA MET 142 HA MET 142 -1.860 -4.022 -4.022 448 1HB MET 142 2HB MET 142 -3.550 -3.499 -3.499 449 2HB MET 142 1HB MET 142 -2.115 -3.344 -3.344 450 1HG MET 142 2HG MET 142 -2.739 -5.741 -5.741 451 2HG MET 142 1HG MET 142 -4.096 -5.594 -5.594 452 1HE MET 142 1HE MET 142 -5.515 -6.370 -6.370 453 2HE MET 142 3HE MET 142 -5.641 -5.535 -5.535 454 3HE MET 142 2HE MET 142 -4.095 -6.314 -6.314 455 H GLU 143 H GLU 143 -0.763 -7.240 -7.240 456 HA GLU 143 HA GLU 143 -2.974 -8.193 -8.193 457 1HB GLU 143 2HB GLU 143 -0.858 -9.673 -9.673 458 2HB GLU 143 1HB GLU 143 -0.208 -9.252 -9.252 459 1HG GLU 143 2HG GLU 143 -1.244 -11.220 -11.220 460 2HG GLU 143 1HG GLU 143 -2.611 -10.158 -10.158 461 H VAL 144 H VAL 144 0.183 -6.974 -6.974 462 HA VAL 144 HA VAL 144 -0.246 -7.546 -7.546 463 HB VAL 144 HB VAL 144 1.765 -5.696 -5.696 464 1HG1 VAL 144 3HG1 VAL 144 1.379 -7.113 -7.113 465 2HG1 VAL 144 2HG1 VAL 144 2.969 -6.513 -6.513 466 3HG1 VAL 144 1HG1 VAL 144 1.626 -5.345 -5.345 467 1HG2 VAL 144 3HG2 VAL 144 1.162 -8.651 -8.651 468 2HG2 VAL 144 2HG2 VAL 144 1.759 -7.890 -7.890 469 3HG2 VAL 144 1HG2 VAL 144 2.898 -8.115 -8.115 470 H LEU 145 H LEU 145 -0.083 -4.450 -4.450 471 HA LEU 145 HA LEU 145 -0.819 -2.764 -2.764 472 1HB LEU 145 2HB LEU 145 -1.354 -2.828 -2.828 473 2HB LEU 145 1HB LEU 145 -1.746 -1.388 -1.388 474 HG LEU 145 HG LEU 145 1.011 -2.649 -2.649 475 1HD1 LEU 145 3HD1 LEU 145 -0.350 -0.017 -0.017 476 2HD1 LEU 145 2HD1 LEU 145 1.397 -0.390 -0.390 477 3HD1 LEU 145 1HD1 LEU 145 0.135 -1.411 -1.411 478 1HD2 LEU 145 2HD2 LEU 145 0.018 -0.563 -0.563 479 2HD2 LEU 145 1HD2 LEU 145 1.056 -1.983 -1.983 480 3HD2 LEU 145 3HD2 LEU 145 1.768 -0.574 -0.574 481 H ASN 146 H ASN 146 -2.971 -4.172 -4.172 482 HA ASN 146 HA ASN 146 -5.478 -3.336 -3.336 483 1HB ASN 146 2HB ASN 146 -4.319 -4.420 -4.420 484 2HB ASN 146 1HB ASN 146 -5.137 -5.895 -5.895 485 1HD2 ASN 146 2HD2 ASN 146 -5.924 -6.213 -6.213 486 2HD2 ASN 146 1HD2 ASN 146 -7.162 -5.334 -5.334 487 H ARG 147 H ARG 147 -3.544 -6.304 -6.304 488 HA ARG 147 HA ARG 147 -5.745 -7.194 -7.194 489 1HB ARG 147 2HB ARG 147 -4.415 -8.704 -8.704 490 2HB ARG 147 1HB ARG 147 -2.890 -7.903 -7.903 491 1HG ARG 147 2HG ARG 147 -2.909 -9.044 -9.044 492 2HG ARG 147 1HG ARG 147 -4.736 -9.175 -9.175 493 1HD ARG 147 2HD ARG 147 -3.506 -11.433 -11.433 494 2HD ARG 147 1HD ARG 147 -4.381 -10.980 -10.980 495 HE ARG 147 HE ARG 147 -1.833 -9.769 -9.769 496 1HH1 ARG 147 1HH2 ARG 147 -3.118 -13.084 -13.084 497 2HH1 ARG 147 2HH2 ARG 147 -1.690 -13.843 -13.843 498 1HH2 ARG 147 1HH1 ARG 147 0.092 -10.802 -10.802 499 2HH2 ARG 147 2HH1 ARG 147 0.165 -12.526 -12.526 500 H VAL 148 H VAL 148 -3.164 -4.744 -4.744 501 HA VAL 148 HA VAL 148 -3.070 -5.212 -5.212 502 HB VAL 148 HB VAL 148 -2.590 -2.581 -2.581 503 1HG1 VAL 148 2HG1 VAL 148 -2.610 -3.318 -3.318 504 2HG1 VAL 148 1HG1 VAL 148 -1.134 -4.261 -4.261 505 3HG1 VAL 148 3HG1 VAL 148 -1.135 -2.449 -2.449 506 1HG2 VAL 148 1HG2 VAL 148 -0.662 -4.916 -4.916 507 2HG2 VAL 148 3HG2 VAL 148 -1.327 -3.959 -3.959 508 3HG2 VAL 148 2HG2 VAL 148 -0.211 -3.177 -3.177 509 H LYS 149 H LYS 149 -4.804 -2.958 -2.958 510 HA LYS 149 HA LYS 149 -6.274 -1.515 -1.515 511 1HB LYS 149 2HB LYS 149 -6.265 -1.260 -1.260 512 2HB LYS 149 1HB LYS 149 -7.089 -2.864 -2.864 513 1HG LYS 149 2HG LYS 149 -9.068 -2.223 -2.223 514 2HG LYS 149 1HG LYS 149 -8.499 -0.666 -0.666 515 1HD LYS 149 2HD LYS 149 -8.787 -1.444 -1.444 516 2HD LYS 149 1HD LYS 149 -9.984 -0.460 -0.460 517 1HE LYS 149 2HE LYS 149 -8.745 1.453 1.453 518 2HE LYS 149 1HE LYS 149 -7.326 0.571 0.571 519 1HZ LYS 149 1HZ LYS 149 -8.801 0.086 0.086 520 2HZ LYS 149 3HZ LYS 149 -10.068 0.943 0.943 521 3HZ LYS 149 2HZ LYS 149 -8.656 1.756 1.756 522 H ASP 150 H ASP 150 -7.025 -4.797 -4.797 523 HA ASP 150 HA ASP 150 -9.610 -4.790 -4.790 524 1HB ASP 150 2HB ASP 150 -7.600 -6.806 -6.806 525 2HB ASP 150 1HB ASP 150 -9.224 -7.255 -7.255 526 H ASP 151 H ASP 151 -6.470 -6.282 -6.282 527 HA ASP 151 HA ASP 151 -8.061 -7.280 -7.280 528 1HB ASP 151 2HB ASP 151 -5.915 -8.282 -8.282 529 2HB ASP 151 1HB ASP 151 -5.051 -6.931 -6.931 530 H LEU 152 H LEU 152 -6.690 -4.012 -4.012 531 HA LEU 152 HA LEU 152 -6.654 -3.513 -3.513 532 1HB LEU 152 2HB LEU 152 -5.823 -2.038 -2.038 533 2HB LEU 152 1HB LEU 152 -7.072 -1.142 -1.142 534 HG LEU 152 HG LEU 152 -4.977 -0.301 -0.301 535 1HD1 LEU 152 3HD1 LEU 152 -6.515 -0.654 -0.654 536 2HD1 LEU 152 2HD1 LEU 152 -5.837 -2.277 -2.277 537 3HD1 LEU 152 1HD1 LEU 152 -4.814 -0.834 -0.834 538 1HD2 LEU 152 2HD2 LEU 152 -4.142 -3.170 -3.170 539 2HD2 LEU 152 1HD2 LEU 152 -3.433 -1.675 -1.675 540 3HD2 LEU 152 3HD2 LEU 152 -3.189 -2.019 -2.019 541 H GLN 153 H GLN 153 -8.817 -3.019 -3.019 542 HA GLN 153 HA GLN 153 -10.210 -1.171 -1.171 543 1HB GLN 153 2HB GLN 153 -10.307 -3.571 -3.571 544 2HB GLN 153 1HB GLN 153 -11.763 -3.723 -3.723 545 1HG GLN 153 2HG GLN 153 -12.654 -1.630 -1.630 546 2HG GLN 153 1HG GLN 153 -11.004 -1.529 -1.529 547 1HE2 GLN 153 1HE2 GLN 153 -13.336 -4.264 -4.264 548 2HE2 GLN 153 2HE2 GLN 153 -13.355 -4.871 -4.871 549 H GLU 154 H GLU 154 -10.642 -3.326 -3.326 550 HA GLU 154 HA GLU 154 -13.112 -2.809 -2.809 551 1HB GLU 154 2HB GLU 154 -10.615 -3.243 -3.243 552 2HB GLU 154 1HB GLU 154 -12.242 -3.917 -3.917 553 1HG GLU 154 2HG GLU 154 -11.747 -5.347 -5.347 554 2HG GLU 154 1HG GLU 154 -10.088 -4.603 -4.603 555 H LEU 155 H LEU 155 -10.030 -1.435 -1.435 556 HA LEU 155 HA LEU 155 -10.886 0.376 0.376 557 1HB LEU 155 2HB LEU 155 -9.446 -1.615 -1.615 558 2HB LEU 155 1HB LEU 155 -8.316 -1.086 -1.086 559 HG LEU 155 HG LEU 155 -7.462 -1.005 -1.005 560 1HD1 LEU 155 1HD1 LEU 155 -6.513 0.568 0.568 561 2HD1 LEU 155 3HD1 LEU 155 -7.570 1.898 1.898 562 3HD1 LEU 155 2HD1 LEU 155 -6.319 1.151 1.151 563 1HD2 LEU 155 3HD2 LEU 155 -9.369 -0.558 -0.558 564 2HD2 LEU 155 2HD2 LEU 155 -7.825 0.287 0.287 565 3HD2 LEU 155 1HD2 LEU 155 -9.205 1.219 1.219 566 H ALA 156 H ALA 156 -8.778 -0.080 -0.080 567 HA ALA 156 HA ALA 156 -8.199 2.894 2.894 568 1HB ALA 156 2HB ALA 156 -6.207 1.561 1.561 569 2HB ALA 156 1HB ALA 156 -6.652 0.874 0.874 570 3HB ALA 156 3HB ALA 156 -6.444 2.634 2.634 571 H VAL 157 H VAL 157 -9.217 3.812 3.812 572 HA VAL 157 HA VAL 157 -8.216 1.920 1.920 573 HB VAL 157 HB VAL 157 -9.921 2.528 2.528 574 1HG1 VAL 157 3HG1 VAL 157 -11.280 2.220 2.220 575 2HG1 VAL 157 2HG1 VAL 157 -12.081 2.026 2.026 576 3HG1 VAL 157 1HG1 VAL 157 -10.727 0.911 0.911 577 1HG2 VAL 157 3HG2 VAL 157 -10.187 5.024 5.024 578 2HG2 VAL 157 2HG2 VAL 157 -10.210 4.806 4.806 579 3HG2 VAL 157 1HG2 VAL 157 -11.680 4.408 4.408 580 H VAL 158 H VAL 158 -8.077 2.392 2.392 581 HA VAL 158 HA VAL 158 -5.978 4.222 4.222 582 HB VAL 158 HB VAL 158 -7.402 2.798 2.798 583 1HG1 VAL 158 2HG1 VAL 158 -5.295 3.993 3.993 584 2HG1 VAL 158 1HG1 VAL 158 -4.428 2.841 2.841 585 3HG1 VAL 158 3HG1 VAL 158 -5.312 2.218 2.218 586 1HG2 VAL 158 1HG2 VAL 158 -5.793 1.473 1.473 587 2HG2 VAL 158 3HG2 VAL 158 -7.464 1.034 1.034 588 3HG2 VAL 158 2HG2 VAL 158 -6.012 0.692 0.692 589 H GLU 159 H GLU 159 -5.831 5.878 5.878 590 HA GLU 159 HA GLU 159 -8.190 7.439 7.439 591 1HB GLU 159 2HB GLU 159 -5.940 8.249 8.249 592 2HB GLU 159 1HB GLU 159 -5.412 7.828 7.828 593 1HG GLU 159 2HG GLU 159 -6.999 9.620 9.620 594 2HG GLU 159 1HG GLU 159 -7.609 9.887 9.887 595 H SER 160 H SER 160 -5.902 5.664 5.664 596 HA SER 160 HA SER 160 -7.714 5.858 5.858 597 1HB SER 160 2HB SER 160 -5.845 7.731 7.731 598 2HB SER 160 1HB SER 160 -4.902 6.286 6.286 599 HG SER 160 HG SER 160 -5.887 7.509 7.509 600 H PHE 161 H PHE 161 -7.392 4.044 4.044 601 HA PHE 161 HA PHE 161 -5.043 2.402 2.402 602 1HB PHE 161 2HB PHE 161 -7.455 1.336 1.336 603 2HB PHE 161 1HB PHE 161 -7.248 1.183 1.183 604 HD1 PHE 161 1HD PHE 161 -5.224 0.180 0.180 605 HD2 PHE 161 2HD PHE 161 -6.371 -0.106 -0.106 606 HE1 PHE 161 1HE PHE 161 -3.337 -1.363 -1.363 607 HE2 PHE 161 2HE PHE 161 -4.729 -1.495 -1.495 608 HZ PHE 161 HZ PHE 161 -3.176 -2.378 -2.378 609 HA PRO 162 HA PRO 162 -5.047 4.586 4.586 610 1HB PRO 162 2HB PRO 162 -2.475 5.700 5.700 611 2HB PRO 162 1HB PRO 162 -3.861 6.329 6.329 612 1HG PRO 162 2HG PRO 162 -1.468 4.979 4.979 613 2HG PRO 162 1HG PRO 162 -2.817 5.842 5.842 614 1HD PRO 162 2HD PRO 162 -2.458 2.945 2.945 615 2HD PRO 162 1HD PRO 162 -3.433 3.631 3.631 616 H THR 163 H THR 163 -1.701 4.124 4.124 617 HA THR 163 HA THR 163 -1.808 1.867 1.867 618 HB THR 163 HB THR 163 -2.934 4.544 4.544 619 HG1 THR 163 1HG THR 163 -4.015 2.533 2.533 620 1HG2 THR 163 1HG2 THR 163 -0.854 3.229 3.229 621 2HG2 THR 163 3HG2 THR 163 -2.044 4.466 4.466 622 3HG2 THR 163 2HG2 THR 163 -0.926 4.935 4.935 623 H LYS 164 H LYS 164 -0.480 5.126 5.126 624 HA LYS 164 HA LYS 164 1.427 4.698 4.698 625 1HB LYS 164 2HB LYS 164 0.207 6.865 6.865 626 2HB LYS 164 1HB LYS 164 1.335 7.065 7.065 627 1HG LYS 164 2HG LYS 164 3.276 7.067 7.067 628 2HG LYS 164 1HG LYS 164 2.116 6.747 6.747 629 1HD LYS 164 2HD LYS 164 0.932 8.926 8.926 630 2HD LYS 164 1HD LYS 164 2.287 9.278 9.278 631 1HE LYS 164 2HE LYS 164 2.549 8.812 8.812 632 2HE LYS 164 1HE LYS 164 2.597 10.419 10.419 633 1HZ LYS 164 2HZ LYS 164 4.490 8.169 8.169 634 2HZ LYS 164 1HZ LYS 164 4.781 9.570 9.570 635 3HZ LYS 164 3HZ LYS 164 4.539 9.684 9.684 636 H ILE 165 H ILE 165 3.074 3.355 3.355 637 HA ILE 165 HA ILE 165 4.632 3.462 3.462 638 HB ILE 165 HB ILE 165 5.335 2.144 2.144 639 1HG1 ILE 165 2HG1 ILE 165 3.364 1.090 1.090 640 2HG1 ILE 165 1HG1 ILE 165 2.979 1.472 1.472 641 1HG2 ILE 165 2HG2 ILE 165 7.018 2.228 2.228 642 2HG2 ILE 165 1HG2 ILE 165 5.880 1.199 1.199 643 3HG2 ILE 165 3HG2 ILE 165 6.624 0.583 0.583 644 1HD1 ILE 165 2HD1 ILE 165 4.955 -0.736 -0.736 645 2HD1 ILE 165 1HD1 ILE 165 3.200 -0.978 -0.978 646 3HD1 ILE 165 3HD1 ILE 165 4.288 -0.357 -0.357 647 H GLU 166 H GLU 166 6.470 4.437 4.437 648 HA GLU 166 HA GLU 166 7.510 5.946 5.946 649 1HB GLU 166 2HB GLU 166 7.152 7.051 7.051 650 2HB GLU 166 1HB GLU 166 8.176 7.816 7.816 651 1HG GLU 166 2HG GLU 166 6.158 8.154 8.154 652 2HG GLU 166 1HG GLU 166 5.116 7.379 7.379 653 H GLY 167 H GLY 167 9.483 5.032 5.032 654 1HA GLY 167 2HA GLY 167 11.472 4.048 4.048 655 2HA GLY 167 1HA GLY 167 11.098 4.338 4.338 656 H ARG 168 H ARG 168 11.599 2.241 2.241 657 HA ARG 168 HA ARG 168 9.918 0.126 0.126 658 1HB ARG 168 2HB ARG 168 12.242 -0.098 -0.098 659 2HB ARG 168 1HB ARG 168 11.343 -1.466 -1.466 660 1HG ARG 168 2HG ARG 168 12.260 -0.598 -0.598 661 2HG ARG 168 1HG ARG 168 13.355 0.450 0.450 662 1HD ARG 168 2HD ARG 168 13.134 -2.635 -2.635 663 2HD ARG 168 1HD ARG 168 14.522 -1.686 -1.686 664 HE ARG 168 HE ARG 168 14.417 -0.691 -0.691 665 1HH1 ARG 168 1HH2 ARG 168 14.284 -4.058 -4.058 666 2HH1 ARG 168 2HH2 ARG 168 14.972 -4.738 -4.738 667 1HH2 ARG 168 1HH1 ARG 168 15.345 -1.630 -1.630 668 2HH2 ARG 168 2HH1 ARG 168 15.583 -3.342 -3.342 669 H GLN 169 H GLN 169 8.513 1.991 1.991 670 HA GLN 169 HA GLN 169 7.881 0.640 0.640 671 1HB GLN 169 2HB GLN 169 9.294 3.244 3.244 672 2HB GLN 169 1HB GLN 169 8.125 3.012 3.012 673 1HG GLN 169 2HG GLN 169 9.611 1.315 1.315 674 2HG GLN 169 1HG GLN 169 10.724 1.384 1.384 675 1HE2 GLN 169 1HE2 GLN 169 9.044 3.785 3.785 676 2HE2 GLN 169 2HE2 GLN 169 10.429 4.771 4.771 677 H MET 170 H MET 170 5.785 1.161 1.161 678 HA MET 170 HA MET 170 4.513 3.365 3.365 679 1HB MET 170 2HB MET 170 3.668 1.060 1.060 680 2HB MET 170 1HB MET 170 3.084 0.776 0.776 681 1HG MET 170 2HG MET 170 1.669 2.908 2.908 682 2HG MET 170 1HG MET 170 2.227 2.822 2.822 683 1HE MET 170 3HE MET 170 2.075 -0.635 -0.635 684 2HE MET 170 2HE MET 170 0.421 -1.034 -1.034 685 3HE MET 170 1HE MET 170 1.410 0.102 0.102 686 H ILE 171 H ILE 171 3.772 4.920 4.920 687 HA ILE 171 HA ILE 171 3.249 4.128 4.128 688 HB ILE 171 HB ILE 171 2.673 6.713 6.713 689 1HG1 ILE 171 2HG1 ILE 171 5.109 5.882 5.882 690 2HG1 ILE 171 1HG1 ILE 171 4.663 7.564 7.564 691 1HG2 ILE 171 3HG2 ILE 171 2.200 5.770 5.770 692 2HG2 ILE 171 2HG2 ILE 171 2.462 7.533 7.533 693 3HG2 ILE 171 1HG2 ILE 171 1.043 6.700 6.700 694 1HD1 ILE 171 2HD1 ILE 171 4.188 6.437 6.437 695 2HD1 ILE 171 1HD1 ILE 171 4.767 4.945 4.945 696 3HD1 ILE 171 3HD1 ILE 171 5.917 6.314 6.314 697 H MET 172 H MET 172 1.428 3.343 3.343 698 HA MET 172 HA MET 172 -1.167 4.130 4.130 699 1HB MET 172 2HB MET 172 -1.146 1.701 1.701 700 2HB MET 172 1HB MET 172 -0.218 1.636 1.636 701 1HG MET 172 2HG MET 172 -2.118 2.274 2.274 702 2HG MET 172 1HG MET 172 -3.002 2.884 2.884 703 1HE MET 172 2HE MET 172 -3.080 0.854 0.854 704 2HE MET 172 1HE MET 172 -3.764 -0.729 -0.729 705 3HE MET 172 3HE MET 172 -1.968 -0.458 -0.458 706 H VAL 173 H VAL 173 -2.263 5.470 5.470 707 HA VAL 173 HA VAL 173 -0.746 6.234 6.234 708 HB VAL 173 HB VAL 173 -3.285 7.472 7.472 709 1HG1 VAL 173 3HG1 VAL 173 -1.316 7.908 7.908 710 2HG1 VAL 173 2HG1 VAL 173 -1.951 9.425 9.425 711 3HG1 VAL 173 1HG1 VAL 173 -3.081 8.279 8.279 712 1HG2 VAL 173 2HG2 VAL 173 -0.307 8.097 8.097 713 2HG2 VAL 173 1HG2 VAL 173 -1.534 7.561 7.561 714 3HG2 VAL 173 3HG2 VAL 173 -1.679 9.176 9.176 715 H LEU 174 H LEU 174 -1.822 5.873 5.873 716 HA LEU 174 HA LEU 174 -4.587 4.584 4.584 717 1HB LEU 174 2HB LEU 174 -3.406 2.723 2.723 718 2HB LEU 174 1HB LEU 174 -2.041 3.447 3.447 719 HG LEU 174 HG LEU 174 -3.646 3.714 3.714 720 1HD1 LEU 174 1HD1 LEU 174 -5.216 2.349 2.349 721 2HD1 LEU 174 3HD1 LEU 174 -5.216 1.451 1.451 722 3HD1 LEU 174 2HD1 LEU 174 -5.786 3.191 3.191 723 1HD2 LEU 174 3HD2 LEU 174 -2.810 0.978 0.978 724 2HD2 LEU 174 2HD2 LEU 174 -1.824 2.168 2.168 725 3HD2 LEU 174 1HD2 LEU 174 -3.421 1.428 1.428 726 H ALA 175 H ALA 175 -5.959 5.383 5.383 727 HA ALA 175 HA ALA 175 -4.911 7.270 7.270 728 1HB ALA 175 3HB ALA 175 -7.270 7.258 7.258 729 2HB ALA 175 2HB ALA 175 -6.945 8.722 8.722 730 3HB ALA 175 1HB ALA 175 -5.779 8.292 8.292 731 HA PRO 176 HA PRO 176 -7.985 5.574 5.574 732 1HB PRO 176 2HB PRO 176 -9.256 8.309 8.309 733 2HB PRO 176 1HB PRO 176 -8.775 7.082 7.082 734 1HG PRO 176 2HG PRO 176 -7.181 9.264 9.264 735 2HG PRO 176 1HG PRO 176 -6.428 7.621 7.621 736 1HD PRO 176 2HD PRO 176 -7.003 9.177 9.177 737 2HD PRO 176 1HD PRO 176 -5.556 8.167 8.167 738 H LYS 177 H LYS 177 -10.072 4.583 4.583 739 HA LYS 177 HA LYS 177 -11.560 5.464 5.464 740 1HB LYS 177 2HB LYS 177 -11.429 3.022 3.022 741 2HB LYS 177 1HB LYS 177 -12.320 3.465 3.465 742 1HG LYS 177 2HG LYS 177 -14.326 4.102 4.102 743 2HG LYS 177 1HG LYS 177 -13.383 3.909 3.909 744 1HD LYS 177 2HD LYS 177 -14.967 2.056 2.056 745 2HD LYS 177 1HD LYS 177 -13.267 1.471 1.471 746 1HE LYS 177 2HE LYS 177 -13.194 1.205 1.205 747 2HE LYS 177 1HE LYS 177 -14.783 2.067 2.067 748 1HZ LYS 177 2HZ LYS 177 -14.357 -0.505 -0.505 749 2HZ LYS 177 1HZ LYS 177 -15.029 -0.303 -0.303 750 3HZ LYS 177 3HZ LYS 177 -15.838 0.308 0.308 751 H LYS 178 H LYS 178 -13.335 6.700 6.700 752 HA LYS 178 HA LYS 178 -13.947 8.198 8.198 753 1HB LYS 178 2HB LYS 178 -15.064 8.136 8.136 754 2HB LYS 178 1HB LYS 178 -15.649 9.285 9.285 755 1HG LYS 178 2HG LYS 178 -13.316 10.212 10.212 756 2HG LYS 178 1HG LYS 178 -12.783 9.090 9.090 757 1HD LYS 178 2HD LYS 178 -14.438 10.164 10.164 758 2HD LYS 178 1HD LYS 178 -14.931 11.291 11.291 759 1HE LYS 178 2HE LYS 178 -13.334 12.412 12.412 760 2HE LYS 178 1HE LYS 178 -12.554 12.187 12.187 761 1HZ LYS 178 3HZ LYS 178 -11.475 10.214 10.214 762 2HZ LYS 178 2HZ LYS 178 -12.190 10.458 10.458 763 3HZ LYS 178 1HZ LYS 178 -11.087 11.596 11.596 764 H LYS 179 H LYS 179 -15.011 6.973 6.973 765 HA LYS 179 HA LYS 179 -17.256 5.350 5.350 766 1HB LYS 179 2HB LYS 179 -16.002 5.827 5.827 767 2HB LYS 179 1HB LYS 179 -17.394 4.729 4.729 768 1HG LYS 179 2HG LYS 179 -15.958 3.366 3.366 769 2HG LYS 179 1HG LYS 179 -14.567 4.462 4.462 770 1HD LYS 179 2HD LYS 179 -14.627 3.850 3.850 771 2HD LYS 179 1HD LYS 179 -16.037 2.774 2.774 772 1HE LYS 179 2HE LYS 179 -13.929 1.444 1.444 773 2HE LYS 179 1HE LYS 179 -14.604 1.371 1.371 774 1HZ LYS 179 2HZ LYS 179 -13.060 3.107 3.107 775 2HZ LYS 179 1HZ LYS 179 -12.424 3.156 3.156 776 3HZ LYS 179 3HZ LYS 179 -12.250 1.755 1.755 777 H GLN 180 H GLN 180 -18.615 7.067 7.067 778 HA GLN 180 HA GLN 180 -19.264 9.153 9.153 779 1HB GLN 180 2HB GLN 180 -20.222 8.607 8.607 780 2HB GLN 180 1HB GLN 180 -20.702 10.029 10.029 781 1HG GLN 180 2HG GLN 180 -18.312 10.781 10.781 782 2HG GLN 180 1HG GLN 180 -17.809 9.340 9.340 783 1HE2 GLN 180 1HE2 GLN 180 -17.433 9.818 9.818 784 2HE2 GLN 180 2HE2 GLN 180 -18.319 10.935 10.935 Start of MODEL 13 1 HA VAL 90 HA VAL 90 -3.044 16.635 16.635 2 HB VAL 90 HB VAL 90 -4.465 16.369 16.369 3 1HG1 VAL 90 2HG1 VAL 90 -5.751 17.832 17.832 4 2HG1 VAL 90 1HG1 VAL 90 -6.565 16.327 16.327 5 3HG1 VAL 90 3HG1 VAL 90 -6.838 16.867 16.867 6 1HG2 VAL 90 3HG2 VAL 90 -5.820 14.011 14.011 7 2HG2 VAL 90 2HG2 VAL 90 -4.637 13.882 13.882 8 3HG2 VAL 90 1HG2 VAL 90 -6.247 14.602 14.602 9 H ILE 91 H ILE 91 -4.209 14.930 14.930 10 HA ILE 91 HA ILE 91 -3.047 12.315 12.315 11 HB ILE 91 HB ILE 91 -4.483 13.359 13.359 12 1HG1 ILE 91 2HG1 ILE 91 -5.995 13.384 13.384 13 2HG1 ILE 91 1HG1 ILE 91 -6.438 12.062 12.062 14 1HG2 ILE 91 1HG2 ILE 91 -3.002 11.313 11.313 15 2HG2 ILE 91 3HG2 ILE 91 -3.806 10.463 10.463 16 3HG2 ILE 91 2HG2 ILE 91 -4.746 10.923 10.923 17 1HD1 ILE 91 2HD1 ILE 91 -5.191 10.410 10.410 18 2HD1 ILE 91 1HD1 ILE 91 -4.796 11.721 11.721 19 3HD1 ILE 91 3HD1 ILE 91 -6.519 11.240 11.240 20 H GLN 92 H GLN 92 -1.068 11.845 11.845 21 HA GLN 92 HA GLN 92 0.609 13.694 13.694 22 1HB GLN 92 2HB GLN 92 1.322 11.363 11.363 23 2HB GLN 92 1HB GLN 92 2.409 12.719 12.719 24 1HG GLN 92 2HG GLN 92 1.231 14.247 14.247 25 2HG GLN 92 1HG GLN 92 -0.234 13.246 13.246 26 1HE2 GLN 92 1HE2 GLN 92 -0.647 11.975 11.975 27 2HE2 GLN 92 2HE2 GLN 92 0.473 11.429 11.429 28 H VAL 93 H VAL 93 2.452 12.588 12.588 29 HA VAL 93 HA VAL 93 1.437 10.069 10.069 30 HB VAL 93 HB VAL 93 3.492 12.013 12.013 31 1HG1 VAL 93 1HG1 VAL 93 3.075 9.021 9.021 32 2HG1 VAL 93 3HG1 VAL 93 3.892 10.154 10.154 33 3HG1 VAL 93 2HG1 VAL 93 4.686 9.780 9.780 34 1HG2 VAL 93 2HG2 VAL 93 0.962 11.968 11.968 35 2HG2 VAL 93 1HG2 VAL 93 2.067 11.625 11.625 36 3HG2 VAL 93 3HG2 VAL 93 1.257 10.250 10.250 37 H LYS 94 H LYS 94 1.907 8.382 8.382 38 HA LYS 94 HA LYS 94 4.862 8.051 8.051 39 1HB LYS 94 2HB LYS 94 2.809 6.137 6.137 40 2HB LYS 94 1HB LYS 94 4.555 6.219 6.219 41 1HG LYS 94 2HG LYS 94 2.513 8.439 8.439 42 2HG LYS 94 1HG LYS 94 2.999 7.196 7.196 43 1HD LYS 94 2HD LYS 94 5.333 7.963 7.963 44 2HD LYS 94 1HD LYS 94 4.955 9.205 9.205 45 1HE LYS 94 2HE LYS 94 3.341 10.311 10.311 46 2HE LYS 94 1HE LYS 94 3.765 9.089 9.089 47 1HZ LYS 94 1HZ LYS 94 5.651 10.972 10.972 48 2HZ LYS 94 3HZ LYS 94 4.999 11.126 11.126 49 3HZ LYS 94 2HZ LYS 94 6.043 9.836 9.836 50 H GLU 95 H GLU 95 5.430 5.563 5.563 51 HA GLU 95 HA GLU 95 4.210 4.824 4.824 52 1HB GLU 95 2HB GLU 95 6.313 6.317 6.317 53 2HB GLU 95 1HB GLU 95 7.118 4.855 4.855 54 1HG GLU 95 2HG GLU 95 6.630 3.619 3.619 55 2HG GLU 95 1HG GLU 95 5.724 5.064 5.064 56 H ILE 96 H ILE 96 4.624 2.540 2.540 57 HA ILE 96 HA ILE 96 6.350 0.972 0.972 58 HB ILE 96 HB ILE 96 3.638 0.751 0.751 59 1HG1 ILE 96 2HG1 ILE 96 4.073 -1.755 -1.755 60 2HG1 ILE 96 1HG1 ILE 96 5.779 -1.451 -1.451 61 1HG2 ILE 96 3HG2 ILE 96 3.212 0.283 0.283 62 2HG2 ILE 96 2HG2 ILE 96 4.088 -1.325 -1.325 63 3HG2 ILE 96 1HG2 ILE 96 2.670 -1.024 -1.024 64 1HD1 ILE 96 3HD1 ILE 96 4.158 0.036 0.036 65 2HD1 ILE 96 2HD1 ILE 96 5.397 -1.232 -1.232 66 3HD1 ILE 96 1HD1 ILE 96 5.889 0.361 0.361 67 H LYS 97 H LYS 97 6.954 -1.046 -1.046 68 HA LYS 97 HA LYS 97 6.315 -0.421 -0.421 69 1HB LYS 97 2HB LYS 97 8.726 -2.070 -2.070 70 2HB LYS 97 1HB LYS 97 8.186 -1.542 -1.542 71 1HG LYS 97 2HG LYS 97 8.550 0.874 0.874 72 2HG LYS 97 1HG LYS 97 9.205 0.257 0.257 73 1HD LYS 97 2HD LYS 97 10.945 -1.055 -1.055 74 2HD LYS 97 1HD LYS 97 10.387 -0.167 -0.167 75 1HE LYS 97 2HE LYS 97 11.530 1.098 1.098 76 2HE LYS 97 1HE LYS 97 12.399 0.947 0.947 77 1HZ LYS 97 3HZ LYS 97 9.885 2.465 2.465 78 2HZ LYS 97 2HZ LYS 97 11.445 3.124 3.124 79 3HZ LYS 97 1HZ LYS 97 10.734 2.353 2.353 80 H PHE 98 H PHE 98 6.069 -2.310 -2.310 81 HA PHE 98 HA PHE 98 5.756 -4.876 -4.876 82 1HB PHE 98 2HB PHE 98 3.436 -3.262 -3.262 83 2HB PHE 98 1HB PHE 98 3.444 -4.968 -4.968 84 HD1 PHE 98 1HD PHE 98 4.458 -5.641 -5.641 85 HD2 PHE 98 2HD PHE 98 1.597 -3.485 -3.485 86 HE1 PHE 98 1HE PHE 98 3.151 -5.502 -5.502 87 HE2 PHE 98 2HE PHE 98 0.280 -3.146 -3.146 88 HZ PHE 98 HZ PHE 98 0.918 -4.419 -4.419 89 H ARG 99 H ARG 99 7.381 -5.610 -5.610 90 HA ARG 99 HA ARG 99 7.673 -4.760 -4.760 91 1HB ARG 99 2HB ARG 99 9.150 -6.731 -6.731 92 2HB ARG 99 1HB ARG 99 9.669 -6.146 -6.146 93 1HG ARG 99 2HG ARG 99 9.519 -3.744 -3.744 94 2HG ARG 99 1HG ARG 99 9.515 -4.597 -4.597 95 1HD ARG 99 2HD ARG 99 11.828 -3.914 -3.914 96 2HD ARG 99 1HD ARG 99 11.730 -5.727 -5.727 97 HE ARG 99 HE ARG 99 11.059 -4.586 -4.586 98 1HH1 ARG 99 1HH2 ARG 99 13.822 -4.789 -4.789 99 2HH1 ARG 99 2HH2 ARG 99 15.025 -4.698 -4.698 100 1HH2 ARG 99 1HH1 ARG 99 12.694 -4.465 -4.465 101 2HH2 ARG 99 2HH1 ARG 99 14.374 -4.510 -4.510 102 HA PRO 100 HA PRO 100 6.102 -8.759 -8.759 103 1HB PRO 100 2HB PRO 100 8.087 -9.535 -9.535 104 2HB PRO 100 1HB PRO 100 6.682 -8.475 -8.475 105 1HG PRO 100 2HG PRO 100 9.552 -7.705 -7.705 106 2HG PRO 100 1HG PRO 100 8.415 -6.936 -6.936 107 1HD PRO 100 2HD PRO 100 9.019 -5.931 -5.931 108 2HD PRO 100 1HD PRO 100 7.395 -5.622 -5.622 109 H GLY 101 H GLY 101 6.436 -10.731 -10.731 110 1HA GLY 101 2HA GLY 101 7.636 -12.423 -12.423 111 2HA GLY 101 1HA GLY 101 9.093 -11.332 -11.332 112 H THR 102 H THR 102 6.555 -9.683 -9.683 113 HA THR 102 HA THR 102 6.694 -10.318 -10.318 114 HB THR 102 HB THR 102 5.564 -7.669 -7.669 115 HG1 THR 102 1HG THR 102 7.962 -8.356 -8.356 116 1HG2 THR 102 3HG2 THR 102 5.612 -9.345 -9.345 117 2HG2 THR 102 2HG2 THR 102 6.010 -7.584 -7.584 118 3HG2 THR 102 1HG2 THR 102 4.447 -8.067 -8.067 119 H ASP 103 H ASP 103 5.489 -12.027 -12.027 120 HA ASP 103 HA ASP 103 2.711 -11.475 -11.475 121 1HB ASP 103 2HB ASP 103 4.068 -12.850 -12.850 122 2HB ASP 103 1HB ASP 103 3.992 -14.089 -14.089 123 H GLU 104 H GLU 104 2.065 -14.286 -14.286 124 HA GLU 104 HA GLU 104 0.883 -12.559 -12.559 125 1HB GLU 104 2HB GLU 104 0.925 -15.568 -15.568 126 2HB GLU 104 1HB GLU 104 -0.226 -14.456 -14.456 127 1HG GLU 104 2HG GLU 104 -1.043 -13.620 -13.620 128 2HG GLU 104 1HG GLU 104 0.059 -14.776 -14.776 129 H GLY 105 H GLY 105 3.499 -14.764 -14.764 130 1HA GLY 105 2HA GLY 105 2.833 -13.987 -13.987 131 2HA GLY 105 1HA GLY 105 4.084 -15.212 -15.212 132 H ASP 106 H ASP 106 4.712 -12.646 -12.646 133 HA ASP 106 HA ASP 106 6.430 -11.322 -11.322 134 1HB ASP 106 2HB ASP 106 7.169 -12.184 -12.184 135 2HB ASP 106 1HB ASP 106 6.178 -10.945 -10.945 136 H TYR 107 H TYR 107 3.650 -11.251 -11.251 137 HA TYR 107 HA TYR 107 3.645 -8.378 -8.378 138 1HB TYR 107 2HB TYR 107 3.210 -10.073 -10.073 139 2HB TYR 107 1HB TYR 107 1.830 -10.721 -10.721 140 HD1 TYR 107 2HD TYR 107 1.920 -7.093 -7.093 141 HD2 TYR 107 1HD TYR 107 0.861 -10.773 -10.773 142 HE1 TYR 107 2HE TYR 107 -0.272 -6.141 -6.141 143 HE2 TYR 107 1HE TYR 107 -0.995 -9.663 -9.663 144 HH TYR 107 HH TYR 107 -2.000 -6.407 -6.407 145 H GLN 108 H GLN 108 0.770 -10.457 -10.457 146 HA GLN 108 HA GLN 108 -0.471 -8.578 -8.578 147 1HB GLN 108 2HB GLN 108 -1.176 -11.185 -11.185 148 2HB GLN 108 1HB GLN 108 -2.118 -9.882 -9.882 149 1HG GLN 108 2HG GLN 108 -0.352 -11.637 -11.637 150 2HG GLN 108 1HG GLN 108 -1.808 -12.249 -12.249 151 1HE2 GLN 108 1HE2 GLN 108 -0.895 -8.895 -8.895 152 2HE2 GLN 108 2HE2 GLN 108 -2.173 -8.750 -8.750 153 H VAL 109 H VAL 109 2.163 -10.109 -10.109 154 HA VAL 109 HA VAL 109 1.725 -9.506 -9.506 155 HB VAL 109 HB VAL 109 4.323 -9.529 -9.529 156 1HG1 VAL 109 2HG1 VAL 109 3.784 -9.435 -9.435 157 2HG1 VAL 109 1HG1 VAL 109 5.361 -9.913 -9.913 158 3HG1 VAL 109 3HG1 VAL 109 4.748 -8.252 -8.252 159 1HG2 VAL 109 3HG2 VAL 109 2.933 -11.668 -11.668 160 2HG2 VAL 109 2HG2 VAL 109 3.137 -11.709 -11.709 161 3HG2 VAL 109 1HG2 VAL 109 4.579 -11.803 -11.803 162 H LYS 110 H LYS 110 3.205 -7.665 -7.665 163 HA LYS 110 HA LYS 110 3.138 -5.277 -5.277 164 1HB LYS 110 2HB LYS 110 4.285 -5.913 -5.913 165 2HB LYS 110 1HB LYS 110 4.312 -4.290 -4.290 166 1HG LYS 110 2HG LYS 110 5.736 -6.837 -6.837 167 2HG LYS 110 1HG LYS 110 6.346 -5.146 -5.146 168 1HD LYS 110 2HD LYS 110 5.530 -4.345 -4.345 169 2HD LYS 110 1HD LYS 110 4.789 -5.948 -5.948 170 1HE LYS 110 2HE LYS 110 6.937 -5.674 -5.674 171 2HE LYS 110 1HE LYS 110 7.078 -7.001 -7.001 172 1HZ LYS 110 2HZ LYS 110 8.010 -4.196 -4.196 173 2HZ LYS 110 1HZ LYS 110 8.978 -5.552 -5.552 174 3HZ LYS 110 3HZ LYS 110 8.148 -5.443 -5.443 175 H LEU 111 H LEU 111 0.829 -6.764 -6.764 176 HA LEU 111 HA LEU 111 -0.407 -4.353 -4.353 177 1HB LEU 111 2HB LEU 111 -0.768 -6.632 -6.632 178 2HB LEU 111 1HB LEU 111 -1.629 -7.122 -7.122 179 HG LEU 111 HG LEU 111 -2.478 -4.662 -4.662 180 1HD1 LEU 111 3HD1 LEU 111 -2.129 -6.512 -6.512 181 2HD1 LEU 111 2HD1 LEU 111 -3.255 -7.555 -7.555 182 3HD1 LEU 111 1HD1 LEU 111 -3.865 -6.050 -6.050 183 1HD2 LEU 111 1HD2 LEU 111 -3.934 -6.863 -6.863 184 2HD2 LEU 111 3HD2 LEU 111 -3.720 -5.140 -5.140 185 3HD2 LEU 111 2HD2 LEU 111 -4.809 -5.570 -5.570 186 H ARG 112 H ARG 112 -0.089 -6.612 -6.612 187 HA ARG 112 HA ARG 112 -1.867 -5.279 -5.279 188 1HB ARG 112 2HB ARG 112 -0.885 -7.538 -7.538 189 2HB ARG 112 1HB ARG 112 0.588 -6.714 -6.714 190 1HG ARG 112 2HG ARG 112 -0.738 -5.546 -5.546 191 2HG ARG 112 1HG ARG 112 -2.260 -6.221 -6.221 192 1HD ARG 112 2HD ARG 112 -1.517 -8.536 -8.536 193 2HD ARG 112 1HD ARG 112 0.023 -7.867 -7.867 194 HE ARG 112 HE ARG 112 -2.068 -6.418 -6.418 195 1HH1 ARG 112 1HH1 ARG 112 -1.081 -9.833 -9.833 196 2HH1 ARG 112 2HH1 ARG 112 -1.743 -10.315 -10.315 197 1HH2 ARG 112 1HH2 ARG 112 -2.959 -7.082 -7.082 198 2HH2 ARG 112 2HH2 ARG 112 -2.825 -8.729 -8.729 199 H SER 113 H SER 113 1.772 -4.694 -4.694 200 HA SER 113 HA SER 113 2.028 -2.679 -2.679 201 1HB SER 113 2HB SER 113 3.864 -3.597 -3.597 202 2HB SER 113 1HB SER 113 3.294 -2.860 -2.860 203 HG SER 113 HG SER 113 3.941 -1.504 -1.504 204 H LEU 114 H LEU 114 0.684 -2.589 -2.589 205 HA LEU 114 HA LEU 114 0.380 0.155 0.155 206 1HB LEU 114 2HB LEU 114 -1.060 -2.149 -2.149 207 2HB LEU 114 1HB LEU 114 -1.507 -0.444 -0.444 208 HG LEU 114 HG LEU 114 1.372 -1.479 -1.479 209 1HD1 LEU 114 3HD1 LEU 114 -0.295 -2.744 -2.744 210 2HD1 LEU 114 2HD1 LEU 114 -0.872 -1.181 -1.181 211 3HD1 LEU 114 1HD1 LEU 114 0.814 -1.748 -1.748 212 1HD2 LEU 114 3HD2 LEU 114 -0.158 1.004 1.004 213 2HD2 LEU 114 2HD2 LEU 114 1.092 1.004 1.004 214 3HD2 LEU 114 1HD2 LEU 114 1.537 0.705 0.705 215 H ILE 115 H ILE 115 -1.936 -2.274 -2.274 216 HA ILE 115 HA ILE 115 -4.069 -0.573 -0.573 217 HB ILE 115 HB ILE 115 -3.484 -2.195 -2.195 218 1HG1 ILE 115 2HG1 ILE 115 -3.006 -3.800 -3.800 219 2HG1 ILE 115 1HG1 ILE 115 -4.495 -4.193 -4.193 220 1HG2 ILE 115 1HG2 ILE 115 -5.853 -1.258 -1.258 221 2HG2 ILE 115 3HG2 ILE 115 -6.038 -2.389 -2.389 222 3HG2 ILE 115 2HG2 ILE 115 -5.371 -0.738 -0.738 223 1HD1 ILE 115 3HD1 ILE 115 -5.855 -3.212 -3.212 224 2HD1 ILE 115 2HD1 ILE 115 -4.276 -2.963 -2.963 225 3HD1 ILE 115 1HD1 ILE 115 -4.860 -4.634 -4.634 226 H ARG 116 H ARG 116 -1.434 -1.114 -1.114 227 HA ARG 116 HA ARG 116 -2.011 0.610 0.610 228 1HB ARG 116 2HB ARG 116 0.069 -1.077 -1.077 229 2HB ARG 116 1HB ARG 116 0.881 0.459 0.459 230 1HG ARG 116 2HG ARG 116 1.317 -0.118 -0.118 231 2HG ARG 116 1HG ARG 116 0.300 1.363 1.363 232 1HD ARG 116 2HD ARG 116 -0.403 -0.297 -0.297 233 2HD ARG 116 1HD ARG 116 -1.724 -0.004 -0.004 234 HE ARG 116 HE ARG 116 0.021 -2.252 -2.252 235 1HH1 ARG 116 1HH1 ARG 116 -2.768 -1.232 -1.232 236 2HH1 ARG 116 2HH1 ARG 116 -3.525 -2.789 -2.789 237 1HH2 ARG 116 1HH2 ARG 116 -1.014 -4.349 -4.349 238 2HH2 ARG 116 2HH2 ARG 116 -2.513 -4.588 -4.588 239 H PHE 117 H PHE 117 -0.232 1.407 1.407 240 HA PHE 117 HA PHE 117 0.347 4.103 4.103 241 1HB PHE 117 2HB PHE 117 -0.045 2.622 2.622 242 2HB PHE 117 1HB PHE 117 0.148 4.448 4.448 243 HD1 PHE 117 1HD PHE 117 1.884 5.392 5.392 244 HD2 PHE 117 2HD PHE 117 1.659 1.271 1.271 245 HE1 PHE 117 1HE PHE 117 4.303 5.223 5.223 246 HE2 PHE 117 2HE PHE 117 4.028 0.990 0.990 247 HZ PHE 117 HZ PHE 117 5.348 2.993 2.993 248 H LEU 118 H LEU 118 -2.528 2.751 2.751 249 HA LEU 118 HA LEU 118 -3.838 5.209 5.209 250 1HB LEU 118 2HB LEU 118 -4.569 2.324 2.324 251 2HB LEU 118 1HB LEU 118 -5.764 3.639 3.639 252 HG LEU 118 HG LEU 118 -3.056 4.125 4.125 253 1HD1 LEU 118 2HD1 LEU 118 -3.795 1.501 1.501 254 2HD1 LEU 118 1HD1 LEU 118 -4.544 2.281 2.281 255 3HD1 LEU 118 3HD1 LEU 118 -2.768 2.518 2.518 256 1HD2 LEU 118 1HD2 LEU 118 -5.117 5.471 5.471 257 2HD2 LEU 118 3HD2 LEU 118 -4.412 4.750 4.750 258 3HD2 LEU 118 2HD2 LEU 118 -5.883 4.026 4.026 259 H GLU 119 H GLU 119 -3.752 3.029 3.029 260 HA GLU 119 HA GLU 119 -6.105 3.979 3.979 261 1HB GLU 119 2HB GLU 119 -3.761 2.259 2.259 262 2HB GLU 119 1HB GLU 119 -4.881 2.943 2.943 263 1HG GLU 119 2HG GLU 119 -6.814 1.822 1.822 264 2HG GLU 119 1HG GLU 119 -5.806 1.191 1.191 265 H GLU 120 H GLU 120 -2.603 4.779 4.779 266 HA GLU 120 HA GLU 120 -2.887 6.737 6.737 267 1HB GLU 120 2HB GLU 120 -0.913 6.937 6.937 268 2HB GLU 120 1HB GLU 120 -0.826 7.779 7.779 269 1HG GLU 120 2HG GLU 120 -0.238 4.815 4.815 270 2HG GLU 120 1HG GLU 120 0.878 6.088 6.088 271 H GLY 121 H GLY 121 -3.672 6.462 6.462 272 1HA GLY 121 2HA GLY 121 -4.934 7.726 7.726 273 2HA GLY 121 1HA GLY 121 -4.792 9.076 9.076 274 H ASP 122 H ASP 122 -2.991 7.127 7.127 275 HA ASP 122 HA ASP 122 -1.838 9.684 9.684 276 1HB ASP 122 2HB ASP 122 -0.343 7.034 7.034 277 2HB ASP 122 1HB ASP 122 0.329 8.634 8.634 278 H LYS 123 H LYS 123 -1.166 9.237 9.237 279 HA LYS 123 HA LYS 123 -2.805 7.019 7.019 280 1HB LYS 123 2HB LYS 123 -0.926 8.348 8.348 281 2HB LYS 123 1HB LYS 123 -2.414 7.435 7.435 282 1HG LYS 123 2HG LYS 123 -3.345 9.308 9.308 283 2HG LYS 123 1HG LYS 123 -3.489 9.695 9.695 284 1HD LYS 123 2HD LYS 123 -0.771 10.297 10.297 285 2HD LYS 123 1HD LYS 123 -2.007 11.086 11.086 286 1HE LYS 123 2HE LYS 123 -3.109 11.832 11.832 287 2HE LYS 123 1HE LYS 123 -1.495 11.329 11.329 288 1HZ LYS 123 1HZ LYS 123 -0.415 12.887 12.887 289 2HZ LYS 123 3HZ LYS 123 -1.899 13.350 13.350 290 3HZ LYS 123 2HZ LYS 123 -1.576 13.688 13.688 291 H ALA 124 H ALA 124 -1.705 5.131 5.131 292 HA ALA 124 HA ALA 124 1.219 5.442 5.442 293 1HB ALA 124 1HB ALA 124 -0.569 2.994 2.994 294 2HB ALA 124 3HB ALA 124 1.257 3.027 3.027 295 3HB ALA 124 2HB ALA 124 0.324 3.579 3.579 296 H LYS 125 H LYS 125 2.220 5.392 5.392 297 HA LYS 125 HA LYS 125 0.456 4.726 4.726 298 1HB LYS 125 2HB LYS 125 3.236 6.078 6.078 299 2HB LYS 125 1HB LYS 125 1.974 5.973 5.973 300 1HG LYS 125 2HG LYS 125 0.535 7.436 7.436 301 2HG LYS 125 1HG LYS 125 2.092 7.757 7.757 302 1HD LYS 125 2HD LYS 125 1.338 8.365 8.365 303 2HD LYS 125 1HD LYS 125 1.566 9.557 9.557 304 1HE LYS 125 2HE LYS 125 4.028 8.900 8.900 305 2HE LYS 125 1HE LYS 125 3.762 7.800 7.800 306 1HZ LYS 125 2HZ LYS 125 3.011 9.687 9.687 307 2HZ LYS 125 1HZ LYS 125 3.280 10.729 10.729 308 3HZ LYS 125 3HZ LYS 125 4.586 9.918 9.918 309 H ILE 126 H ILE 126 0.796 2.872 2.872 310 HA ILE 126 HA ILE 126 3.072 1.347 1.347 311 HB ILE 126 HB ILE 126 1.120 0.764 0.764 312 1HG1 ILE 126 2HG1 ILE 126 -0.377 1.404 1.404 313 2HG1 ILE 126 1HG1 ILE 126 -0.322 -0.392 -0.392 314 1HG2 ILE 126 3HG2 ILE 126 3.194 -0.686 -0.686 315 2HG2 ILE 126 2HG2 ILE 126 2.734 -0.868 -0.868 316 3HG2 ILE 126 1HG2 ILE 126 1.671 -1.545 -1.545 317 1HD1 ILE 126 3HD1 ILE 126 1.194 -0.275 -0.275 318 2HD1 ILE 126 2HD1 ILE 126 0.950 1.507 1.507 319 3HD1 ILE 126 1HD1 ILE 126 -0.462 0.417 0.417 320 H THR 127 H THR 127 4.911 1.284 1.284 321 HA THR 127 HA THR 127 4.927 2.517 2.517 322 HB THR 127 HB THR 127 7.240 1.797 1.797 323 HG1 THR 127 1HG THR 127 5.933 4.266 4.266 324 1HG2 THR 127 1HG2 THR 127 6.887 3.543 3.543 325 2HG2 THR 127 3HG2 THR 127 8.376 3.584 3.584 326 3HG2 THR 127 2HG2 THR 127 7.920 2.068 2.068 327 H LEU 128 H LEU 128 4.875 1.088 1.088 328 HA LEU 128 HA LEU 128 5.746 -1.662 -1.662 329 1HB LEU 128 2HB LEU 128 4.339 -0.174 -0.174 330 2HB LEU 128 1HB LEU 128 5.846 -0.796 -0.796 331 HG LEU 128 HG LEU 128 3.954 -2.331 -2.331 332 1HD1 LEU 128 3HD1 LEU 128 5.772 -3.559 -3.559 333 2HD1 LEU 128 2HD1 LEU 128 4.606 -4.461 -4.461 334 3HD1 LEU 128 1HD1 LEU 128 5.997 -3.574 -3.574 335 1HD2 LEU 128 2HD2 LEU 128 2.631 -1.277 -1.277 336 2HD2 LEU 128 1HD2 LEU 128 2.514 -3.087 -3.087 337 3HD2 LEU 128 3HD2 LEU 128 3.452 -2.054 -2.054 338 H ARG 129 H ARG 129 7.682 -2.458 -2.458 339 HA ARG 129 HA ARG 129 9.379 -0.486 -0.486 340 1HB ARG 129 2HB ARG 129 9.920 -0.386 -0.386 341 2HB ARG 129 1HB ARG 129 10.165 -2.154 -2.154 342 1HG ARG 129 2HG ARG 129 12.080 -1.969 -1.969 343 2HG ARG 129 1HG ARG 129 11.566 -0.341 -0.341 344 1HD ARG 129 2HD ARG 129 12.655 -0.983 -0.983 345 2HD ARG 129 1HD ARG 129 13.648 -0.307 -0.307 346 HE ARG 129 HE ARG 129 11.268 1.296 1.296 347 1HH1 ARG 129 1HH1 ARG 129 14.415 0.503 0.503 348 2HH1 ARG 129 2HH1 ARG 129 14.626 2.059 2.059 349 1HH2 ARG 129 1HH2 ARG 129 11.564 3.403 3.403 350 2HH2 ARG 129 2HH2 ARG 129 12.982 3.729 3.729 351 H PHE 130 H PHE 130 9.093 -1.436 -1.436 352 HA PHE 130 HA PHE 130 8.195 -4.147 -4.147 353 1HB PHE 130 2HB PHE 130 9.072 -1.953 -1.953 354 2HB PHE 130 1HB PHE 130 8.478 -3.621 -3.621 355 HD1 PHE 130 2HD PHE 130 6.356 -4.436 -4.436 356 HD2 PHE 130 1HD PHE 130 7.592 -0.424 -0.424 357 HE1 PHE 130 2HE PHE 130 4.011 -3.709 -3.709 358 HE2 PHE 130 1HE PHE 130 5.293 0.304 0.304 359 HZ PHE 130 HZ PHE 130 3.440 -1.383 -1.383 360 H ARG 131 H ARG 131 9.402 -5.870 -5.870 361 HA ARG 131 HA ARG 131 12.129 -5.445 -5.445 362 1HB ARG 131 2HB ARG 131 10.618 -8.046 -8.046 363 2HB ARG 131 1HB ARG 131 12.182 -7.996 -7.996 364 1HG ARG 131 2HG ARG 131 11.659 -7.055 -7.055 365 2HG ARG 131 1HG ARG 131 12.480 -8.573 -8.573 366 1HD ARG 131 2HD ARG 131 13.510 -5.699 -5.699 367 2HD ARG 131 1HD ARG 131 14.164 -6.900 -6.900 368 HE ARG 131 HE ARG 131 14.460 -8.374 -8.374 369 1HH1 ARG 131 1HH1 ARG 131 14.985 -4.850 -4.850 370 2HH1 ARG 131 2HH1 ARG 131 16.181 -4.781 -4.781 371 1HH2 ARG 131 1HH2 ARG 131 16.072 -8.253 -8.253 372 2HH2 ARG 131 2HH2 ARG 131 16.805 -6.736 -6.736 373 H GLY 132 H GLY 132 11.344 -4.289 -4.289 374 1HA GLY 132 2HA GLY 132 9.842 -5.779 -5.779 375 2HA GLY 132 1HA GLY 132 8.898 -4.637 -4.637 376 H ARG 133 H ARG 133 8.381 -3.114 -3.114 377 HA ARG 133 HA ARG 133 10.653 -1.872 -1.872 378 1HB ARG 133 2HB ARG 133 9.119 -3.725 -3.725 379 2HB ARG 133 1HB ARG 133 8.106 -2.274 -2.274 380 1HG ARG 133 2HG ARG 133 10.201 -1.129 -1.129 381 2HG ARG 133 1HG ARG 133 11.085 -2.671 -2.671 382 1HD ARG 133 2HD ARG 133 9.578 -3.813 -3.813 383 2HD ARG 133 1HD ARG 133 8.560 -2.309 -2.309 384 HE ARG 133 HE ARG 133 11.261 -1.566 -1.566 385 1HH1 ARG 133 1HH2 ARG 133 8.672 -3.633 -3.633 386 2HH1 ARG 133 2HH2 ARG 133 9.181 -3.461 -3.461 387 1HH2 ARG 133 1HH1 ARG 133 11.942 -1.341 -1.341 388 2HH2 ARG 133 2HH1 ARG 133 11.063 -2.140 -2.140 389 H GLU 134 H GLU 134 9.239 -0.084 -0.084 390 HA GLU 134 HA GLU 134 8.537 1.983 1.983 391 1HB GLU 134 2HB GLU 134 7.249 2.809 2.809 392 2HB GLU 134 1HB GLU 134 9.046 2.728 2.728 393 1HG GLU 134 2HG GLU 134 9.063 0.605 0.605 394 2HG GLU 134 1HG GLU 134 7.261 0.533 0.533 395 H MET 135 H MET 135 6.133 0.259 0.259 396 HA MET 135 HA MET 135 4.456 0.066 0.066 397 1HB MET 135 2HB MET 135 2.712 -0.892 -0.892 398 2HB MET 135 1HB MET 135 2.971 0.883 0.883 399 1HG MET 135 2HG MET 135 4.393 0.709 0.709 400 2HG MET 135 1HG MET 135 4.140 -1.063 -1.063 401 1HE MET 135 2HE MET 135 3.710 0.754 0.754 402 2HE MET 135 1HE MET 135 3.395 -1.016 -1.016 403 3HE MET 135 3HE MET 135 2.174 0.107 0.107 404 H ALA 136 H ALA 136 5.265 -1.719 -1.719 405 HA ALA 136 HA ALA 136 6.662 -3.658 -3.658 406 1HB ALA 136 3HB ALA 136 7.164 -3.096 -3.096 407 2HB ALA 136 2HB ALA 136 5.544 -3.684 -3.684 408 3HB ALA 136 1HB ALA 136 6.757 -4.845 -4.845 409 H HIS 137 H HIS 137 3.949 -3.431 -3.431 410 HA HIS 137 HA HIS 137 3.340 -6.244 -6.244 411 1HB HIS 137 2HB HIS 137 2.271 -5.851 -5.851 412 2HB HIS 137 1HB HIS 137 3.823 -4.937 -4.937 413 HD1 HIS 137 1HD HIS 137 0.106 -4.282 -4.282 414 HD2 HIS 137 2HD HIS 137 3.755 -2.314 -2.314 415 HE1 HIS 137 1HE HIS 137 -0.310 -1.784 -1.784 416 H GLN 138 H GLN 138 1.195 -7.123 -7.123 417 HA GLN 138 HA GLN 138 -0.765 -5.092 -5.092 418 1HB GLN 138 2HB GLN 138 -2.625 -6.602 -6.602 419 2HB GLN 138 1HB GLN 138 -1.544 -5.984 -5.984 420 1HG GLN 138 2HG GLN 138 -0.300 -8.158 -8.158 421 2HG GLN 138 1HG GLN 138 -1.377 -8.812 -8.812 422 1HE2 GLN 138 1HE2 GLN 138 -3.023 -10.000 -10.000 423 2HE2 GLN 138 2HE2 GLN 138 -3.866 -9.835 -9.835 424 H GLN 139 H GLN 139 1.237 -7.287 -7.287 425 HA GLN 139 HA GLN 139 -0.473 -8.841 -8.841 426 1HB GLN 139 2HB GLN 139 2.510 -9.444 -9.444 427 2HB GLN 139 1HB GLN 139 1.182 -10.556 -10.556 428 1HG GLN 139 2HG GLN 139 0.333 -10.079 -10.079 429 2HG GLN 139 1HG GLN 139 1.832 -9.057 -9.057 430 1HE2 GLN 139 1HE2 GLN 139 1.630 -11.052 -11.052 431 2HE2 GLN 139 2HE2 GLN 139 2.682 -12.378 -12.378 432 H ILE 140 H ILE 140 2.796 -7.332 -7.332 433 HA ILE 140 HA ILE 140 3.507 -7.823 -7.823 434 HB ILE 140 HB ILE 140 4.489 -5.765 -5.765 435 1HG1 ILE 140 2HG1 ILE 140 5.575 -8.564 -8.564 436 2HG1 ILE 140 1HG1 ILE 140 4.544 -8.200 -8.200 437 1HG2 ILE 140 3HG2 ILE 140 5.389 -6.776 -6.776 438 2HG2 ILE 140 2HG2 ILE 140 6.549 -6.065 -6.065 439 3HG2 ILE 140 1HG2 ILE 140 5.185 -5.083 -5.083 440 1HD1 ILE 140 1HD1 ILE 140 6.197 -6.513 -6.513 441 2HD1 ILE 140 3HD1 ILE 140 7.301 -6.936 -6.936 442 3HD1 ILE 140 2HD1 ILE 140 6.895 -8.173 -8.173 443 H GLY 141 H GLY 141 2.158 -4.834 -4.834 444 1HA GLY 141 2HA GLY 141 2.181 -3.656 -3.656 445 2HA GLY 141 1HA GLY 141 1.380 -3.035 -3.035 446 H MET 142 H MET 142 -0.413 -4.672 -4.672 447 HA MET 142 HA MET 142 -2.301 -3.867 -3.867 448 1HB MET 142 2HB MET 142 -2.607 -4.782 -4.782 449 2HB MET 142 1HB MET 142 -4.003 -4.170 -4.170 450 1HG MET 142 2HG MET 142 -2.697 -2.004 -2.004 451 2HG MET 142 1HG MET 142 -1.649 -2.449 -2.449 452 1HE MET 142 3HE MET 142 -2.179 -2.748 -2.748 453 2HE MET 142 2HE MET 142 -3.407 -4.022 -4.022 454 3HE MET 142 1HE MET 142 -3.802 -2.650 -2.650 455 H GLU 143 H GLU 143 -0.894 -6.907 -6.907 456 HA GLU 143 HA GLU 143 -3.339 -7.944 -7.944 457 1HB GLU 143 2HB GLU 143 -1.143 -9.408 -9.408 458 2HB GLU 143 1HB GLU 143 -0.638 -9.066 -9.066 459 1HG GLU 143 2HG GLU 143 -1.751 -11.097 -11.097 460 2HG GLU 143 1HG GLU 143 -3.108 -10.004 -10.004 461 H VAL 144 H VAL 144 -0.284 -6.662 -6.662 462 HA VAL 144 HA VAL 144 -0.703 -7.420 -7.420 463 HB VAL 144 HB VAL 144 1.273 -5.445 -5.445 464 1HG1 VAL 144 1HG1 VAL 144 0.825 -7.007 -7.007 465 2HG1 VAL 144 3HG1 VAL 144 2.455 -6.456 -6.456 466 3HG1 VAL 144 2HG1 VAL 144 1.149 -5.242 -5.242 467 1HG2 VAL 144 3HG2 VAL 144 0.778 -8.442 -8.442 468 2HG2 VAL 144 2HG2 VAL 144 1.292 -7.581 -7.581 469 3HG2 VAL 144 1HG2 VAL 144 2.494 -7.816 -7.816 470 H LEU 145 H LEU 145 -0.474 -4.254 -4.254 471 HA LEU 145 HA LEU 145 -1.422 -2.695 -2.695 472 1HB LEU 145 2HB LEU 145 -1.806 -2.469 -2.469 473 2HB LEU 145 1HB LEU 145 -2.045 -1.104 -1.104 474 HG LEU 145 HG LEU 145 0.546 -2.651 -2.651 475 1HD1 LEU 145 2HD1 LEU 145 -0.768 -0.152 -0.152 476 2HD1 LEU 145 1HD1 LEU 145 1.014 -0.080 -0.080 477 3HD1 LEU 145 3HD1 LEU 145 0.289 -1.355 -1.355 478 1HD2 LEU 145 1HD2 LEU 145 -0.220 -0.581 -0.581 479 2HD2 LEU 145 3HD2 LEU 145 0.567 -2.163 -2.163 480 3HD2 LEU 145 2HD2 LEU 145 1.510 -0.812 -0.812 481 H ASN 146 H ASN 146 -3.300 -4.051 -4.051 482 HA ASN 146 HA ASN 146 -5.894 -3.199 -3.199 483 1HB ASN 146 2HB ASN 146 -4.686 -4.563 -4.563 484 2HB ASN 146 1HB ASN 146 -5.658 -5.851 -5.851 485 1HD2 ASN 146 2HD2 ASN 146 -6.083 -5.929 -5.929 486 2HD2 ASN 146 1HD2 ASN 146 -7.509 -5.192 -5.192 487 H ARG 147 H ARG 147 -4.048 -6.197 -6.197 488 HA ARG 147 HA ARG 147 -6.324 -6.972 -6.972 489 1HB ARG 147 2HB ARG 147 -5.053 -8.586 -8.586 490 2HB ARG 147 1HB ARG 147 -3.501 -7.847 -7.847 491 1HG ARG 147 2HG ARG 147 -3.555 -8.966 -8.966 492 2HG ARG 147 1HG ARG 147 -5.388 -8.891 -8.891 493 1HD ARG 147 2HD ARG 147 -4.523 -11.265 -11.265 494 2HD ARG 147 1HD ARG 147 -5.378 -10.797 -10.797 495 HE ARG 147 HE ARG 147 -2.717 -10.035 -10.035 496 1HH1 ARG 147 1HH1 ARG 147 -4.367 -13.044 -13.044 497 2HH1 ARG 147 2HH1 ARG 147 -3.172 -14.093 -14.093 498 1HH2 ARG 147 1HH2 ARG 147 -1.116 -11.465 -11.465 499 2HH2 ARG 147 2HH2 ARG 147 -1.299 -13.183 -13.183 500 H VAL 148 H VAL 148 -3.677 -4.589 -4.589 501 HA VAL 148 HA VAL 148 -3.596 -5.256 -5.256 502 HB VAL 148 HB VAL 148 -3.041 -2.548 -2.548 503 1HG1 VAL 148 2HG1 VAL 148 -3.041 -3.605 -3.605 504 2HG1 VAL 148 1HG1 VAL 148 -1.542 -4.442 -4.442 505 3HG1 VAL 148 3HG1 VAL 148 -1.616 -2.628 -2.628 506 1HG2 VAL 148 1HG2 VAL 148 -1.190 -4.905 -4.905 507 2HG2 VAL 148 3HG2 VAL 148 -1.984 -3.882 -3.882 508 3HG2 VAL 148 2HG2 VAL 148 -0.749 -3.147 -3.147 509 H LYS 149 H LYS 149 -5.233 -2.691 -2.691 510 HA LYS 149 HA LYS 149 -6.677 -1.361 -1.361 511 1HB LYS 149 2HB LYS 149 -6.391 -0.970 -0.970 512 2HB LYS 149 1HB LYS 149 -7.188 -2.563 -2.563 513 1HG LYS 149 2HG LYS 149 -9.278 -1.911 -1.911 514 2HG LYS 149 1HG LYS 149 -8.815 -0.297 -0.297 515 1HD LYS 149 2HD LYS 149 -8.070 -1.034 -1.034 516 2HD LYS 149 1HD LYS 149 -9.896 -0.709 -0.709 517 1HE LYS 149 2HE LYS 149 -8.780 1.563 1.563 518 2HE LYS 149 1HE LYS 149 -7.530 1.050 1.050 519 1HZ LYS 149 3HZ LYS 149 -9.272 0.848 0.848 520 2HZ LYS 149 2HZ LYS 149 -10.468 1.262 1.262 521 3HZ LYS 149 1HZ LYS 149 -9.299 2.405 2.405 522 H ASP 150 H ASP 150 -7.408 -4.559 -4.559 523 HA ASP 150 HA ASP 150 -10.074 -4.508 -4.508 524 1HB ASP 150 2HB ASP 150 -8.180 -6.292 -6.292 525 2HB ASP 150 1HB ASP 150 -9.540 -7.015 -7.015 526 H ASP 151 H ASP 151 -7.039 -6.190 -6.190 527 HA ASP 151 HA ASP 151 -8.709 -7.157 -7.157 528 1HB ASP 151 2HB ASP 151 -6.511 -8.150 -8.150 529 2HB ASP 151 1HB ASP 151 -5.699 -6.882 -6.882 530 H LEU 152 H LEU 152 -7.129 -3.975 -3.975 531 HA LEU 152 HA LEU 152 -7.144 -3.506 -3.506 532 1HB LEU 152 2HB LEU 152 -6.139 -2.090 -2.090 533 2HB LEU 152 1HB LEU 152 -7.367 -1.107 -1.107 534 HG LEU 152 HG LEU 152 -5.196 -0.451 -0.451 535 1HD1 LEU 152 1HD1 LEU 152 -6.555 -2.124 -2.124 536 2HD1 LEU 152 3HD1 LEU 152 -5.274 -0.917 -0.917 537 3HD1 LEU 152 2HD1 LEU 152 -6.840 -0.410 -0.410 538 1HD2 LEU 152 1HD2 LEU 152 -4.730 -3.429 -3.429 539 2HD2 LEU 152 3HD2 LEU 152 -3.907 -2.216 -2.216 540 3HD2 LEU 152 2HD2 LEU 152 -3.610 -2.195 -2.195 541 H GLN 153 H GLN 153 -9.244 -2.876 -2.876 542 HA GLN 153 HA GLN 153 -10.673 -1.024 -1.024 543 1HB GLN 153 2HB GLN 153 -10.769 -3.416 -3.416 544 2HB GLN 153 1HB GLN 153 -12.209 -3.579 -3.579 545 1HG GLN 153 2HG GLN 153 -13.086 -1.434 -1.434 546 2HG GLN 153 1HG GLN 153 -11.444 -1.365 -1.365 547 1HE2 GLN 153 1HE2 GLN 153 -11.532 -1.984 -1.984 548 2HE2 GLN 153 2HE2 GLN 153 -12.414 -3.330 -3.330 549 H GLU 154 H GLU 154 -10.922 -3.081 -3.081 550 HA GLU 154 HA GLU 154 -13.405 -2.476 -2.476 551 1HB GLU 154 2HB GLU 154 -10.931 -2.812 -2.812 552 2HB GLU 154 1HB GLU 154 -12.568 -3.462 -3.462 553 1HG GLU 154 2HG GLU 154 -12.046 -5.095 -5.095 554 2HG GLU 154 1HG GLU 154 -10.408 -4.312 -4.312 555 H LEU 155 H LEU 155 -10.234 -1.193 -1.193 556 HA LEU 155 HA LEU 155 -11.241 0.958 0.958 557 1HB LEU 155 2HB LEU 155 -9.632 -0.804 -0.804 558 2HB LEU 155 1HB LEU 155 -8.424 -0.238 -0.238 559 HG LEU 155 HG LEU 155 -9.483 1.949 1.949 560 1HD1 LEU 155 3HD1 LEU 155 -9.741 0.059 0.059 561 2HD1 LEU 155 2HD1 LEU 155 -8.017 -0.410 -0.410 562 3HD1 LEU 155 1HD1 LEU 155 -8.417 1.178 1.178 563 1HD2 LEU 155 3HD2 LEU 155 -6.652 0.817 0.817 564 2HD2 LEU 155 2HD2 LEU 155 -7.432 2.196 2.196 565 3HD2 LEU 155 1HD2 LEU 155 -7.017 2.343 2.343 566 H ALA 156 H ALA 156 -8.943 0.125 0.125 567 HA ALA 156 HA ALA 156 -8.368 3.030 3.030 568 1HB ALA 156 2HB ALA 156 -6.421 1.821 1.821 569 2HB ALA 156 1HB ALA 156 -6.811 0.796 0.796 570 3HB ALA 156 3HB ALA 156 -6.602 2.553 2.553 571 H VAL 157 H VAL 157 -9.404 3.777 3.777 572 HA VAL 157 HA VAL 157 -8.208 1.920 1.920 573 HB VAL 157 HB VAL 157 -9.824 2.632 2.632 574 1HG1 VAL 157 2HG1 VAL 157 -11.229 1.918 1.918 575 2HG1 VAL 157 1HG1 VAL 157 -11.992 1.819 1.819 576 3HG1 VAL 157 3HG1 VAL 157 -10.564 0.779 0.779 577 1HG2 VAL 157 1HG2 VAL 157 -10.062 5.180 5.180 578 2HG2 VAL 157 3HG2 VAL 157 -11.422 4.389 4.389 579 3HG2 VAL 157 2HG2 VAL 157 -11.374 4.353 4.353 580 H VAL 158 H VAL 158 -7.913 2.431 2.431 581 HA VAL 158 HA VAL 158 -5.970 4.433 4.433 582 HB VAL 158 HB VAL 158 -7.276 2.992 2.992 583 1HG1 VAL 158 3HG1 VAL 158 -5.294 4.486 4.486 584 2HG1 VAL 158 2HG1 VAL 158 -4.326 3.366 3.366 585 3HG1 VAL 158 1HG1 VAL 158 -5.135 2.757 2.757 586 1HG2 VAL 158 3HG2 VAL 158 -6.959 1.182 1.182 587 2HG2 VAL 158 2HG2 VAL 158 -5.878 0.932 0.932 588 3HG2 VAL 158 1HG2 VAL 158 -5.223 1.682 1.682 589 H GLU 159 H GLU 159 -5.811 6.064 6.064 590 HA GLU 159 HA GLU 159 -8.111 7.674 7.674 591 1HB GLU 159 2HB GLU 159 -5.876 8.433 8.433 592 2HB GLU 159 1HB GLU 159 -5.247 7.857 7.857 593 1HG GLU 159 2HG GLU 159 -6.552 9.700 9.700 594 2HG GLU 159 1HG GLU 159 -7.336 10.125 10.125 595 H SER 160 H SER 160 -5.840 5.783 5.783 596 HA SER 160 HA SER 160 -7.580 6.110 6.110 597 1HB SER 160 2HB SER 160 -5.552 7.843 7.843 598 2HB SER 160 1HB SER 160 -4.750 6.340 6.340 599 HG SER 160 HG SER 160 -6.310 6.289 6.289 600 H PHE 161 H PHE 161 -7.387 4.225 4.225 601 HA PHE 161 HA PHE 161 -5.275 2.389 2.389 602 1HB PHE 161 2HB PHE 161 -7.687 1.603 1.603 603 2HB PHE 161 1HB PHE 161 -7.858 1.215 1.215 604 HD1 PHE 161 2HD PHE 161 -5.810 0.906 0.906 605 HD2 PHE 161 1HD PHE 161 -6.968 -0.954 -0.954 606 HE1 PHE 161 2HE PHE 161 -4.019 -0.596 -0.596 607 HE2 PHE 161 1HE PHE 161 -5.067 -2.447 -2.447 608 HZ PHE 161 HZ PHE 161 -3.497 -2.236 -2.236 609 HA PRO 162 HA PRO 162 -5.235 3.298 3.298 610 1HB PRO 162 2HB PRO 162 -3.459 5.355 5.355 611 2HB PRO 162 1HB PRO 162 -4.907 5.383 5.383 612 1HG PRO 162 2HG PRO 162 -2.046 4.784 4.784 613 2HG PRO 162 1HG PRO 162 -3.381 5.527 5.527 614 1HD PRO 162 2HD PRO 162 -2.539 2.733 2.733 615 2HD PRO 162 1HD PRO 162 -3.693 3.299 3.299 616 H THR 163 H THR 163 -2.039 4.107 4.107 617 HA THR 163 HA THR 163 -1.564 2.175 2.175 618 HB THR 163 HB THR 163 -3.446 4.391 4.391 619 HG1 THR 163 1HG THR 163 -3.983 3.289 3.289 620 1HG2 THR 163 3HG2 THR 163 -1.208 4.225 4.225 621 2HG2 THR 163 2HG2 THR 163 -2.737 5.182 5.182 622 3HG2 THR 163 1HG2 THR 163 -1.645 5.614 5.614 623 H LYS 164 H LYS 164 -0.813 5.246 5.246 624 HA LYS 164 HA LYS 164 1.128 5.851 5.851 625 1HB LYS 164 2HB LYS 164 0.441 7.175 7.175 626 2HB LYS 164 1HB LYS 164 1.565 7.849 7.849 627 1HG LYS 164 2HG LYS 164 -0.330 7.970 7.970 628 2HG LYS 164 1HG LYS 164 -1.421 7.230 7.230 629 1HD LYS 164 2HD LYS 164 -1.942 9.505 9.505 630 2HD LYS 164 1HD LYS 164 -0.996 9.240 9.240 631 1HE LYS 164 2HE LYS 164 0.230 10.369 10.369 632 2HE LYS 164 1HE LYS 164 -0.520 11.406 11.406 633 1HZ LYS 164 3HZ LYS 164 1.056 10.548 10.548 634 2HZ LYS 164 2HZ LYS 164 1.775 9.567 9.567 635 3HZ LYS 164 1HZ LYS 164 1.840 11.258 11.258 636 H ILE 165 H ILE 165 2.818 4.292 4.292 637 HA ILE 165 HA ILE 165 4.258 4.004 4.004 638 HB ILE 165 HB ILE 165 5.201 3.293 3.293 639 1HG1 ILE 165 2HG1 ILE 165 2.836 2.090 2.090 640 2HG1 ILE 165 1HG1 ILE 165 3.095 2.364 2.364 641 1HG2 ILE 165 3HG2 ILE 165 6.751 3.018 3.018 642 2HG2 ILE 165 2HG2 ILE 165 5.535 2.040 2.040 643 3HG2 ILE 165 1HG2 ILE 165 6.315 1.409 1.409 644 1HD1 ILE 165 2HD1 ILE 165 4.889 0.379 0.379 645 2HD1 ILE 165 1HD1 ILE 165 4.015 0.091 0.091 646 3HD1 ILE 165 3HD1 ILE 165 3.137 0.007 0.007 647 H GLU 166 H GLU 166 6.123 4.948 4.948 648 HA GLU 166 HA GLU 166 6.912 7.248 7.248 649 1HB GLU 166 2HB GLU 166 7.367 6.691 6.691 650 2HB GLU 166 1HB GLU 166 8.040 8.100 8.100 651 1HG GLU 166 2HG GLU 166 5.722 8.928 8.928 652 2HG GLU 166 1HG GLU 166 5.028 7.503 7.503 653 H GLY 167 H GLY 167 8.361 6.132 6.132 654 1HA GLY 167 2HA GLY 167 10.365 5.085 5.085 655 2HA GLY 167 1HA GLY 167 10.670 5.004 5.004 656 H ARG 168 H ARG 168 11.081 3.053 3.053 657 HA ARG 168 HA ARG 168 9.271 0.960 0.960 658 1HB ARG 168 2HB ARG 168 12.084 0.622 0.622 659 2HB ARG 168 1HB ARG 168 11.007 -0.690 -0.690 660 1HG ARG 168 2HG ARG 168 12.643 -0.505 -0.505 661 2HG ARG 168 1HG ARG 168 11.170 0.235 0.235 662 1HD ARG 168 2HD ARG 168 13.294 1.469 1.469 663 2HD ARG 168 1HD ARG 168 12.141 2.514 2.514 664 HE ARG 168 HE ARG 168 14.229 1.001 1.001 665 1HH1 ARG 168 1HH1 ARG 168 13.076 4.107 4.107 666 2HH1 ARG 168 2HH1 ARG 168 14.094 5.074 5.074 667 1HH2 ARG 168 1HH2 ARG 168 15.583 2.326 2.326 668 2HH2 ARG 168 2HH2 ARG 168 15.534 4.052 4.052 669 H GLN 169 H GLN 169 8.246 2.567 2.567 670 HA GLN 169 HA GLN 169 8.237 0.922 0.922 671 1HB GLN 169 2HB GLN 169 10.445 2.226 2.226 672 2HB GLN 169 1HB GLN 169 9.426 3.666 3.666 673 1HG GLN 169 2HG GLN 169 8.384 2.986 2.986 674 2HG GLN 169 1HG GLN 169 9.567 1.619 1.619 675 1HE2 GLN 169 1HE2 GLN 169 9.005 4.688 4.688 676 2HE2 GLN 169 2HE2 GLN 169 10.616 5.276 5.276 677 H MET 170 H MET 170 6.036 1.114 1.114 678 HA MET 170 HA MET 170 4.640 3.505 3.505 679 1HB MET 170 2HB MET 170 3.726 1.385 1.385 680 2HB MET 170 1HB MET 170 3.387 0.716 0.716 681 1HG MET 170 2HG MET 170 1.609 2.190 2.190 682 2HG MET 170 1HG MET 170 2.192 3.365 3.365 683 1HE MET 170 2HE MET 170 1.270 -0.522 -0.522 684 2HE MET 170 1HE MET 170 -0.254 0.320 0.320 685 3HE MET 170 3HE MET 170 -0.162 -0.519 -0.519 686 H ILE 171 H ILE 171 3.927 4.897 4.897 687 HA ILE 171 HA ILE 171 3.298 3.758 3.758 688 HB ILE 171 HB ILE 171 2.703 6.539 6.539 689 1HG1 ILE 171 2HG1 ILE 171 5.182 5.663 5.663 690 2HG1 ILE 171 1HG1 ILE 171 4.722 7.259 7.259 691 1HG2 ILE 171 3HG2 ILE 171 2.413 5.082 5.082 692 2HG2 ILE 171 2HG2 ILE 171 2.603 6.900 6.900 693 3HG2 ILE 171 1HG2 ILE 171 1.184 6.162 6.162 694 1HD1 ILE 171 1HD1 ILE 171 4.747 4.540 4.540 695 2HD1 ILE 171 3HD1 ILE 171 6.086 5.747 5.747 696 3HD1 ILE 171 2HD1 ILE 171 4.446 6.080 6.080 697 H MET 172 H MET 172 1.400 2.906 2.906 698 HA MET 172 HA MET 172 -1.170 3.952 3.952 699 1HB MET 172 2HB MET 172 -1.288 1.532 1.532 700 2HB MET 172 1HB MET 172 -0.386 1.350 1.350 701 1HG MET 172 2HG MET 172 -3.023 2.787 2.787 702 2HG MET 172 1HG MET 172 -3.118 1.037 1.037 703 1HE MET 172 2HE MET 172 -3.800 -0.277 -0.277 704 2HE MET 172 1HE MET 172 -2.055 -0.722 -0.722 705 3HE MET 172 3HE MET 172 -2.731 -0.292 -0.292 706 H VAL 173 H VAL 173 -2.234 5.268 5.268 707 HA VAL 173 HA VAL 173 -0.629 5.816 5.816 708 HB VAL 173 HB VAL 173 -3.056 7.328 7.328 709 1HG1 VAL 173 2HG1 VAL 173 -1.241 7.223 7.223 710 2HG1 VAL 173 1HG1 VAL 173 -1.254 8.886 8.886 711 3HG1 VAL 173 3HG1 VAL 173 -2.794 8.131 8.131 712 1HG2 VAL 173 2HG2 VAL 173 -0.091 7.737 7.737 713 2HG2 VAL 173 1HG2 VAL 173 -1.472 7.418 7.418 714 3HG2 VAL 173 3HG2 VAL 173 -1.387 8.975 8.975 715 H LEU 174 H LEU 174 -1.567 4.924 4.924 716 HA LEU 174 HA LEU 174 -4.388 3.785 3.785 717 1HB LEU 174 2HB LEU 174 -3.325 1.922 1.922 718 2HB LEU 174 1HB LEU 174 -1.994 2.640 2.640 719 HG LEU 174 HG LEU 174 -3.736 2.959 2.959 720 1HD1 LEU 174 1HD1 LEU 174 -5.229 1.522 1.522 721 2HD1 LEU 174 3HD1 LEU 174 -5.553 1.055 1.055 722 3HD1 LEU 174 2HD1 LEU 174 -5.780 2.787 2.787 723 1HD2 LEU 174 3HD2 LEU 174 -3.078 0.163 0.163 724 2HD2 LEU 174 2HD2 LEU 174 -2.066 1.297 1.297 725 3HD2 LEU 174 1HD2 LEU 174 -3.773 0.758 0.758 726 H ALA 175 H ALA 175 -5.687 5.581 5.581 727 HA ALA 175 HA ALA 175 -4.640 6.992 6.992 728 1HB ALA 175 1HB ALA 175 -5.734 8.043 8.043 729 2HB ALA 175 3HB ALA 175 -7.277 7.229 7.229 730 3HB ALA 175 2HB ALA 175 -6.534 8.622 8.622 731 HA PRO 176 HA PRO 176 -7.800 5.566 5.566 732 1HB PRO 176 2HB PRO 176 -8.780 8.451 8.451 733 2HB PRO 176 1HB PRO 176 -8.465 7.286 7.286 734 1HG PRO 176 2HG PRO 176 -6.666 9.283 9.283 735 2HG PRO 176 1HG PRO 176 -6.084 7.613 7.613 736 1HD PRO 176 2HD PRO 176 -6.217 8.922 8.922 737 2HD PRO 176 1HD PRO 176 -5.067 7.704 7.704 738 H LYS 177 H LYS 177 -10.084 4.977 4.977 739 HA LYS 177 HA LYS 177 -11.049 5.414 5.414 740 1HB LYS 177 2HB LYS 177 -11.650 3.438 3.438 741 2HB LYS 177 1HB LYS 177 -12.703 4.575 4.575 742 1HG LYS 177 2HG LYS 177 -13.914 4.940 4.940 743 2HG LYS 177 1HG LYS 177 -13.054 3.445 3.445 744 1HD LYS 177 2HD LYS 177 -14.886 3.764 3.764 745 2HD LYS 177 1HD LYS 177 -15.444 3.198 3.198 746 1HE LYS 177 2HE LYS 177 -13.900 1.269 1.269 747 2HE LYS 177 1HE LYS 177 -13.304 1.774 1.774 748 1HZ LYS 177 1HZ LYS 177 -16.102 1.058 1.058 749 2HZ LYS 177 3HZ LYS 177 -14.987 0.095 0.095 750 3HZ LYS 177 2HZ LYS 177 -15.551 1.542 1.542 751 H LYS 178 H LYS 178 -11.981 6.960 6.960 752 HA LYS 178 HA LYS 178 -12.965 9.281 9.281 753 1HB LYS 178 2HB LYS 178 -13.327 9.859 9.859 754 2HB LYS 178 1HB LYS 178 -11.744 9.053 9.053 755 1HG LYS 178 2HG LYS 178 -12.694 6.862 6.862 756 2HG LYS 178 1HG LYS 178 -14.249 7.687 7.687 757 1HD LYS 178 2HD LYS 178 -13.079 7.501 7.501 758 2HD LYS 178 1HD LYS 178 -13.010 9.234 9.234 759 1HE LYS 178 2HE LYS 178 -10.626 8.862 8.862 760 2HE LYS 178 1HE LYS 178 -10.743 7.138 7.138 761 1HZ LYS 178 3HZ LYS 178 -11.183 7.964 7.964 762 2HZ LYS 178 2HZ LYS 178 -11.026 9.567 9.567 763 3HZ LYS 178 1HZ LYS 178 -9.694 8.517 8.517 764 H LYS 179 H LYS 179 -15.001 10.122 10.122 765 HA LYS 179 HA LYS 179 -17.314 8.945 8.945 766 1HB LYS 179 2HB LYS 179 -17.085 10.797 10.797 767 2HB LYS 179 1HB LYS 179 -18.560 10.515 10.515 768 1HG LYS 179 2HG LYS 179 -15.953 11.910 11.910 769 2HG LYS 179 1HG LYS 179 -17.486 12.711 12.711 770 1HD LYS 179 2HD LYS 179 -18.665 11.586 11.586 771 2HD LYS 179 1HD LYS 179 -17.102 10.858 10.858 772 1HE LYS 179 2HE LYS 179 -16.132 13.152 13.152 773 2HE LYS 179 1HE LYS 179 -17.706 13.886 13.886 774 1HZ LYS 179 2HZ LYS 179 -17.300 12.074 12.074 775 2HZ LYS 179 1HZ LYS 179 -17.511 13.759 13.759 776 3HZ LYS 179 3HZ LYS 179 -18.773 12.761 12.761 777 H GLN 180 H GLN 180 -17.882 6.878 6.878 778 HA GLN 180 HA GLN 180 -18.292 6.435 6.435 779 1HB GLN 180 2HB GLN 180 -17.343 4.320 4.320 780 2HB GLN 180 1HB GLN 180 -17.847 4.008 4.008 781 1HG GLN 180 2HG GLN 180 -15.936 5.518 5.518 782 2HG GLN 180 1HG GLN 180 -15.351 5.563 5.563 783 1HE2 GLN 180 1HE2 GLN 180 -14.978 4.045 4.045 784 2HE2 GLN 180 2HE2 GLN 180 -14.382 2.497 2.497 Start of MODEL 14 1 HA VAL 90 HA VAL 90 -1.935 16.930 16.930 2 HB VAL 90 HB VAL 90 -3.505 16.929 16.929 3 1HG1 VAL 90 1HG1 VAL 90 -4.221 18.825 18.825 4 2HG1 VAL 90 3HG1 VAL 90 -5.372 17.668 17.668 5 3HG1 VAL 90 2HG1 VAL 90 -5.600 18.121 18.121 6 1HG2 VAL 90 2HG2 VAL 90 -5.342 15.174 15.174 7 2HG2 VAL 90 1HG2 VAL 90 -4.349 14.612 14.612 8 3HG2 VAL 90 3HG2 VAL 90 -5.718 15.731 15.731 9 H ILE 91 H ILE 91 -3.378 15.821 15.821 10 HA ILE 91 HA ILE 91 -2.971 12.946 12.946 11 HB ILE 91 HB ILE 91 -3.965 14.580 14.580 12 1HG1 ILE 91 2HG1 ILE 91 -5.565 14.722 14.722 13 2HG1 ILE 91 1HG1 ILE 91 -6.195 13.598 13.598 14 1HG2 ILE 91 2HG2 ILE 91 -3.718 11.533 11.533 15 2HG2 ILE 91 1HG2 ILE 91 -4.764 12.261 12.261 16 3HG2 ILE 91 3HG2 ILE 91 -2.991 12.502 12.502 17 1HD1 ILE 91 1HD1 ILE 91 -5.369 11.639 11.639 18 2HD1 ILE 91 3HD1 ILE 91 -4.868 12.801 12.801 19 3HD1 ILE 91 2HD1 ILE 91 -6.611 12.648 12.648 20 H GLN 92 H GLN 92 -1.125 12.044 12.044 21 HA GLN 92 HA GLN 92 0.989 13.538 13.538 22 1HB GLN 92 2HB GLN 92 1.065 11.049 11.049 23 2HB GLN 92 1HB GLN 92 2.454 12.117 12.117 24 1HG GLN 92 2HG GLN 92 1.631 13.853 13.853 25 2HG GLN 92 1HG GLN 92 -0.035 13.264 13.264 26 1HE2 GLN 92 1HE2 GLN 92 -0.831 12.303 12.303 27 2HE2 GLN 92 2HE2 GLN 92 0.040 11.453 11.453 28 H VAL 93 H VAL 93 2.691 11.918 11.918 29 HA VAL 93 HA VAL 93 1.238 9.833 9.833 30 HB VAL 93 HB VAL 93 3.953 11.143 11.143 31 1HG1 VAL 93 3HG1 VAL 93 2.372 8.784 8.784 32 2HG1 VAL 93 2HG1 VAL 93 3.639 9.661 9.661 33 3HG1 VAL 93 1HG1 VAL 93 4.120 8.753 8.753 34 1HG2 VAL 93 1HG2 VAL 93 1.779 12.412 12.412 35 2HG2 VAL 93 3HG2 VAL 93 2.760 11.846 11.846 36 3HG2 VAL 93 2HG2 VAL 93 1.349 10.872 10.872 37 H LYS 94 H LYS 94 1.494 7.681 7.681 38 HA LYS 94 HA LYS 94 4.359 7.382 7.382 39 1HB LYS 94 2HB LYS 94 2.251 5.276 5.276 40 2HB LYS 94 1HB LYS 94 3.846 5.313 5.313 41 1HG LYS 94 2HG LYS 94 1.550 7.275 7.275 42 2HG LYS 94 1HG LYS 94 1.852 5.844 5.844 43 1HD LYS 94 2HD LYS 94 3.847 8.172 8.172 44 2HD LYS 94 1HD LYS 94 2.698 7.967 7.967 45 1HE LYS 94 2HE LYS 94 3.786 5.759 5.759 46 2HE LYS 94 1HE LYS 94 5.027 6.066 6.066 47 1HZ LYS 94 2HZ LYS 94 5.587 8.118 8.118 48 2HZ LYS 94 1HZ LYS 94 4.441 7.797 7.797 49 3HZ LYS 94 3HZ LYS 94 5.777 6.768 6.768 50 H GLU 95 H GLU 95 5.132 5.095 5.095 51 HA GLU 95 HA GLU 95 3.864 4.622 4.622 52 1HB GLU 95 2HB GLU 95 5.681 6.423 6.423 53 2HB GLU 95 1HB GLU 95 6.739 5.105 5.105 54 1HG GLU 95 2HG GLU 95 6.475 3.872 3.872 55 2HG GLU 95 1HG GLU 95 5.311 5.141 5.141 56 H ILE 96 H ILE 96 4.363 2.657 2.657 57 HA ILE 96 HA ILE 96 5.925 0.780 0.780 58 HB ILE 96 HB ILE 96 3.203 0.680 0.680 59 1HG1 ILE 96 2HG1 ILE 96 3.373 -1.857 -1.857 60 2HG1 ILE 96 1HG1 ILE 96 5.064 -1.772 -1.772 61 1HG2 ILE 96 2HG2 ILE 96 2.850 0.646 0.646 62 2HG2 ILE 96 1HG2 ILE 96 3.596 -1.018 -1.018 63 3HG2 ILE 96 3HG2 ILE 96 2.155 -0.743 -0.743 64 1HD1 ILE 96 3HD1 ILE 96 5.616 -0.301 -0.301 65 2HD1 ILE 96 2HD1 ILE 96 3.906 -0.499 -0.499 66 3HD1 ILE 96 1HD1 ILE 96 4.994 -1.928 -1.928 67 H LYS 97 H LYS 97 6.683 -1.092 -1.092 68 HA LYS 97 HA LYS 97 6.112 -0.387 -0.387 69 1HB LYS 97 2HB LYS 97 8.685 -1.806 -1.806 70 2HB LYS 97 1HB LYS 97 8.017 -1.434 -1.434 71 1HG LYS 97 2HG LYS 97 8.194 1.038 1.038 72 2HG LYS 97 1HG LYS 97 9.058 0.598 0.598 73 1HD LYS 97 2HD LYS 97 10.843 -0.525 -0.525 74 2HD LYS 97 1HD LYS 97 9.946 -0.161 -0.161 75 1HE LYS 97 2HE LYS 97 10.223 2.296 2.296 76 2HE LYS 97 1HE LYS 97 11.121 1.948 1.948 77 1HZ LYS 97 1HZ LYS 97 11.914 1.069 1.069 78 2HZ LYS 97 3HZ LYS 97 12.587 2.358 2.358 79 3HZ LYS 97 2HZ LYS 97 12.760 0.765 0.765 80 H PHE 98 H PHE 98 5.831 -2.106 -2.106 81 HA PHE 98 HA PHE 98 5.747 -4.752 -4.752 82 1HB PHE 98 2HB PHE 98 3.629 -3.399 -3.399 83 2HB PHE 98 1HB PHE 98 3.698 -5.167 -5.167 84 HD1 PHE 98 1HD PHE 98 4.032 -5.802 -5.802 85 HD2 PHE 98 2HD PHE 98 2.101 -2.489 -2.489 86 HE1 PHE 98 1HE PHE 98 2.850 -5.475 -5.475 87 HE2 PHE 98 2HE PHE 98 0.767 -2.185 -2.185 88 HZ PHE 98 HZ PHE 98 1.024 -3.874 -3.874 89 H ARG 99 H ARG 99 6.368 -6.366 -6.366 90 HA ARG 99 HA ARG 99 7.825 -5.349 -5.349 91 1HB ARG 99 2HB ARG 99 8.205 -7.646 -7.646 92 2HB ARG 99 1HB ARG 99 8.842 -7.672 -7.672 93 1HG ARG 99 2HG ARG 99 10.626 -7.024 -7.024 94 2HG ARG 99 1HG ARG 99 10.207 -5.714 -5.714 95 1HD ARG 99 2HD ARG 99 10.798 -4.910 -4.910 96 2HD ARG 99 1HD ARG 99 9.128 -4.406 -4.406 97 HE ARG 99 HE ARG 99 8.723 -6.839 -6.839 98 1HH1 ARG 99 1HH2 ARG 99 10.355 -3.769 -3.769 99 2HH1 ARG 99 2HH2 ARG 99 9.966 -3.823 -3.823 100 1HH2 ARG 99 1HH1 ARG 99 8.199 -6.908 -6.908 101 2HH2 ARG 99 2HH1 ARG 99 8.722 -5.634 -5.634 102 HA PRO 100 HA PRO 100 5.488 -8.003 -8.003 103 1HB PRO 100 2HB PRO 100 8.215 -9.306 -9.306 104 2HB PRO 100 1HB PRO 100 7.032 -8.748 -8.748 105 1HG PRO 100 2HG PRO 100 9.362 -7.356 -7.356 106 2HG PRO 100 1HG PRO 100 7.949 -6.564 -6.564 107 1HD PRO 100 2HD PRO 100 8.797 -6.212 -6.212 108 2HD PRO 100 1HD PRO 100 7.322 -5.541 -5.541 109 H GLY 101 H GLY 101 4.485 -9.978 -9.978 110 1HA GLY 101 2HA GLY 101 3.960 -11.967 -11.967 111 2HA GLY 101 1HA GLY 101 5.717 -12.199 -12.199 112 H THR 102 H THR 102 5.951 -12.619 -12.619 113 HA THR 102 HA THR 102 6.139 -12.608 -12.608 114 HB THR 102 HB THR 102 5.512 -9.653 -9.653 115 HG1 THR 102 1HG THR 102 7.129 -10.291 -10.291 116 1HG2 THR 102 3HG2 THR 102 6.895 -11.635 -11.635 117 2HG2 THR 102 2HG2 THR 102 7.322 -9.870 -9.870 118 3HG2 THR 102 1HG2 THR 102 5.650 -10.405 -10.405 119 H ASP 103 H ASP 103 4.653 -13.777 -13.777 120 HA ASP 103 HA ASP 103 2.457 -12.279 -12.279 121 1HB ASP 103 2HB ASP 103 2.164 -14.013 -14.013 122 2HB ASP 103 1HB ASP 103 2.540 -15.216 -15.216 123 H GLU 104 H GLU 104 3.684 -15.493 -15.493 124 HA GLU 104 HA GLU 104 1.157 -14.233 -14.233 125 1HB GLU 104 2HB GLU 104 2.582 -16.428 -16.428 126 2HB GLU 104 1HB GLU 104 0.954 -15.780 -15.780 127 1HG GLU 104 2HG GLU 104 0.065 -16.486 -16.486 128 2HG GLU 104 1HG GLU 104 1.689 -17.132 -17.132 129 H GLY 105 H GLY 105 3.566 -15.052 -15.052 130 1HA GLY 105 2HA GLY 105 2.998 -12.412 -12.412 131 2HA GLY 105 1HA GLY 105 3.559 -13.877 -13.877 132 H ASP 106 H ASP 106 4.763 -12.565 -12.565 133 HA ASP 106 HA ASP 106 6.781 -11.076 -11.076 134 1HB ASP 106 2HB ASP 106 7.530 -12.373 -12.373 135 2HB ASP 106 1HB ASP 106 6.487 -11.343 -11.343 136 H TYR 107 H TYR 107 4.147 -11.179 -11.179 137 HA TYR 107 HA TYR 107 4.095 -8.392 -8.392 138 1HB TYR 107 2HB TYR 107 3.477 -10.277 -10.277 139 2HB TYR 107 1HB TYR 107 2.172 -10.799 -10.799 140 HD1 TYR 107 2HD TYR 107 2.051 -7.219 -7.219 141 HD2 TYR 107 1HD TYR 107 1.140 -10.861 -10.861 142 HE1 TYR 107 2HE TYR 107 -0.013 -6.248 -6.248 143 HE2 TYR 107 1HE TYR 107 -0.588 -9.729 -9.729 144 HH TYR 107 HH TYR 107 -1.653 -6.491 -6.491 145 H GLN 108 H GLN 108 1.240 -10.297 -10.297 146 HA GLN 108 HA GLN 108 0.167 -8.271 -8.271 147 1HB GLN 108 2HB GLN 108 -0.698 -10.772 -10.772 148 2HB GLN 108 1HB GLN 108 -1.577 -9.466 -9.466 149 1HG GLN 108 2HG GLN 108 0.057 -11.425 -11.425 150 2HG GLN 108 1HG GLN 108 -1.400 -11.908 -11.908 151 1HE2 GLN 108 1HE2 GLN 108 -0.439 -8.609 -8.609 152 2HE2 GLN 108 2HE2 GLN 108 -1.710 -8.481 -8.481 153 H VAL 109 H VAL 109 2.707 -9.727 -9.727 154 HA VAL 109 HA VAL 109 2.259 -8.917 -8.917 155 HB VAL 109 HB VAL 109 4.842 -9.134 -9.134 156 1HG1 VAL 109 2HG1 VAL 109 4.418 -8.407 -8.407 157 2HG1 VAL 109 1HG1 VAL 109 5.953 -9.073 -9.073 158 3HG1 VAL 109 3HG1 VAL 109 5.379 -7.483 -7.483 159 1HG2 VAL 109 1HG2 VAL 109 3.524 -11.241 -11.241 160 2HG2 VAL 109 3HG2 VAL 109 5.143 -11.173 -11.173 161 3HG2 VAL 109 2HG2 VAL 109 3.649 -10.830 -10.830 162 H LYS 110 H LYS 110 3.576 -7.283 -7.283 163 HA LYS 110 HA LYS 110 3.589 -4.744 -4.744 164 1HB LYS 110 2HB LYS 110 4.541 -5.713 -5.713 165 2HB LYS 110 1HB LYS 110 4.562 -4.008 -4.008 166 1HG LYS 110 2HG LYS 110 6.140 -6.357 -6.357 167 2HG LYS 110 1HG LYS 110 6.645 -4.685 -4.685 168 1HD LYS 110 2HD LYS 110 5.791 -3.690 -3.690 169 2HD LYS 110 1HD LYS 110 5.324 -5.319 -5.319 170 1HE LYS 110 2HE LYS 110 7.471 -4.607 -4.607 171 2HE LYS 110 1HE LYS 110 7.751 -6.029 -6.029 172 1HZ LYS 110 2HZ LYS 110 8.478 -4.497 -4.497 173 2HZ LYS 110 1HZ LYS 110 8.221 -3.171 -3.171 174 3HZ LYS 110 3HZ LYS 110 9.401 -4.329 -4.329 175 H LEU 111 H LEU 111 1.321 -6.479 -6.479 176 HA LEU 111 HA LEU 111 -0.047 -4.124 -4.124 177 1HB LEU 111 2HB LEU 111 -0.406 -6.437 -6.437 178 2HB LEU 111 1HB LEU 111 -1.226 -6.882 -6.882 179 HG LEU 111 HG LEU 111 -2.133 -4.424 -4.424 180 1HD1 LEU 111 2HD1 LEU 111 -1.769 -6.287 -6.287 181 2HD1 LEU 111 1HD1 LEU 111 -2.934 -7.293 -7.293 182 3HD1 LEU 111 3HD1 LEU 111 -3.492 -5.761 -5.761 183 1HD2 LEU 111 2HD2 LEU 111 -3.568 -6.703 -6.703 184 2HD2 LEU 111 1HD2 LEU 111 -3.249 -5.054 -5.054 185 3HD2 LEU 111 3HD2 LEU 111 -4.411 -5.291 -5.291 186 H ARG 112 H ARG 112 0.482 -6.221 -6.221 187 HA ARG 112 HA ARG 112 -1.387 -4.965 -4.965 188 1HB ARG 112 2HB ARG 112 -0.117 -7.143 -7.143 189 2HB ARG 112 1HB ARG 112 1.146 -6.064 -6.064 190 1HG ARG 112 2HG ARG 112 -0.546 -5.062 -5.062 191 2HG ARG 112 1HG ARG 112 -1.810 -6.138 -6.138 192 1HD ARG 112 2HD ARG 112 -0.557 -8.153 -8.153 193 2HD ARG 112 1HD ARG 112 0.751 -7.069 -7.069 194 HE ARG 112 HE ARG 112 -1.808 -6.212 -6.212 195 1HH1 ARG 112 1HH1 ARG 112 0.555 -8.877 -8.877 196 2HH1 ARG 112 2HH1 ARG 112 0.169 -9.300 -9.300 197 1HH2 ARG 112 1HH2 ARG 112 -2.326 -6.793 -6.793 198 2HH2 ARG 112 2HH2 ARG 112 -1.490 -8.099 -8.099 199 H SER 113 H SER 113 2.229 -4.135 -4.135 200 HA SER 113 HA SER 113 2.153 -2.143 -2.143 201 1HB SER 113 2HB SER 113 3.881 -2.318 -2.318 202 2HB SER 113 1HB SER 113 4.060 -1.161 -1.161 203 HG SER 113 HG SER 113 4.048 -3.992 -3.992 204 H LEU 114 H LEU 114 1.028 -2.096 -2.096 205 HA LEU 114 HA LEU 114 0.778 0.622 0.622 206 1HB LEU 114 2HB LEU 114 1.223 -1.163 -1.163 207 2HB LEU 114 1HB LEU 114 -0.260 -2.031 -2.031 208 HG LEU 114 HG LEU 114 -1.608 -0.230 -0.230 209 1HD1 LEU 114 2HD1 LEU 114 1.110 0.992 0.992 210 2HD1 LEU 114 1HD1 LEU 114 -0.445 1.619 1.619 211 3HD1 LEU 114 3HD1 LEU 114 -0.127 1.658 1.658 212 1HD2 LEU 114 2HD2 LEU 114 -1.105 -2.159 -2.159 213 2HD2 LEU 114 1HD2 LEU 114 -1.354 -0.711 -0.711 214 3HD2 LEU 114 3HD2 LEU 114 0.313 -1.331 -1.331 215 H ILE 115 H ILE 115 -1.546 -2.046 -2.046 216 HA ILE 115 HA ILE 115 -3.739 -0.433 -0.433 217 HB ILE 115 HB ILE 115 -3.169 -2.013 -2.013 218 1HG1 ILE 115 2HG1 ILE 115 -2.662 -3.645 -3.645 219 2HG1 ILE 115 1HG1 ILE 115 -4.171 -4.017 -4.017 220 1HG2 ILE 115 2HG2 ILE 115 -5.534 -1.077 -1.077 221 2HG2 ILE 115 1HG2 ILE 115 -5.725 -2.286 -2.286 222 3HG2 ILE 115 3HG2 ILE 115 -5.105 -0.645 -0.645 223 1HD1 ILE 115 2HD1 ILE 115 -5.475 -3.025 -3.025 224 2HD1 ILE 115 1HD1 ILE 115 -3.859 -2.854 -2.854 225 3HD1 ILE 115 3HD1 ILE 115 -4.528 -4.490 -4.490 226 H ARG 116 H ARG 116 -1.200 -0.825 -0.825 227 HA ARG 116 HA ARG 116 -2.045 0.754 0.754 228 1HB ARG 116 2HB ARG 116 -0.243 -0.788 -0.788 229 2HB ARG 116 1HB ARG 116 0.730 -0.042 -0.042 230 1HG ARG 116 2HG ARG 116 1.229 1.909 1.909 231 2HG ARG 116 1HG ARG 116 0.062 1.401 1.401 232 1HD ARG 116 2HD ARG 116 2.420 0.915 0.915 233 2HD ARG 116 1HD ARG 116 1.533 -0.653 -0.653 234 HE ARG 116 HE ARG 116 2.736 0.154 0.154 235 1HH1 ARG 116 1HH1 ARG 116 3.623 -0.906 -0.906 236 2HH1 ARG 116 2HH1 ARG 116 5.120 -1.633 -1.633 237 1HH2 ARG 116 1HH2 ARG 116 4.771 -0.834 -0.834 238 2HH2 ARG 116 2HH2 ARG 116 5.782 -1.590 -1.590 239 H PHE 117 H PHE 117 -0.072 1.697 1.697 240 HA PHE 117 HA PHE 117 0.311 4.339 4.339 241 1HB PHE 117 2HB PHE 117 -0.243 2.873 2.873 242 2HB PHE 117 1HB PHE 117 0.450 4.505 4.505 243 HD1 PHE 117 1HD PHE 117 1.919 2.715 2.715 244 HD2 PHE 117 2HD PHE 117 1.580 2.944 2.944 245 HE1 PHE 117 1HE PHE 117 4.168 1.786 1.786 246 HE2 PHE 117 2HE PHE 117 3.855 1.866 1.866 247 HZ PHE 117 HZ PHE 117 5.161 1.342 1.342 248 H LEU 118 H LEU 118 -2.354 2.780 2.780 249 HA LEU 118 HA LEU 118 -3.763 4.965 4.965 250 1HB LEU 118 2HB LEU 118 -4.114 2.286 2.286 251 2HB LEU 118 1HB LEU 118 -5.537 2.923 2.923 252 HG LEU 118 HG LEU 118 -5.154 4.956 4.956 253 1HD1 LEU 118 1HD1 LEU 118 -4.225 2.265 2.265 254 2HD1 LEU 118 3HD1 LEU 118 -5.040 3.510 3.510 255 3HD1 LEU 118 2HD1 LEU 118 -3.500 3.937 3.937 256 1HD2 LEU 118 3HD2 LEU 118 -6.889 2.537 2.537 257 2HD2 LEU 118 2HD2 LEU 118 -7.113 4.268 4.268 258 3HD2 LEU 118 1HD2 LEU 118 -7.066 3.876 3.876 259 H GLU 119 H GLU 119 -3.737 3.106 3.106 260 HA GLU 119 HA GLU 119 -6.187 3.945 3.945 261 1HB GLU 119 2HB GLU 119 -3.708 2.565 2.565 262 2HB GLU 119 1HB GLU 119 -5.039 3.108 3.108 263 1HG GLU 119 2HG GLU 119 -6.634 1.592 1.592 264 2HG GLU 119 1HG GLU 119 -5.400 1.125 1.125 265 H GLU 120 H GLU 120 -2.774 4.988 4.988 266 HA GLU 120 HA GLU 120 -3.138 6.786 6.786 267 1HB GLU 120 2HB GLU 120 -1.243 7.100 7.100 268 2HB GLU 120 1HB GLU 120 -1.144 8.000 8.000 269 1HG GLU 120 2HG GLU 120 -0.803 5.678 5.678 270 2HG GLU 120 1HG GLU 120 -0.489 5.050 5.050 271 H GLY 121 H GLY 121 -4.197 6.823 6.823 272 1HA GLY 121 2HA GLY 121 -5.643 8.187 8.187 273 2HA GLY 121 1HA GLY 121 -5.310 9.426 9.426 274 H ASP 122 H ASP 122 -3.449 7.484 7.484 275 HA ASP 122 HA ASP 122 -2.425 10.038 10.038 276 1HB ASP 122 2HB ASP 122 -0.902 7.413 7.413 277 2HB ASP 122 1HB ASP 122 -0.287 9.033 9.033 278 H LYS 123 H LYS 123 -1.711 9.582 9.582 279 HA LYS 123 HA LYS 123 -3.476 7.516 7.516 280 1HB LYS 123 2HB LYS 123 -1.916 8.534 8.534 281 2HB LYS 123 1HB LYS 123 -3.696 8.624 8.624 282 1HG LYS 123 2HG LYS 123 -3.571 10.782 10.782 283 2HG LYS 123 1HG LYS 123 -3.145 10.874 10.874 284 1HD LYS 123 2HD LYS 123 -1.668 12.213 12.213 285 2HD LYS 123 1HD LYS 123 -0.733 11.023 11.023 286 1HE LYS 123 2HE LYS 123 -0.255 9.650 9.650 287 2HE LYS 123 1HE LYS 123 -1.797 10.064 10.064 288 1HZ LYS 123 2HZ LYS 123 0.582 11.831 11.831 289 2HZ LYS 123 1HZ LYS 123 0.145 10.953 10.953 290 3HZ LYS 123 3HZ LYS 123 -0.855 12.206 12.206 291 H ALA 124 H ALA 124 -2.469 5.731 5.731 292 HA ALA 124 HA ALA 124 0.359 5.872 5.872 293 1HB ALA 124 2HB ALA 124 -1.611 3.576 3.576 294 2HB ALA 124 1HB ALA 124 0.190 3.583 3.583 295 3HB ALA 124 3HB ALA 124 -1.101 4.343 4.343 296 H LYS 125 H LYS 125 1.679 5.845 5.845 297 HA LYS 125 HA LYS 125 0.315 5.437 5.437 298 1HB LYS 125 2HB LYS 125 1.440 7.637 7.637 299 2HB LYS 125 1HB LYS 125 2.976 6.796 6.796 300 1HG LYS 125 2HG LYS 125 3.271 6.113 6.113 301 2HG LYS 125 1HG LYS 125 1.670 6.810 6.810 302 1HD LYS 125 2HD LYS 125 3.937 8.465 8.465 303 2HD LYS 125 1HD LYS 125 3.821 8.195 8.195 304 1HE LYS 125 2HE LYS 125 1.583 9.242 9.242 305 2HE LYS 125 1HE LYS 125 1.637 9.547 9.547 306 1HZ LYS 125 1HZ LYS 125 3.544 10.601 10.601 307 2HZ LYS 125 3HZ LYS 125 2.297 11.465 11.465 308 3HZ LYS 125 2HZ LYS 125 3.606 10.877 10.877 309 H ILE 126 H ILE 126 0.589 3.578 3.578 310 HA ILE 126 HA ILE 126 2.719 1.862 1.862 311 HB ILE 126 HB ILE 126 0.940 1.713 1.713 312 1HG1 ILE 126 2HG1 ILE 126 -0.703 2.141 2.141 313 2HG1 ILE 126 1HG1 ILE 126 -0.664 0.378 0.378 314 1HG2 ILE 126 1HG2 ILE 126 2.457 -0.220 -0.220 315 2HG2 ILE 126 3HG2 ILE 126 1.216 -0.756 -0.756 316 3HG2 ILE 126 2HG2 ILE 126 2.728 0.047 0.047 317 1HD1 ILE 126 1HD1 ILE 126 0.666 0.078 0.078 318 2HD1 ILE 126 3HD1 ILE 126 0.508 1.841 1.841 319 3HD1 ILE 126 2HD1 ILE 126 -0.972 0.809 0.809 320 H THR 127 H THR 127 4.658 1.636 1.636 321 HA THR 127 HA THR 127 4.805 2.884 2.884 322 HB THR 127 HB THR 127 7.156 2.209 2.209 323 HG1 THR 127 1HG THR 127 5.977 3.856 3.856 324 1HG2 THR 127 3HG2 THR 127 6.690 3.725 3.725 325 2HG2 THR 127 2HG2 THR 127 8.242 3.825 3.825 326 3HG2 THR 127 1HG2 THR 127 7.701 2.244 2.244 327 H LEU 128 H LEU 128 4.527 1.411 1.411 328 HA LEU 128 HA LEU 128 5.310 -1.369 -1.369 329 1HB LEU 128 2HB LEU 128 3.381 -0.465 -0.465 330 2HB LEU 128 1HB LEU 128 4.710 -0.087 -0.087 331 HG LEU 128 HG LEU 128 5.298 -2.287 -2.287 332 1HD1 LEU 128 1HD1 LEU 128 3.436 -3.166 -3.166 333 2HD1 LEU 128 3HD1 LEU 128 3.998 -4.259 -4.259 334 3HD1 LEU 128 2HD1 LEU 128 5.204 -3.527 -3.527 335 1HD2 LEU 128 2HD2 LEU 128 3.130 -1.006 -1.006 336 2HD2 LEU 128 1HD2 LEU 128 3.337 -2.773 -2.773 337 3HD2 LEU 128 3HD2 LEU 128 2.267 -2.214 -2.214 338 H ARG 129 H ARG 129 7.096 -2.353 -2.353 339 HA ARG 129 HA ARG 129 8.848 -0.574 -0.574 340 1HB ARG 129 2HB ARG 129 9.571 -0.366 -0.366 341 2HB ARG 129 1HB ARG 129 9.707 -2.157 -2.157 342 1HG ARG 129 2HG ARG 129 11.540 -2.099 -2.099 343 2HG ARG 129 1HG ARG 129 11.075 -0.439 -0.439 344 1HD ARG 129 2HD ARG 129 11.869 0.397 0.397 345 2HD ARG 129 1HD ARG 129 12.372 -1.293 -1.293 346 HE ARG 129 HE ARG 129 14.192 -1.102 -1.102 347 1HH1 ARG 129 1HH1 ARG 129 12.025 1.729 1.729 348 2HH1 ARG 129 2HH1 ARG 129 13.190 2.691 2.691 349 1HH2 ARG 129 1HH2 ARG 129 15.739 0.218 0.218 350 2HH2 ARG 129 2HH2 ARG 129 15.321 1.825 1.825 351 H PHE 130 H PHE 130 8.512 -1.647 -1.647 352 HA PHE 130 HA PHE 130 8.039 -4.447 -4.447 353 1HB PHE 130 2HB PHE 130 8.885 -2.105 -2.105 354 2HB PHE 130 1HB PHE 130 8.325 -3.770 -3.770 355 HD1 PHE 130 1HD PHE 130 6.221 -4.656 -4.656 356 HD2 PHE 130 2HD PHE 130 7.356 -0.493 -0.493 357 HE1 PHE 130 1HE PHE 130 3.899 -3.969 -3.969 358 HE2 PHE 130 2HE PHE 130 4.981 0.087 0.087 359 HZ PHE 130 HZ PHE 130 3.217 -1.701 -1.701 360 H ARG 131 H ARG 131 9.652 -5.695 -5.695 361 HA ARG 131 HA ARG 131 12.250 -4.356 -4.356 362 1HB ARG 131 2HB ARG 131 12.508 -6.802 -6.802 363 2HB ARG 131 1HB ARG 131 11.628 -7.225 -7.225 364 1HG ARG 131 2HG ARG 131 14.034 -7.471 -7.471 365 2HG ARG 131 1HG ARG 131 13.461 -6.075 -6.075 366 1HD ARG 131 2HD ARG 131 14.290 -4.678 -4.678 367 2HD ARG 131 1HD ARG 131 15.293 -6.153 -6.153 368 HE ARG 131 HE ARG 131 16.418 -5.673 -5.673 369 1HH1 ARG 131 1HH1 ARG 131 13.824 -3.296 -3.296 370 2HH1 ARG 131 2HH1 ARG 131 14.384 -2.156 -2.156 371 1HH2 ARG 131 1HH2 ARG 131 17.141 -4.113 -4.113 372 2HH2 ARG 131 2HH2 ARG 131 16.284 -2.624 -2.624 373 H GLY 132 H GLY 132 11.231 -2.705 -2.705 374 1HA GLY 132 2HA GLY 132 9.839 -3.531 -3.531 375 2HA GLY 132 1HA GLY 132 9.619 -2.059 -2.059 376 H ARG 133 H ARG 133 10.485 -0.482 -0.482 377 HA ARG 133 HA ARG 133 11.762 1.179 1.179 378 1HB ARG 133 2HB ARG 133 13.819 -0.204 -0.204 379 2HB ARG 133 1HB ARG 133 13.771 -0.753 -0.753 380 1HG ARG 133 2HG ARG 133 15.426 1.009 1.009 381 2HG ARG 133 1HG ARG 133 14.101 1.599 1.599 382 1HD ARG 133 2HD ARG 133 14.790 3.394 3.394 383 2HD ARG 133 1HD ARG 133 13.149 2.853 2.853 384 HE ARG 133 HE ARG 133 15.133 1.326 1.326 385 1HH1 ARG 133 1HH1 ARG 133 13.987 4.684 4.684 386 2HH1 ARG 133 2HH1 ARG 133 14.550 5.203 5.203 387 1HH2 ARG 133 1HH2 ARG 133 15.895 2.043 2.043 388 2HH2 ARG 133 2HH2 ARG 133 15.650 3.682 3.682 389 H GLU 134 H GLU 134 9.734 1.305 1.305 390 HA GLU 134 HA GLU 134 10.321 2.433 2.433 391 1HB GLU 134 2HB GLU 134 9.962 -0.062 -0.062 392 2HB GLU 134 1HB GLU 134 8.269 0.137 0.137 393 1HG GLU 134 2HG GLU 134 8.093 2.078 2.078 394 2HG GLU 134 1HG GLU 134 9.804 1.743 1.743 395 H MET 135 H MET 135 7.156 2.123 2.123 396 HA MET 135 HA MET 135 6.331 2.559 2.559 397 1HB MET 135 2HB MET 135 3.973 2.865 2.865 398 2HB MET 135 1HB MET 135 5.101 4.257 4.257 399 1HG MET 135 2HG MET 135 5.677 3.714 3.714 400 2HG MET 135 1HG MET 135 4.518 2.349 2.349 401 1HE MET 135 3HE MET 135 4.622 4.520 4.520 402 2HE MET 135 2HE MET 135 3.414 3.190 3.190 403 3HE MET 135 1HE MET 135 2.879 4.882 4.882 404 H ALA 136 H ALA 136 6.350 0.435 0.435 405 HA ALA 136 HA ALA 136 6.642 -1.495 -1.495 406 1HB ALA 136 2HB ALA 136 8.056 -1.203 -1.203 407 2HB ALA 136 1HB ALA 136 6.689 -1.859 -1.859 408 3HB ALA 136 3HB ALA 136 7.507 -2.881 -2.881 409 H HIS 137 H HIS 137 5.940 -3.638 -3.638 410 HA HIS 137 HA HIS 137 3.635 -4.845 -4.845 411 1HB HIS 137 2HB HIS 137 4.897 -4.708 -4.708 412 2HB HIS 137 1HB HIS 137 4.023 -6.093 -6.093 413 HD1 HIS 137 1HD HIS 137 5.471 -7.096 -7.096 414 HD2 HIS 137 2HD HIS 137 7.490 -4.430 -4.430 415 HE1 HIS 137 1HE HIS 137 7.975 -7.322 -7.322 416 H GLN 138 H GLN 138 1.450 -4.514 -4.514 417 HA GLN 138 HA GLN 138 0.865 -3.061 -3.061 418 1HB GLN 138 2HB GLN 138 0.087 -1.876 -1.876 419 2HB GLN 138 1HB GLN 138 -1.065 -3.242 -3.242 420 1HG GLN 138 2HG GLN 138 -2.232 -2.592 -2.592 421 2HG GLN 138 1HG GLN 138 -0.904 -1.440 -1.440 422 1HE2 GLN 138 1HE2 GLN 138 -1.484 0.609 0.609 423 2HE2 GLN 138 2HE2 GLN 138 -2.439 1.239 1.239 424 H GLN 139 H GLN 139 1.514 -5.853 -5.853 425 HA GLN 139 HA GLN 139 -0.869 -7.267 -7.267 426 1HB GLN 139 2HB GLN 139 1.864 -8.566 -8.566 427 2HB GLN 139 1HB GLN 139 0.253 -9.307 -9.307 428 1HG GLN 139 2HG GLN 139 1.500 -7.138 -7.138 429 2HG GLN 139 1HG GLN 139 1.272 -8.872 -8.872 430 1HE2 GLN 139 1HE2 GLN 139 -1.166 -9.642 -9.642 431 2HE2 GLN 139 2HE2 GLN 139 -2.396 -8.645 -8.645 432 H ILE 140 H ILE 140 2.656 -6.999 -6.999 433 HA ILE 140 HA ILE 140 3.018 -8.169 -8.169 434 HB ILE 140 HB ILE 140 4.391 -6.100 -6.100 435 1HG1 ILE 140 2HG1 ILE 140 4.652 -9.138 -9.138 436 2HG1 ILE 140 1HG1 ILE 140 4.145 -8.359 -8.359 437 1HG2 ILE 140 2HG2 ILE 140 5.026 -7.599 -7.599 438 2HG2 ILE 140 1HG2 ILE 140 6.276 -6.741 -6.741 439 3HG2 ILE 140 3HG2 ILE 140 4.973 -5.801 -5.801 440 1HD1 ILE 140 3HD1 ILE 140 6.411 -7.220 -7.220 441 2HD1 ILE 140 2HD1 ILE 140 6.939 -8.303 -8.303 442 3HD1 ILE 140 1HD1 ILE 140 6.419 -9.009 -9.009 443 H GLY 141 H GLY 141 1.958 -4.889 -4.889 444 1HA GLY 141 2HA GLY 141 2.044 -4.174 -4.174 445 2HA GLY 141 1HA GLY 141 1.226 -3.279 -3.279 446 H MET 142 H MET 142 -0.792 -4.839 -4.839 447 HA MET 142 HA MET 142 -2.304 -4.089 -4.089 448 1HB MET 142 2HB MET 142 -3.954 -3.628 -3.628 449 2HB MET 142 1HB MET 142 -2.502 -3.572 -3.572 450 1HG MET 142 2HG MET 142 -3.045 -6.050 -6.050 451 2HG MET 142 1HG MET 142 -4.469 -5.782 -5.782 452 1HE MET 142 2HE MET 142 -5.599 -6.872 -6.872 453 2HE MET 142 1HE MET 142 -5.585 -6.153 -6.153 454 3HE MET 142 3HE MET 142 -4.062 -6.787 -6.787 455 H GLU 143 H GLU 143 -1.070 -7.278 -7.278 456 HA GLU 143 HA GLU 143 -3.224 -8.256 -8.256 457 1HB GLU 143 2HB GLU 143 -1.139 -9.733 -9.733 458 2HB GLU 143 1HB GLU 143 -0.438 -9.320 -9.320 459 1HG GLU 143 2HG GLU 143 -1.498 -11.273 -11.273 460 2HG GLU 143 1HG GLU 143 -2.841 -10.181 -10.181 461 H VAL 144 H VAL 144 -0.041 -6.994 -6.994 462 HA VAL 144 HA VAL 144 -0.396 -7.661 -7.661 463 HB VAL 144 HB VAL 144 1.572 -5.743 -5.743 464 1HG1 VAL 144 1HG1 VAL 144 1.244 -7.310 -7.310 465 2HG1 VAL 144 3HG1 VAL 144 2.833 -6.687 -6.687 466 3HG1 VAL 144 2HG1 VAL 144 1.498 -5.533 -5.533 467 1HG2 VAL 144 3HG2 VAL 144 1.042 -8.727 -8.727 468 2HG2 VAL 144 2HG2 VAL 144 1.527 -7.889 -7.889 469 3HG2 VAL 144 1HG2 VAL 144 2.762 -8.134 -8.134 470 H LEU 145 H LEU 145 -0.230 -4.547 -4.547 471 HA LEU 145 HA LEU 145 -0.932 -2.850 -2.850 472 1HB LEU 145 2HB LEU 145 -1.520 -2.934 -2.934 473 2HB LEU 145 1HB LEU 145 -1.934 -1.501 -1.501 474 HG LEU 145 HG LEU 145 0.834 -2.669 -2.669 475 1HD1 LEU 145 1HD1 LEU 145 -0.674 -0.081 -0.081 476 2HD1 LEU 145 3HD1 LEU 145 1.087 -0.326 -0.326 477 3HD1 LEU 145 2HD1 LEU 145 -0.126 -1.405 -1.405 478 1HD2 LEU 145 2HD2 LEU 145 -0.062 -0.546 -0.546 479 2HD2 LEU 145 1HD2 LEU 145 0.891 -2.025 -2.025 480 3HD2 LEU 145 3HD2 LEU 145 1.664 -0.678 -0.678 481 H ASN 146 H ASN 146 -3.107 -4.206 -4.206 482 HA ASN 146 HA ASN 146 -5.565 -3.294 -3.294 483 1HB ASN 146 2HB ASN 146 -4.463 -4.409 -4.409 484 2HB ASN 146 1HB ASN 146 -5.413 -5.813 -5.813 485 1HD2 ASN 146 2HD2 ASN 146 -5.551 -4.784 -4.784 486 2HD2 ASN 146 1HD2 ASN 146 -7.198 -5.138 -5.138 487 H ARG 147 H ARG 147 -3.694 -6.336 -6.336 488 HA ARG 147 HA ARG 147 -5.921 -7.195 -7.195 489 1HB ARG 147 2HB ARG 147 -4.631 -8.769 -8.769 490 2HB ARG 147 1HB ARG 147 -3.081 -8.022 -8.022 491 1HG ARG 147 2HG ARG 147 -3.223 -9.048 -9.048 492 2HG ARG 147 1HG ARG 147 -5.049 -9.109 -9.109 493 1HD ARG 147 2HD ARG 147 -3.958 -11.428 -11.428 494 2HD ARG 147 1HD ARG 147 -4.778 -11.034 -11.034 495 HE ARG 147 HE ARG 147 -2.210 -10.046 -10.046 496 1HH1 ARG 147 1HH1 ARG 147 -3.508 -13.194 -13.194 497 2HH1 ARG 147 2HH1 ARG 147 -2.119 -14.096 -14.096 498 1HH2 ARG 147 1HH2 ARG 147 -0.346 -11.280 -11.280 499 2HH2 ARG 147 2HH2 ARG 147 -0.298 -12.994 -12.994 500 H VAL 148 H VAL 148 -3.299 -4.794 -4.794 501 HA VAL 148 HA VAL 148 -3.204 -5.295 -5.295 502 HB VAL 148 HB VAL 148 -2.666 -2.667 -2.667 503 1HG1 VAL 148 1HG1 VAL 148 -2.654 -3.353 -3.353 504 2HG1 VAL 148 3HG1 VAL 148 -1.255 -4.411 -4.411 505 3HG1 VAL 148 2HG1 VAL 148 -1.133 -2.623 -2.623 506 1HG2 VAL 148 2HG2 VAL 148 -0.766 -5.029 -5.029 507 2HG2 VAL 148 1HG2 VAL 148 -1.450 -4.094 -4.094 508 3HG2 VAL 148 3HG2 VAL 148 -0.321 -3.294 -3.294 509 H LYS 149 H LYS 149 -4.945 -2.957 -2.957 510 HA LYS 149 HA LYS 149 -6.426 -1.535 -1.535 511 1HB LYS 149 2HB LYS 149 -6.385 -1.395 -1.395 512 2HB LYS 149 1HB LYS 149 -7.250 -2.977 -2.977 513 1HG LYS 149 2HG LYS 149 -9.203 -2.270 -2.270 514 2HG LYS 149 1HG LYS 149 -8.661 -0.674 -0.674 515 1HD LYS 149 2HD LYS 149 -8.686 -1.582 -1.582 516 2HD LYS 149 1HD LYS 149 -10.084 -0.690 -0.690 517 1HE LYS 149 2HE LYS 149 -8.834 1.358 1.358 518 2HE LYS 149 1HE LYS 149 -7.425 0.489 0.489 519 1HZ LYS 149 2HZ LYS 149 -8.874 -0.062 -0.062 520 2HZ LYS 149 1HZ LYS 149 -10.186 0.723 0.723 521 3HZ LYS 149 3HZ LYS 149 -8.828 1.618 1.618 522 H ASP 150 H ASP 150 -7.118 -4.828 -4.828 523 HA ASP 150 HA ASP 150 -9.719 -4.905 -4.905 524 1HB ASP 150 2HB ASP 150 -7.772 -6.647 -6.647 525 2HB ASP 150 1HB ASP 150 -9.103 -7.389 -7.389 526 H ASP 151 H ASP 151 -6.536 -6.348 -6.348 527 HA ASP 151 HA ASP 151 -8.071 -7.364 -7.364 528 1HB ASP 151 2HB ASP 151 -5.922 -8.306 -8.306 529 2HB ASP 151 1HB ASP 151 -5.084 -7.022 -7.022 530 H LEU 152 H LEU 152 -6.608 -4.103 -4.103 531 HA LEU 152 HA LEU 152 -6.644 -3.504 -3.504 532 1HB LEU 152 2HB LEU 152 -5.840 -2.101 -2.101 533 2HB LEU 152 1HB LEU 152 -7.180 -1.230 -1.230 534 HG LEU 152 HG LEU 152 -5.125 -0.252 -0.252 535 1HD1 LEU 152 2HD1 LEU 152 -6.211 -1.980 -1.980 536 2HD1 LEU 152 1HD1 LEU 152 -5.053 -0.646 -0.646 537 3HD1 LEU 152 3HD1 LEU 152 -6.685 -0.321 -0.321 538 1HD2 LEU 152 1HD2 LEU 152 -4.233 -3.115 -3.115 539 2HD2 LEU 152 3HD2 LEU 152 -3.631 -1.922 -1.922 540 3HD2 LEU 152 2HD2 LEU 152 -3.296 -1.635 -1.635 541 H GLN 153 H GLN 153 -8.917 -3.210 -3.210 542 HA GLN 153 HA GLN 153 -10.567 -1.528 -1.528 543 1HB GLN 153 2HB GLN 153 -10.366 -3.874 -3.874 544 2HB GLN 153 1HB GLN 153 -11.714 -4.284 -4.284 545 1HG GLN 153 2HG GLN 153 -12.984 -2.315 -2.315 546 2HG GLN 153 1HG GLN 153 -11.402 -1.963 -1.963 547 1HE2 GLN 153 1HE2 GLN 153 -11.638 -2.493 -2.493 548 2HE2 GLN 153 2HE2 GLN 153 -12.221 -4.007 -4.007 549 H GLU 154 H GLU 154 -10.350 -3.429 -3.429 550 HA GLU 154 HA GLU 154 -12.835 -3.118 -3.118 551 1HB GLU 154 2HB GLU 154 -10.266 -3.125 -3.125 552 2HB GLU 154 1HB GLU 154 -11.801 -3.977 -3.977 553 1HG GLU 154 2HG GLU 154 -11.148 -5.558 -5.558 554 2HG GLU 154 1HG GLU 154 -9.629 -4.574 -4.574 555 H LEU 155 H LEU 155 -9.762 -1.497 -1.497 556 HA LEU 155 HA LEU 155 -10.980 0.658 0.658 557 1HB LEU 155 2HB LEU 155 -8.315 -0.626 -0.626 558 2HB LEU 155 1HB LEU 155 -8.176 1.122 1.122 559 HG LEU 155 HG LEU 155 -9.819 1.246 1.246 560 1HD1 LEU 155 2HD1 LEU 155 -7.943 -1.163 -1.163 561 2HD1 LEU 155 1HD1 LEU 155 -8.901 -0.299 -0.299 562 3HD1 LEU 155 3HD1 LEU 155 -9.746 -1.211 -1.211 563 1HD2 LEU 155 1HD2 LEU 155 -7.763 2.557 2.557 564 2HD2 LEU 155 3HD2 LEU 155 -7.797 1.939 1.939 565 3HD2 LEU 155 2HD2 LEU 155 -6.742 1.142 1.142 566 H ALA 156 H ALA 156 -8.789 -0.006 -0.006 567 HA ALA 156 HA ALA 156 -8.632 2.880 2.880 568 1HB ALA 156 2HB ALA 156 -6.442 1.647 1.647 569 2HB ALA 156 1HB ALA 156 -7.089 0.727 0.727 570 3HB ALA 156 3HB ALA 156 -6.861 2.493 2.493 571 H VAL 157 H VAL 157 -9.700 3.677 3.677 572 HA VAL 157 HA VAL 157 -8.687 1.652 1.652 573 HB VAL 157 HB VAL 157 -10.165 2.340 2.340 574 1HG1 VAL 157 1HG1 VAL 157 -11.742 2.105 2.105 575 2HG1 VAL 157 3HG1 VAL 157 -12.443 1.913 1.913 576 3HG1 VAL 157 2HG1 VAL 157 -11.176 0.749 0.749 577 1HG2 VAL 157 3HG2 VAL 157 -10.097 4.960 4.960 578 2HG2 VAL 157 2HG2 VAL 157 -11.622 4.254 4.254 579 3HG2 VAL 157 1HG2 VAL 157 -11.383 4.500 4.500 580 H VAL 158 H VAL 158 -8.391 2.279 2.279 581 HA VAL 158 HA VAL 158 -6.168 3.952 3.952 582 HB VAL 158 HB VAL 158 -7.454 2.703 2.703 583 1HG1 VAL 158 3HG1 VAL 158 -5.340 3.942 3.942 584 2HG1 VAL 158 2HG1 VAL 158 -4.483 2.763 2.763 585 3HG1 VAL 158 1HG1 VAL 158 -5.335 2.172 2.172 586 1HG2 VAL 158 2HG2 VAL 158 -5.776 1.306 1.306 587 2HG2 VAL 158 1HG2 VAL 158 -7.472 0.888 0.888 588 3HG2 VAL 158 3HG2 VAL 158 -6.096 0.577 0.577 589 H GLU 159 H GLU 159 -5.761 5.654 5.654 590 HA GLU 159 HA GLU 159 -7.959 7.441 7.441 591 1HB GLU 159 2HB GLU 159 -5.654 8.051 8.051 592 2HB GLU 159 1HB GLU 159 -5.147 7.606 7.606 593 1HG GLU 159 2HG GLU 159 -6.551 9.553 9.553 594 2HG GLU 159 1HG GLU 159 -7.125 9.867 9.867 595 H SER 160 H SER 160 -5.819 5.580 5.580 596 HA SER 160 HA SER 160 -7.654 5.904 5.904 597 1HB SER 160 2HB SER 160 -5.843 7.816 7.816 598 2HB SER 160 1HB SER 160 -4.848 6.441 6.441 599 HG SER 160 HG SER 160 -5.863 7.672 7.672 600 H PHE 161 H PHE 161 -7.271 4.168 4.168 601 HA PHE 161 HA PHE 161 -4.948 2.490 2.490 602 1HB PHE 161 2HB PHE 161 -7.372 1.445 1.445 603 2HB PHE 161 1HB PHE 161 -7.162 1.361 1.361 604 HD1 PHE 161 1HD PHE 161 -5.141 0.376 0.376 605 HD2 PHE 161 2HD PHE 161 -6.382 -0.129 -0.129 606 HE1 PHE 161 1HE PHE 161 -3.307 -1.254 -1.254 607 HE2 PHE 161 2HE PHE 161 -4.722 -1.528 -1.528 608 HZ PHE 161 HZ PHE 161 -3.191 -2.375 -2.375 609 HA PRO 162 HA PRO 162 -4.934 5.036 5.036 610 1HB PRO 162 2HB PRO 162 -2.475 6.319 6.319 611 2HB PRO 162 1HB PRO 162 -3.873 6.589 6.589 612 1HG PRO 162 2HG PRO 162 -1.348 5.149 5.149 613 2HG PRO 162 1HG PRO 162 -2.632 5.830 5.830 614 1HD PRO 162 2HD PRO 162 -2.295 3.096 3.096 615 2HD PRO 162 1HD PRO 162 -3.301 3.555 3.555 616 H THR 163 H THR 163 -1.574 4.834 4.834 617 HA THR 163 HA THR 163 -1.662 3.325 3.325 618 HB THR 163 HB THR 163 -2.777 5.967 5.967 619 HG1 THR 163 1HG THR 163 -3.595 5.476 5.476 620 1HG2 THR 163 2HG2 THR 163 -0.641 5.507 5.507 621 2HG2 THR 163 1HG2 THR 163 -1.809 6.899 6.899 622 3HG2 THR 163 3HG2 THR 163 -0.692 6.735 6.735 623 H LYS 164 H LYS 164 -0.122 5.662 5.662 624 HA LYS 164 HA LYS 164 1.742 6.252 6.252 625 1HB LYS 164 2HB LYS 164 2.555 7.875 7.875 626 2HB LYS 164 1HB LYS 164 0.896 8.082 8.082 627 1HG LYS 164 2HG LYS 164 -0.113 6.950 6.950 628 2HG LYS 164 1HG LYS 164 1.503 6.582 6.582 629 1HD LYS 164 2HD LYS 164 1.962 9.028 9.028 630 2HD LYS 164 1HD LYS 164 0.337 9.392 9.392 631 1HE LYS 164 2HE LYS 164 -0.748 8.178 8.178 632 2HE LYS 164 1HE LYS 164 0.890 7.826 7.826 633 1HZ LYS 164 3HZ LYS 164 1.276 10.195 10.195 634 2HZ LYS 164 2HZ LYS 164 -0.272 10.517 10.517 635 3HZ LYS 164 1HZ LYS 164 -0.105 9.735 9.735 636 H ILE 165 H ILE 165 2.959 4.161 4.161 637 HA ILE 165 HA ILE 165 4.858 3.778 3.778 638 HB ILE 165 HB ILE 165 5.063 2.787 2.787 639 1HG1 ILE 165 2HG1 ILE 165 3.328 1.661 1.661 640 2HG1 ILE 165 1HG1 ILE 165 2.799 2.136 2.136 641 1HG2 ILE 165 2HG2 ILE 165 7.024 2.572 2.572 642 2HG2 ILE 165 1HG2 ILE 165 5.997 1.462 1.462 643 3HG2 ILE 165 3HG2 ILE 165 6.472 1.028 1.028 644 1HD1 ILE 165 2HD1 ILE 165 4.723 -0.230 -0.230 645 2HD1 ILE 165 1HD1 ILE 165 2.924 -0.357 -0.357 646 3HD1 ILE 165 3HD1 ILE 165 3.849 0.231 0.231 647 H GLU 166 H GLU 166 6.470 4.788 4.788 648 HA GLU 166 HA GLU 166 7.542 6.386 6.386 649 1HB GLU 166 2HB GLU 166 7.560 7.261 7.261 650 2HB GLU 166 1HB GLU 166 8.352 8.129 8.129 651 1HG GLU 166 2HG GLU 166 6.053 8.446 8.446 652 2HG GLU 166 1HG GLU 166 5.318 7.709 7.709 653 H GLY 167 H GLY 167 9.249 5.052 5.052 654 1HA GLY 167 2HA GLY 167 11.332 4.125 4.125 655 2HA GLY 167 1HA GLY 167 11.145 4.439 4.439 656 H ARG 168 H ARG 168 11.619 2.479 2.479 657 HA ARG 168 HA ARG 168 10.117 0.213 0.213 658 1HB ARG 168 2HB ARG 168 11.714 -1.183 -1.183 659 2HB ARG 168 1HB ARG 168 12.499 -0.250 -0.250 660 1HG ARG 168 2HG ARG 168 13.282 1.472 1.472 661 2HG ARG 168 1HG ARG 168 12.503 0.667 0.667 662 1HD ARG 168 2HD ARG 168 14.649 -0.705 -0.705 663 2HD ARG 168 1HD ARG 168 14.975 0.175 0.175 664 HE ARG 168 HE ARG 168 12.823 -1.703 -1.703 665 1HH1 ARG 168 1HH1 ARG 168 16.338 -1.536 -1.536 666 2HH1 ARG 168 2HH1 ARG 168 16.700 -2.971 -2.971 667 1HH2 ARG 168 1HH2 ARG 168 13.321 -3.643 -3.643 668 2HH2 ARG 168 2HH2 ARG 168 14.959 -4.187 -4.187 669 H GLN 169 H GLN 169 8.566 2.064 2.064 670 HA GLN 169 HA GLN 169 7.727 0.574 0.574 671 1HB GLN 169 2HB GLN 169 8.051 2.706 2.706 672 2HB GLN 169 1HB GLN 169 9.382 1.487 1.487 673 1HG GLN 169 2HG GLN 169 10.623 2.643 2.643 674 2HG GLN 169 1HG GLN 169 9.286 3.782 3.782 675 1HE2 GLN 169 1HE2 GLN 169 9.474 3.089 3.089 676 2HE2 GLN 169 2HE2 GLN 169 10.376 4.463 4.463 677 H MET 170 H MET 170 5.753 1.235 1.235 678 HA MET 170 HA MET 170 4.549 3.546 3.546 679 1HB MET 170 2HB MET 170 3.528 1.294 1.294 680 2HB MET 170 1HB MET 170 3.067 0.978 0.978 681 1HG MET 170 2HG MET 170 1.654 3.056 3.056 682 2HG MET 170 1HG MET 170 2.146 3.250 3.250 683 1HE MET 170 1HE MET 170 1.812 0.065 0.065 684 2HE MET 170 3HE MET 170 0.065 -0.094 -0.094 685 3HE MET 170 2HE MET 170 0.964 1.347 1.347 686 H ILE 171 H ILE 171 4.005 5.120 5.120 687 HA ILE 171 HA ILE 171 3.373 4.166 4.166 688 HB ILE 171 HB ILE 171 2.935 6.861 6.861 689 1HG1 ILE 171 2HG1 ILE 171 5.322 5.879 5.879 690 2HG1 ILE 171 1HG1 ILE 171 4.933 7.560 7.560 691 1HG2 ILE 171 2HG2 ILE 171 2.335 5.736 5.736 692 2HG2 ILE 171 1HG2 ILE 171 2.659 7.515 7.515 693 3HG2 ILE 171 3HG2 ILE 171 1.245 6.780 6.780 694 1HD1 ILE 171 3HD1 ILE 171 4.374 6.469 6.469 695 2HD1 ILE 171 2HD1 ILE 171 4.783 4.912 4.912 696 3HD1 ILE 171 1HD1 ILE 171 6.076 6.150 6.150 697 H MET 172 H MET 172 1.510 3.369 3.369 698 HA MET 172 HA MET 172 -1.045 4.281 4.281 699 1HB MET 172 2HB MET 172 -0.992 1.814 1.814 700 2HB MET 172 1HB MET 172 -0.236 1.715 1.715 701 1HG MET 172 2HG MET 172 -2.299 2.479 2.479 702 2HG MET 172 1HG MET 172 -2.988 2.949 2.949 703 1HE MET 172 2HE MET 172 -3.181 0.970 0.970 704 2HE MET 172 1HE MET 172 -3.875 -0.610 -0.610 705 3HE MET 172 3HE MET 172 -2.087 -0.386 -0.386 706 H VAL 173 H VAL 173 -2.150 5.608 5.608 707 HA VAL 173 HA VAL 173 -0.595 6.067 6.067 708 HB VAL 173 HB VAL 173 -3.105 7.475 7.475 709 1HG1 VAL 173 2HG1 VAL 173 -0.536 8.017 8.017 710 2HG1 VAL 173 1HG1 VAL 173 -1.887 9.229 9.229 711 3HG1 VAL 173 3HG1 VAL 173 -2.118 7.657 7.657 712 1HG2 VAL 173 2HG2 VAL 173 -0.247 7.973 7.973 713 2HG2 VAL 173 1HG2 VAL 173 -1.761 7.707 7.707 714 3HG2 VAL 173 3HG2 VAL 173 -1.548 9.222 9.222 715 H LEU 174 H LEU 174 -1.742 5.363 5.363 716 HA LEU 174 HA LEU 174 -4.505 4.227 4.227 717 1HB LEU 174 2HB LEU 174 -3.410 2.277 2.277 718 2HB LEU 174 1HB LEU 174 -2.149 2.936 2.936 719 HG LEU 174 HG LEU 174 -4.315 3.324 3.324 720 1HD1 LEU 174 1HD1 LEU 174 -4.752 0.948 0.948 721 2HD1 LEU 174 3HD1 LEU 174 -5.708 1.279 1.279 722 3HD1 LEU 174 2HD1 LEU 174 -5.688 2.507 2.507 723 1HD2 LEU 174 1HD2 LEU 174 -2.879 0.667 0.667 724 2HD2 LEU 174 3HD2 LEU 174 -2.285 2.148 2.148 725 3HD2 LEU 174 2HD2 LEU 174 -3.873 1.343 1.343 726 H ALA 175 H ALA 175 -5.975 4.985 4.985 727 HA ALA 175 HA ALA 175 -4.885 7.040 7.040 728 1HB ALA 175 1HB ALA 175 -7.275 6.827 6.827 729 2HB ALA 175 3HB ALA 175 -7.056 8.317 8.317 730 3HB ALA 175 2HB ALA 175 -5.832 7.936 7.936 731 HA PRO 176 HA PRO 176 -8.173 5.639 5.639 732 1HB PRO 176 2HB PRO 176 -9.278 8.470 8.470 733 2HB PRO 176 1HB PRO 176 -8.989 7.401 7.401 734 1HG PRO 176 2HG PRO 176 -7.237 9.432 9.432 735 2HG PRO 176 1HG PRO 176 -6.597 7.790 7.790 736 1HD PRO 176 2HD PRO 176 -6.897 9.005 9.005 737 2HD PRO 176 1HD PRO 176 -5.508 8.065 8.065 738 H LYS 177 H LYS 177 -10.278 4.787 4.787 739 HA LYS 177 HA LYS 177 -11.610 5.486 5.486 740 1HB LYS 177 2HB LYS 177 -11.716 3.176 3.176 741 2HB LYS 177 1HB LYS 177 -12.743 4.019 4.019 742 1HG LYS 177 2HG LYS 177 -14.327 4.570 4.570 743 2HG LYS 177 1HG LYS 177 -13.365 3.347 3.347 744 1HD LYS 177 2HD LYS 177 -14.961 2.978 2.978 745 2HD LYS 177 1HD LYS 177 -15.468 2.445 2.445 746 1HE LYS 177 2HE LYS 177 -13.529 0.842 0.842 747 2HE LYS 177 1HE LYS 177 -13.054 1.344 1.344 748 1HZ LYS 177 2HZ LYS 177 -15.662 0.172 0.172 749 2HZ LYS 177 1HZ LYS 177 -14.392 -0.625 -0.625 750 3HZ LYS 177 3HZ LYS 177 -15.215 0.650 0.650 751 H LYS 178 H LYS 178 -13.452 6.763 6.763 752 HA LYS 178 HA LYS 178 -14.189 8.499 8.499 753 1HB LYS 178 2HB LYS 178 -15.303 7.960 7.960 754 2HB LYS 178 1HB LYS 178 -16.039 9.156 9.156 755 1HG LYS 178 2HG LYS 178 -13.827 10.379 10.379 756 2HG LYS 178 1HG LYS 178 -13.195 9.260 9.260 757 1HD LYS 178 2HD LYS 178 -15.644 11.117 11.117 758 2HD LYS 178 1HD LYS 178 -13.985 11.467 11.467 759 1HE LYS 178 2HE LYS 178 -14.103 9.466 9.466 760 2HE LYS 178 1HE LYS 178 -15.794 9.141 9.141 761 1HZ LYS 178 1HZ LYS 178 -16.409 11.331 11.331 762 2HZ LYS 178 3HZ LYS 178 -14.830 11.613 11.613 763 3HZ LYS 178 2HZ LYS 178 -15.767 10.378 10.378 764 H LYS 179 H LYS 179 -15.045 7.212 7.212 765 HA LYS 179 HA LYS 179 -16.941 5.167 5.167 766 1HB LYS 179 2HB LYS 179 -15.980 6.339 6.339 767 2HB LYS 179 1HB LYS 179 -17.184 5.005 5.005 768 1HG LYS 179 2HG LYS 179 -15.533 3.597 3.597 769 2HG LYS 179 1HG LYS 179 -14.303 4.907 4.907 770 1HD LYS 179 2HD LYS 179 -14.316 4.815 4.815 771 2HD LYS 179 1HD LYS 179 -15.577 3.530 3.530 772 1HE LYS 179 2HE LYS 179 -12.753 3.248 3.248 773 2HE LYS 179 1HE LYS 179 -13.263 2.591 2.591 774 1HZ LYS 179 1HZ LYS 179 -14.471 1.906 1.906 775 2HZ LYS 179 3HZ LYS 179 -13.393 0.947 0.947 776 3HZ LYS 179 2HZ LYS 179 -14.938 1.294 1.294 777 H GLN 180 H GLN 180 -18.926 5.707 5.707 778 HA GLN 180 HA GLN 180 -20.195 8.002 8.002 779 1HB GLN 180 2HB GLN 180 -21.586 8.223 8.223 780 2HB GLN 180 1HB GLN 180 -19.842 8.506 8.506 781 1HG GLN 180 2HG GLN 180 -19.608 6.163 6.163 782 2HG GLN 180 1HG GLN 180 -21.374 5.891 5.891 783 1HE2 GLN 180 1HE2 GLN 180 -22.876 7.580 7.580 784 2HE2 GLN 180 2HE2 GLN 180 -22.481 8.198 8.198 Start of MODEL 15 1 HA VAL 90 HA VAL 90 -1.666 16.578 16.578 2 HB VAL 90 HB VAL 90 -3.501 16.854 16.854 3 1HG1 VAL 90 2HG1 VAL 90 -3.749 18.724 18.724 4 2HG1 VAL 90 1HG1 VAL 90 -4.858 17.641 17.641 5 3HG1 VAL 90 3HG1 VAL 90 -5.330 18.201 18.201 6 1HG2 VAL 90 3HG2 VAL 90 -5.204 15.206 15.206 7 2HG2 VAL 90 2HG2 VAL 90 -4.512 14.609 14.609 8 3HG2 VAL 90 1HG2 VAL 90 -5.771 15.873 15.873 9 H ILE 91 H ILE 91 -2.827 15.533 15.533 10 HA ILE 91 HA ILE 91 -2.595 12.622 12.622 11 HB ILE 91 HB ILE 91 -3.395 14.259 14.259 12 1HG1 ILE 91 2HG1 ILE 91 -5.122 14.472 14.472 13 2HG1 ILE 91 1HG1 ILE 91 -5.684 13.285 13.285 14 1HG2 ILE 91 3HG2 ILE 91 -3.312 11.208 11.208 15 2HG2 ILE 91 2HG2 ILE 91 -4.210 11.996 11.996 16 3HG2 ILE 91 1HG2 ILE 91 -2.429 12.141 12.141 17 1HD1 ILE 91 3HD1 ILE 91 -4.954 11.404 11.404 18 2HD1 ILE 91 2HD1 ILE 91 -4.513 12.640 12.640 19 3HD1 ILE 91 1HD1 ILE 91 -6.233 12.467 12.467 20 H GLN 92 H GLN 92 -0.765 11.491 11.491 21 HA GLN 92 HA GLN 92 1.445 13.066 13.066 22 1HB GLN 92 2HB GLN 92 1.404 10.171 10.171 23 2HB GLN 92 1HB GLN 92 2.830 11.272 11.272 24 1HG GLN 92 2HG GLN 92 0.378 11.389 11.389 25 2HG GLN 92 1HG GLN 92 2.019 10.806 10.806 26 1HE2 GLN 92 1HE2 GLN 92 -0.135 13.445 13.445 27 2HE2 GLN 92 2HE2 GLN 92 0.979 14.731 14.731 28 H VAL 93 H VAL 93 2.891 11.809 11.809 29 HA VAL 93 HA VAL 93 1.233 9.888 9.888 30 HB VAL 93 HB VAL 93 3.433 11.612 11.612 31 1HG1 VAL 93 3HG1 VAL 93 2.199 8.969 8.969 32 2HG1 VAL 93 2HG1 VAL 93 3.087 10.129 10.129 33 3HG1 VAL 93 1HG1 VAL 93 3.979 9.265 9.265 34 1HG2 VAL 93 2HG2 VAL 93 0.600 10.670 10.670 35 2HG2 VAL 93 1HG2 VAL 93 0.992 12.347 12.347 36 3HG2 VAL 93 3HG2 VAL 93 1.516 11.791 11.791 37 H LYS 94 H LYS 94 1.636 7.723 7.723 38 HA LYS 94 HA LYS 94 4.499 7.351 7.351 39 1HB LYS 94 2HB LYS 94 2.392 5.220 5.220 40 2HB LYS 94 1HB LYS 94 3.982 5.197 5.197 41 1HG LYS 94 2HG LYS 94 1.667 7.086 7.086 42 2HG LYS 94 1HG LYS 94 1.995 5.579 5.579 43 1HD LYS 94 2HD LYS 94 3.969 7.948 7.948 44 2HD LYS 94 1HD LYS 94 2.801 7.698 7.698 45 1HE LYS 94 2HE LYS 94 5.036 5.688 5.688 46 2HE LYS 94 1HE LYS 94 5.094 6.909 6.909 47 1HZ LYS 94 2HZ LYS 94 3.143 5.891 5.891 48 2HZ LYS 94 1HZ LYS 94 3.091 4.736 4.736 49 3HZ LYS 94 3HZ LYS 94 4.405 4.764 4.764 50 H GLU 95 H GLU 95 5.302 5.151 5.151 51 HA GLU 95 HA GLU 95 4.080 4.836 4.836 52 1HB GLU 95 2HB GLU 95 6.106 6.419 6.419 53 2HB GLU 95 1HB GLU 95 6.984 4.959 4.959 54 1HG GLU 95 2HG GLU 95 6.505 3.812 3.812 55 2HG GLU 95 1HG GLU 95 5.577 5.272 5.272 56 H ILE 96 H ILE 96 4.493 2.687 2.687 57 HA ILE 96 HA ILE 96 6.238 1.017 1.017 58 HB ILE 96 HB ILE 96 3.548 0.736 0.736 59 1HG1 ILE 96 2HG1 ILE 96 3.912 -1.733 -1.733 60 2HG1 ILE 96 1HG1 ILE 96 5.578 -1.578 -1.578 61 1HG2 ILE 96 1HG2 ILE 96 3.143 0.462 0.462 62 2HG2 ILE 96 3HG2 ILE 96 3.998 -1.155 -1.155 63 3HG2 ILE 96 2HG2 ILE 96 2.565 -0.899 -0.899 64 1HD1 ILE 96 3HD1 ILE 96 4.392 -0.050 -0.050 65 2HD1 ILE 96 2HD1 ILE 96 5.507 -1.459 -1.459 66 3HD1 ILE 96 1HD1 ILE 96 6.091 0.106 0.106 67 H LYS 97 H LYS 97 7.045 -0.850 -0.850 68 HA LYS 97 HA LYS 97 6.298 -0.226 -0.226 69 1HB LYS 97 2HB LYS 97 8.898 -1.599 -1.599 70 2HB LYS 97 1HB LYS 97 8.159 -1.337 -1.337 71 1HG LYS 97 2HG LYS 97 8.261 1.137 1.137 72 2HG LYS 97 1HG LYS 97 9.109 0.886 0.886 73 1HD LYS 97 2HD LYS 97 11.037 -0.125 -0.125 74 2HD LYS 97 1HD LYS 97 10.135 -0.149 -0.149 75 1HE LYS 97 2HE LYS 97 11.781 1.730 1.730 76 2HE LYS 97 1HE LYS 97 10.082 2.356 2.356 77 1HZ LYS 97 3HZ LYS 97 10.160 2.705 2.705 78 2HZ LYS 97 2HZ LYS 97 11.759 2.139 2.139 79 3HZ LYS 97 1HZ LYS 97 11.394 3.557 3.557 80 H PHE 98 H PHE 98 5.950 -1.981 -1.981 81 HA PHE 98 HA PHE 98 5.853 -4.581 -4.581 82 1HB PHE 98 2HB PHE 98 3.725 -3.299 -3.299 83 2HB PHE 98 1HB PHE 98 3.850 -5.077 -5.077 84 HD1 PHE 98 1HD PHE 98 4.192 -5.783 -5.783 85 HD2 PHE 98 2HD PHE 98 2.050 -2.612 -2.612 86 HE1 PHE 98 1HE PHE 98 2.981 -5.574 -5.574 87 HE2 PHE 98 2HE PHE 98 0.717 -2.381 -2.381 88 HZ PHE 98 HZ PHE 98 1.054 -4.060 -4.060 89 H ARG 99 H ARG 99 6.985 -6.028 -6.028 90 HA ARG 99 HA ARG 99 8.462 -5.021 -5.021 91 1HB ARG 99 2HB ARG 99 8.769 -7.381 -7.381 92 2HB ARG 99 1HB ARG 99 9.830 -7.029 -7.029 93 1HG ARG 99 2HG ARG 99 10.362 -4.774 -4.774 94 2HG ARG 99 1HG ARG 99 9.408 -5.250 -5.250 95 1HD ARG 99 2HD ARG 99 11.807 -5.628 -5.628 96 2HD ARG 99 1HD ARG 99 10.997 -7.251 -7.251 97 HE ARG 99 HE ARG 99 11.986 -6.337 -6.337 98 1HH1 ARG 99 1HH2 ARG 99 13.038 -7.599 -7.599 99 2HH1 ARG 99 2HH2 ARG 99 14.497 -8.310 -8.310 100 1HH2 ARG 99 1HH1 ARG 99 13.963 -7.312 -7.312 101 2HH2 ARG 99 2HH1 ARG 99 15.030 -8.145 -8.145 102 HA PRO 100 HA PRO 100 6.436 -7.568 -7.568 103 1HB PRO 100 2HB PRO 100 8.616 -8.925 -8.925 104 2HB PRO 100 1HB PRO 100 8.099 -7.230 -7.230 105 1HG PRO 100 2HG PRO 100 10.306 -8.103 -8.103 106 2HG PRO 100 1HG PRO 100 10.317 -6.776 -6.776 107 1HD PRO 100 2HD PRO 100 9.878 -6.140 -6.140 108 2HD PRO 100 1HD PRO 100 8.724 -5.446 -5.446 109 H GLY 101 H GLY 101 5.477 -9.604 -9.604 110 1HA GLY 101 2HA GLY 101 4.948 -11.640 -11.640 111 2HA GLY 101 1HA GLY 101 6.645 -11.786 -11.786 112 H THR 102 H THR 102 6.691 -12.005 -12.005 113 HA THR 102 HA THR 102 6.550 -11.938 -11.938 114 HB THR 102 HB THR 102 5.559 -9.093 -9.093 115 HG1 THR 102 1HG THR 102 8.174 -10.237 -10.237 116 1HG2 THR 102 3HG2 THR 102 6.940 -10.898 -10.898 117 2HG2 THR 102 2HG2 THR 102 7.123 -9.091 -9.091 118 3HG2 THR 102 1HG2 THR 102 5.499 -9.853 -9.853 119 H ASP 103 H ASP 103 5.067 -13.299 -13.299 120 HA ASP 103 HA ASP 103 2.488 -12.140 -12.140 121 1HB ASP 103 2HB ASP 103 2.975 -13.889 -13.889 122 2HB ASP 103 1HB ASP 103 3.082 -15.016 -15.016 123 H GLU 104 H GLU 104 1.489 -14.400 -14.400 124 HA GLU 104 HA GLU 104 0.637 -13.023 -13.023 125 1HB GLU 104 2HB GLU 104 1.384 -15.911 -15.911 126 2HB GLU 104 1HB GLU 104 0.272 -14.940 -14.940 127 1HG GLU 104 2HG GLU 104 -1.270 -14.623 -14.623 128 2HG GLU 104 1HG GLU 104 -0.148 -15.581 -15.581 129 H GLY 105 H GLY 105 3.342 -14.992 -14.992 130 1HA GLY 105 2HA GLY 105 4.397 -14.959 -14.959 131 2HA GLY 105 1HA GLY 105 5.142 -14.406 -14.406 132 H ASP 106 H ASP 106 5.417 -12.600 -12.600 133 HA ASP 106 HA ASP 106 6.717 -10.868 -10.868 134 1HB ASP 106 2HB ASP 106 6.201 -11.262 -11.262 135 2HB ASP 106 1HB ASP 106 7.323 -10.034 -10.034 136 H TYR 107 H TYR 107 4.031 -11.221 -11.221 137 HA TYR 107 HA TYR 107 3.897 -8.414 -8.414 138 1HB TYR 107 2HB TYR 107 3.312 -10.337 -10.337 139 2HB TYR 107 1HB TYR 107 1.951 -10.788 -10.788 140 HD1 TYR 107 2HD TYR 107 2.048 -7.217 -7.217 141 HD2 TYR 107 1HD TYR 107 0.998 -10.900 -10.900 142 HE1 TYR 107 2HE TYR 107 -0.096 -6.258 -6.258 143 HE2 TYR 107 1HE TYR 107 -0.787 -9.772 -9.772 144 HH TYR 107 HH TYR 107 -1.782 -6.500 -6.500 145 H GLN 108 H GLN 108 1.076 -10.333 -10.333 146 HA GLN 108 HA GLN 108 0.009 -8.235 -8.235 147 1HB GLN 108 2HB GLN 108 -0.942 -10.610 -10.610 148 2HB GLN 108 1HB GLN 108 -1.748 -9.396 -9.396 149 1HG GLN 108 2HG GLN 108 -0.038 -11.563 -11.563 150 2HG GLN 108 1HG GLN 108 -1.594 -11.906 -11.906 151 1HE2 GLN 108 1HE2 GLN 108 -0.559 -8.712 -8.712 152 2HE2 GLN 108 2HE2 GLN 108 -1.651 -8.767 -8.767 153 H VAL 109 H VAL 109 2.575 -9.631 -9.631 154 HA VAL 109 HA VAL 109 2.173 -8.791 -8.791 155 HB VAL 109 HB VAL 109 4.701 -9.014 -9.014 156 1HG1 VAL 109 3HG1 VAL 109 4.391 -8.283 -8.283 157 2HG1 VAL 109 2HG1 VAL 109 5.905 -8.939 -8.939 158 3HG1 VAL 109 1HG1 VAL 109 5.290 -7.359 -7.359 159 1HG2 VAL 109 3HG2 VAL 109 3.424 -11.137 -11.137 160 2HG2 VAL 109 2HG2 VAL 109 5.077 -11.054 -11.054 161 3HG2 VAL 109 1HG2 VAL 109 3.626 -10.733 -10.733 162 H LYS 110 H LYS 110 3.362 -7.194 -7.194 163 HA LYS 110 HA LYS 110 3.387 -4.647 -4.647 164 1HB LYS 110 2HB LYS 110 4.314 -5.626 -5.626 165 2HB LYS 110 1HB LYS 110 4.284 -3.914 -3.914 166 1HG LYS 110 2HG LYS 110 5.952 -6.187 -6.187 167 2HG LYS 110 1HG LYS 110 6.398 -4.498 -4.498 168 1HD LYS 110 2HD LYS 110 5.527 -3.529 -3.529 169 2HD LYS 110 1HD LYS 110 5.131 -5.168 -5.168 170 1HE LYS 110 2HE LYS 110 7.555 -5.799 -5.799 171 2HE LYS 110 1HE LYS 110 7.972 -4.152 -4.152 172 1HZ LYS 110 1HZ LYS 110 6.624 -4.740 -4.740 173 2HZ LYS 110 3HZ LYS 110 8.256 -4.321 -4.321 174 3HZ LYS 110 2HZ LYS 110 7.034 -3.203 -3.203 175 H LEU 111 H LEU 111 1.145 -6.387 -6.387 176 HA LEU 111 HA LEU 111 -0.323 -4.076 -4.076 177 1HB LEU 111 2HB LEU 111 -0.551 -6.468 -6.468 178 2HB LEU 111 1HB LEU 111 -1.426 -6.856 -6.856 179 HG LEU 111 HG LEU 111 -2.263 -4.562 -4.562 180 1HD1 LEU 111 3HD1 LEU 111 -1.902 -6.575 -6.575 181 2HD1 LEU 111 2HD1 LEU 111 -3.011 -7.526 -7.526 182 3HD1 LEU 111 1HD1 LEU 111 -3.646 -6.137 -6.137 183 1HD2 LEU 111 2HD2 LEU 111 -3.757 -6.472 -6.472 184 2HD2 LEU 111 1HD2 LEU 111 -3.513 -4.691 -4.691 185 3HD2 LEU 111 3HD2 LEU 111 -4.602 -5.335 -5.335 186 H ARG 112 H ARG 112 0.242 -6.207 -6.207 187 HA ARG 112 HA ARG 112 -1.555 -5.135 -5.135 188 1HB ARG 112 2HB ARG 112 0.289 -7.128 -7.128 189 2HB ARG 112 1HB ARG 112 1.026 -5.941 -5.941 190 1HG ARG 112 2HG ARG 112 -0.997 -5.923 -5.923 191 2HG ARG 112 1HG ARG 112 -1.868 -6.971 -6.971 192 1HD ARG 112 2HD ARG 112 0.672 -7.817 -7.817 193 2HD ARG 112 1HD ARG 112 -1.025 -8.334 -8.334 194 HE ARG 112 HE ARG 112 -0.763 -8.989 -8.989 195 1HH1 ARG 112 1HH1 ARG 112 1.130 -9.692 -9.692 196 2HH1 ARG 112 2HH1 ARG 112 1.762 -11.189 -11.189 197 1HH2 ARG 112 1HH2 ARG 112 0.103 -11.012 -11.012 198 2HH2 ARG 112 2HH2 ARG 112 1.173 -11.950 -11.950 199 H SER 113 H SER 113 1.956 -4.130 -4.130 200 HA SER 113 HA SER 113 2.095 -2.234 -2.234 201 1HB SER 113 2HB SER 113 3.945 -2.993 -2.993 202 2HB SER 113 1HB SER 113 3.318 -2.107 -2.107 203 HG SER 113 HG SER 113 4.866 -0.946 -0.946 204 H LEU 114 H LEU 114 0.717 -1.976 -1.976 205 HA LEU 114 HA LEU 114 0.145 0.811 0.811 206 1HB LEU 114 2HB LEU 114 -1.197 -1.601 -1.601 207 2HB LEU 114 1HB LEU 114 -1.609 0.106 0.106 208 HG LEU 114 HG LEU 114 1.234 -1.038 -1.038 209 1HD1 LEU 114 1HD1 LEU 114 -0.409 -2.280 -2.280 210 2HD1 LEU 114 3HD1 LEU 114 -1.016 -0.740 -0.740 211 3HD1 LEU 114 2HD1 LEU 114 0.665 -1.292 -1.292 212 1HD2 LEU 114 3HD2 LEU 114 -0.164 1.560 1.560 213 2HD2 LEU 114 2HD2 LEU 114 1.085 1.381 1.381 214 3HD2 LEU 114 1HD2 LEU 114 1.513 1.105 1.105 215 H ILE 115 H ILE 115 -1.864 -2.056 -2.056 216 HA ILE 115 HA ILE 115 -4.192 -0.611 -0.611 217 HB ILE 115 HB ILE 115 -3.509 -2.329 -2.329 218 1HG1 ILE 115 2HG1 ILE 115 -2.821 -3.761 -3.761 219 2HG1 ILE 115 1HG1 ILE 115 -4.291 -4.354 -4.354 220 1HG2 ILE 115 3HG2 ILE 115 -5.897 -1.531 -1.531 221 2HG2 ILE 115 2HG2 ILE 115 -6.028 -2.754 -2.754 222 3HG2 ILE 115 1HG2 ILE 115 -5.555 -1.061 -1.061 223 1HD1 ILE 115 1HD1 ILE 115 -5.682 -3.365 -3.365 224 2HD1 ILE 115 3HD1 ILE 115 -4.098 -2.933 -2.933 225 3HD1 ILE 115 2HD1 ILE 115 -4.557 -4.670 -4.670 226 H ARG 116 H ARG 116 -1.592 -1.057 -1.057 227 HA ARG 116 HA ARG 116 -2.372 0.419 0.419 228 1HB ARG 116 2HB ARG 116 -0.327 -1.147 -1.147 229 2HB ARG 116 1HB ARG 116 0.551 0.311 0.311 230 1HG ARG 116 2HG ARG 116 -0.916 0.279 0.279 231 2HG ARG 116 1HG ARG 116 0.680 -0.522 -0.522 232 1HD ARG 116 2HD ARG 116 1.762 1.587 1.587 233 2HD ARG 116 1HD ARG 116 0.193 2.491 2.491 234 HE ARG 116 HE ARG 116 0.434 1.200 1.200 235 1HH1 ARG 116 1HH1 ARG 116 2.559 3.310 3.310 236 2HH1 ARG 116 2HH1 ARG 116 3.324 4.041 4.041 237 1HH2 ARG 116 1HH2 ARG 116 1.472 2.203 2.203 238 2HH2 ARG 116 2HH2 ARG 116 2.695 3.407 3.407 239 H PHE 117 H PHE 117 -0.602 1.570 1.570 240 HA PHE 117 HA PHE 117 -0.276 4.108 4.108 241 1HB PHE 117 2HB PHE 117 -0.755 2.971 2.971 242 2HB PHE 117 1HB PHE 117 -0.034 4.580 4.580 243 HD1 PHE 117 1HD PHE 117 1.380 2.540 2.540 244 HD2 PHE 117 2HD PHE 117 1.111 3.132 3.132 245 HE1 PHE 117 1HE PHE 117 3.734 1.844 1.844 246 HE2 PHE 117 2HE PHE 117 3.487 2.316 2.316 247 HZ PHE 117 HZ PHE 117 4.802 1.740 1.740 248 H LEU 118 H LEU 118 -2.919 2.852 2.852 249 HA LEU 118 HA LEU 118 -4.317 5.280 5.280 250 1HB LEU 118 2HB LEU 118 -4.817 2.406 2.406 251 2HB LEU 118 1HB LEU 118 -6.158 3.621 3.621 252 HG LEU 118 HG LEU 118 -3.561 4.652 4.652 253 1HD1 LEU 118 3HD1 LEU 118 -3.883 2.038 2.038 254 2HD1 LEU 118 2HD1 LEU 118 -4.672 2.962 2.962 255 3HD1 LEU 118 1HD1 LEU 118 -2.971 3.378 3.378 256 1HD2 LEU 118 1HD2 LEU 118 -5.876 5.633 5.633 257 2HD2 LEU 118 3HD2 LEU 118 -4.965 5.550 5.550 258 3HD2 LEU 118 2HD2 LEU 118 -6.299 4.370 4.370 259 H GLU 119 H GLU 119 -4.536 2.734 2.734 260 HA GLU 119 HA GLU 119 -6.958 3.737 3.737 261 1HB GLU 119 2HB GLU 119 -7.080 1.948 1.948 262 2HB GLU 119 1HB GLU 119 -6.088 1.354 1.354 263 1HG GLU 119 2HG GLU 119 -4.990 0.419 0.419 264 2HG GLU 119 1HG GLU 119 -4.003 1.892 1.892 265 H GLU 120 H GLU 120 -3.523 4.353 4.353 266 HA GLU 120 HA GLU 120 -4.256 5.989 5.989 267 1HB GLU 120 2HB GLU 120 -1.937 6.683 6.683 268 2HB GLU 120 1HB GLU 120 -2.107 4.893 4.893 269 1HG GLU 120 2HG GLU 120 -1.238 4.891 4.891 270 2HG GLU 120 1HG GLU 120 -1.113 6.689 6.689 271 H GLY 121 H GLY 121 -4.697 6.240 6.240 272 1HA GLY 121 2HA GLY 121 -5.543 7.829 7.829 273 2HA GLY 121 1HA GLY 121 -5.297 8.977 8.977 274 H ASP 122 H ASP 122 -3.460 7.107 7.107 275 HA ASP 122 HA ASP 122 -2.119 9.613 9.613 276 1HB ASP 122 2HB ASP 122 -0.805 6.919 6.919 277 2HB ASP 122 1HB ASP 122 -0.051 8.535 8.535 278 H LYS 123 H LYS 123 -1.373 9.452 9.452 279 HA LYS 123 HA LYS 123 -3.299 7.978 7.978 280 1HB LYS 123 2HB LYS 123 -3.173 10.558 10.558 281 2HB LYS 123 1HB LYS 123 -1.477 10.394 10.394 282 1HG LYS 123 2HG LYS 123 -4.025 9.276 9.276 283 2HG LYS 123 1HG LYS 123 -3.293 10.821 10.821 284 1HD LYS 123 2HD LYS 123 -1.729 8.166 8.166 285 2HD LYS 123 1HD LYS 123 -2.857 8.690 8.690 286 1HE LYS 123 2HE LYS 123 -0.234 9.869 9.869 287 2HE LYS 123 1HE LYS 123 -0.624 9.263 9.263 288 1HZ LYS 123 1HZ LYS 123 -1.761 11.715 11.715 289 2HZ LYS 123 3HZ LYS 123 -0.534 11.661 11.661 290 3HZ LYS 123 2HZ LYS 123 -2.099 11.121 11.121 291 H ALA 124 H ALA 124 -2.221 5.936 5.936 292 HA ALA 124 HA ALA 124 0.698 6.110 6.110 293 1HB ALA 124 1HB ALA 124 -0.497 4.143 4.143 294 2HB ALA 124 3HB ALA 124 -1.097 3.696 3.696 295 3HB ALA 124 2HB ALA 124 0.672 3.670 3.670 296 H LYS 125 H LYS 125 1.988 5.748 5.748 297 HA LYS 125 HA LYS 125 0.160 5.229 5.229 298 1HB LYS 125 2HB LYS 125 1.110 7.598 7.598 299 2HB LYS 125 1HB LYS 125 2.725 6.941 6.941 300 1HG LYS 125 2HG LYS 125 3.056 6.093 6.093 301 2HG LYS 125 1HG LYS 125 1.396 6.624 6.624 302 1HD LYS 125 2HD LYS 125 3.591 8.515 8.515 303 2HD LYS 125 1HD LYS 125 3.394 8.121 8.121 304 1HE LYS 125 2HE LYS 125 1.077 9.027 9.027 305 2HE LYS 125 1HE LYS 125 1.275 9.522 9.522 306 1HZ LYS 125 2HZ LYS 125 3.155 10.867 10.867 307 2HZ LYS 125 1HZ LYS 125 2.940 10.422 10.422 308 3HZ LYS 125 3HZ LYS 125 1.741 11.320 11.320 309 H ILE 126 H ILE 126 0.635 3.368 3.368 310 HA ILE 126 HA ILE 126 2.939 1.843 1.843 311 HB ILE 126 HB ILE 126 1.095 1.578 1.578 312 1HG1 ILE 126 2HG1 ILE 126 -0.435 1.910 1.910 313 2HG1 ILE 126 1HG1 ILE 126 -0.363 0.155 0.155 314 1HG2 ILE 126 2HG2 ILE 126 2.721 -0.308 -0.308 315 2HG2 ILE 126 1HG2 ILE 126 1.504 -0.834 -0.834 316 3HG2 ILE 126 3HG2 ILE 126 3.012 -0.004 -0.004 317 1HD1 ILE 126 2HD1 ILE 126 1.172 -0.094 -0.094 318 2HD1 ILE 126 1HD1 ILE 126 0.803 1.640 1.640 319 3HD1 ILE 126 3HD1 ILE 126 -0.530 0.407 0.407 320 H THR 127 H THR 127 4.827 1.706 1.706 321 HA THR 127 HA THR 127 4.734 2.921 2.921 322 HB THR 127 HB THR 127 7.145 2.518 2.518 323 HG1 THR 127 1HG THR 127 5.682 4.860 4.860 324 1HG2 THR 127 3HG2 THR 127 6.640 3.870 3.870 325 2HG2 THR 127 2HG2 THR 127 8.126 4.179 4.179 326 3HG2 THR 127 1HG2 THR 127 7.793 2.521 2.521 327 H LEU 128 H LEU 128 4.835 1.368 1.368 328 HA LEU 128 HA LEU 128 5.858 -1.243 -1.243 329 1HB LEU 128 2HB LEU 128 4.259 -0.283 -0.283 330 2HB LEU 128 1HB LEU 128 5.727 -0.865 -0.865 331 HG LEU 128 HG LEU 128 4.229 -2.425 -2.425 332 1HD1 LEU 128 1HD1 LEU 128 2.608 -1.327 -1.327 333 2HD1 LEU 128 3HD1 LEU 128 3.250 -2.212 -2.212 334 3HD1 LEU 128 2HD1 LEU 128 2.524 -3.121 -3.121 335 1HD2 LEU 128 2HD2 LEU 128 5.826 -3.462 -3.462 336 2HD2 LEU 128 1HD2 LEU 128 6.207 -3.627 -3.627 337 3HD2 LEU 128 3HD2 LEU 128 4.771 -4.488 -4.488 338 H ARG 129 H ARG 129 7.742 -2.177 -2.177 339 HA ARG 129 HA ARG 129 9.450 -0.383 -0.383 340 1HB ARG 129 2HB ARG 129 10.014 0.106 0.106 341 2HB ARG 129 1HB ARG 129 10.172 -1.660 -1.660 342 1HG ARG 129 2HG ARG 129 12.141 -1.767 -1.767 343 2HG ARG 129 1HG ARG 129 11.663 -0.241 -0.241 344 1HD ARG 129 2HD ARG 129 12.280 1.048 1.048 345 2HD ARG 129 1HD ARG 129 12.783 -0.505 -0.505 346 HE ARG 129 HE ARG 129 14.154 -0.369 -0.369 347 1HH1 ARG 129 1HH2 ARG 129 13.900 1.432 1.432 348 2HH1 ARG 129 2HH2 ARG 129 15.521 2.038 2.038 349 1HH2 ARG 129 1HH1 ARG 129 16.361 0.457 0.457 350 2HH2 ARG 129 2HH1 ARG 129 16.941 1.475 1.475 351 H PHE 130 H PHE 130 9.191 -1.575 -1.575 352 HA PHE 130 HA PHE 130 8.822 -4.459 -4.459 353 1HB PHE 130 2HB PHE 130 9.487 -2.331 -2.331 354 2HB PHE 130 1HB PHE 130 8.943 -4.101 -4.101 355 HD1 PHE 130 2HD PHE 130 6.784 -4.907 -4.907 356 HD2 PHE 130 1HD PHE 130 8.005 -0.766 -0.766 357 HE1 PHE 130 2HE PHE 130 4.511 -4.136 -4.136 358 HE2 PHE 130 1HE PHE 130 5.645 -0.120 -0.120 359 HZ PHE 130 HZ PHE 130 3.863 -1.833 -1.833 360 H ARG 131 H ARG 131 10.707 -5.771 -5.771 361 HA ARG 131 HA ARG 131 13.340 -4.522 -4.522 362 1HB ARG 131 2HB ARG 131 12.619 -7.114 -7.114 363 2HB ARG 131 1HB ARG 131 14.260 -6.479 -6.479 364 1HG ARG 131 2HG ARG 131 12.245 -7.600 -7.600 365 2HG ARG 131 1HG ARG 131 13.748 -8.355 -8.355 366 1HD ARG 131 2HD ARG 131 14.469 -7.570 -7.570 367 2HD ARG 131 1HD ARG 131 14.922 -6.154 -6.154 368 HE ARG 131 HE ARG 131 12.187 -5.949 -5.949 369 1HH1 ARG 131 1HH1 ARG 131 15.637 -5.609 -5.609 370 2HH1 ARG 131 2HH1 ARG 131 15.375 -4.504 -4.504 371 1HH2 ARG 131 1HH2 ARG 131 11.832 -4.444 -4.444 372 2HH2 ARG 131 2HH2 ARG 131 13.181 -3.838 -3.838 373 H GLY 132 H GLY 132 13.504 -2.790 -2.790 374 1HA GLY 132 2HA GLY 132 11.335 -2.239 -2.239 375 2HA GLY 132 1HA GLY 132 12.889 -1.382 -1.382 376 H ARG 133 H ARG 133 10.433 -2.514 -2.514 377 HA ARG 133 HA ARG 133 9.841 -2.876 -2.876 378 1HB ARG 133 2HB ARG 133 10.619 -1.591 -1.591 379 2HB ARG 133 1HB ARG 133 10.747 -0.624 -0.624 380 1HG ARG 133 2HG ARG 133 13.242 -1.054 -1.054 381 2HG ARG 133 1HG ARG 133 13.082 -2.004 -2.004 382 1HD ARG 133 2HD ARG 133 13.836 0.220 0.220 383 2HD ARG 133 1HD ARG 133 12.098 0.101 0.101 384 HE ARG 133 HE ARG 133 11.517 1.609 1.609 385 1HH1 ARG 133 1HH2 ARG 133 14.991 0.757 0.757 386 2HH1 ARG 133 2HH2 ARG 133 15.398 2.033 2.033 387 1HH2 ARG 133 1HH1 ARG 133 12.099 3.323 3.323 388 2HH2 ARG 133 2HH1 ARG 133 13.742 3.505 3.505 389 H GLU 134 H GLU 134 11.475 -4.949 -4.949 390 HA GLU 134 HA GLU 134 11.398 -6.456 -6.456 391 1HB GLU 134 2HB GLU 134 12.970 -8.157 -8.157 392 2HB GLU 134 1HB GLU 134 13.762 -6.670 -6.670 393 1HG GLU 134 2HG GLU 134 13.865 -5.699 -5.699 394 2HG GLU 134 1HG GLU 134 13.061 -7.164 -7.164 395 H MET 135 H MET 135 10.845 -5.692 -5.692 396 HA MET 135 HA MET 135 8.753 -7.704 -7.704 397 1HB MET 135 2HB MET 135 10.460 -6.842 -6.842 398 2HB MET 135 1HB MET 135 9.045 -7.920 -7.920 399 1HG MET 135 2HG MET 135 11.686 -8.534 -8.534 400 2HG MET 135 1HG MET 135 11.160 -9.170 -9.170 401 1HE MET 135 3HE MET 135 12.034 -11.331 -11.331 402 2HE MET 135 2HE MET 135 11.298 -12.121 -12.121 403 3HE MET 135 1HE MET 135 12.184 -10.569 -10.569 404 H ALA 136 H ALA 136 9.427 -4.405 -4.405 405 HA ALA 136 HA ALA 136 7.316 -3.652 -3.652 406 1HB ALA 136 1HB ALA 136 8.964 -1.895 -1.895 407 2HB ALA 136 3HB ALA 136 8.395 -1.988 -1.988 408 3HB ALA 136 2HB ALA 136 7.259 -1.486 -1.486 409 H HIS 137 H HIS 137 5.600 -4.779 -4.779 410 HA HIS 137 HA HIS 137 4.216 -4.408 -4.408 411 1HB HIS 137 2HB HIS 137 3.867 -6.920 -6.920 412 2HB HIS 137 1HB HIS 137 3.102 -6.469 -6.469 413 HD1 HIS 137 1HD HIS 137 3.905 -8.813 -8.813 414 HD2 HIS 137 2HD HIS 137 7.025 -6.136 -6.136 415 HE1 HIS 137 1HE HIS 137 6.035 -9.727 -9.727 416 H GLN 138 H GLN 138 1.764 -4.580 -4.580 417 HA GLN 138 HA GLN 138 1.106 -3.727 -3.727 418 1HB GLN 138 2HB GLN 138 -0.655 -3.609 -3.609 419 2HB GLN 138 1HB GLN 138 -1.093 -3.026 -3.026 420 1HG GLN 138 2HG GLN 138 0.859 -1.392 -1.392 421 2HG GLN 138 1HG GLN 138 1.121 -1.883 -1.883 422 1HE2 GLN 138 1HE2 GLN 138 0.054 -0.744 -0.744 423 2HE2 GLN 138 2HE2 GLN 138 -1.379 0.200 0.200 424 H GLN 139 H GLN 139 1.763 -6.432 -6.432 425 HA GLN 139 HA GLN 139 -0.524 -7.969 -7.969 426 1HB GLN 139 2HB GLN 139 2.310 -8.981 -8.981 427 2HB GLN 139 1HB GLN 139 0.835 -9.944 -9.944 428 1HG GLN 139 2HG GLN 139 1.567 -7.810 -7.810 429 2HG GLN 139 1HG GLN 139 1.577 -9.589 -9.589 430 1HE2 GLN 139 1HE2 GLN 139 -0.656 -10.679 -10.679 431 2HE2 GLN 139 2HE2 GLN 139 -2.088 -9.918 -9.918 432 H ILE 140 H ILE 140 2.966 -7.176 -7.176 433 HA ILE 140 HA ILE 140 3.457 -8.382 -8.382 434 HB ILE 140 HB ILE 140 4.802 -6.554 -6.554 435 1HG1 ILE 140 2HG1 ILE 140 5.012 -9.541 -9.541 436 2HG1 ILE 140 1HG1 ILE 140 4.189 -8.976 -8.976 437 1HG2 ILE 140 1HG2 ILE 140 5.759 -8.063 -8.063 438 2HG2 ILE 140 3HG2 ILE 140 6.805 -7.139 -7.139 439 3HG2 ILE 140 2HG2 ILE 140 5.593 -6.270 -6.270 440 1HD1 ILE 140 2HD1 ILE 140 6.348 -8.024 -8.024 441 2HD1 ILE 140 1HD1 ILE 140 7.179 -8.748 -8.748 442 3HD1 ILE 140 3HD1 ILE 140 6.378 -9.814 -9.814 443 H GLY 141 H GLY 141 2.460 -5.253 -5.253 444 1HA GLY 141 2HA GLY 141 2.633 -4.343 -4.343 445 2HA GLY 141 1HA GLY 141 1.863 -3.472 -3.472 446 H MET 142 H MET 142 -0.233 -4.828 -4.828 447 HA MET 142 HA MET 142 -1.827 -4.236 -4.236 448 1HB MET 142 2HB MET 142 -2.498 -4.403 -4.403 449 2HB MET 142 1HB MET 142 -3.704 -3.973 -3.973 450 1HG MET 142 2HG MET 142 -2.069 -2.089 -2.089 451 2HG MET 142 1HG MET 142 -1.272 -2.326 -2.326 452 1HE MET 142 1HE MET 142 -2.533 0.323 0.323 453 2HE MET 142 3HE MET 142 -1.674 0.211 0.211 454 3HE MET 142 2HE MET 142 -3.275 1.014 1.014 455 H GLU 143 H GLU 143 -0.600 -7.179 -7.179 456 HA GLU 143 HA GLU 143 -3.048 -8.130 -8.130 457 1HB GLU 143 2HB GLU 143 -0.860 -9.659 -9.659 458 2HB GLU 143 1HB GLU 143 -0.387 -9.302 -9.302 459 1HG GLU 143 2HG GLU 143 -1.530 -11.268 -11.268 460 2HG GLU 143 1HG GLU 143 -2.853 -10.142 -10.142 461 H VAL 144 H VAL 144 0.066 -6.959 -6.959 462 HA VAL 144 HA VAL 144 -0.347 -7.596 -7.596 463 HB VAL 144 HB VAL 144 1.624 -5.635 -5.635 464 1HG1 VAL 144 3HG1 VAL 144 1.199 -7.259 -7.259 465 2HG1 VAL 144 2HG1 VAL 144 2.810 -6.646 -6.646 466 3HG1 VAL 144 1HG1 VAL 144 1.475 -5.481 -5.481 467 1HG2 VAL 144 3HG2 VAL 144 1.126 -8.630 -8.630 468 2HG2 VAL 144 2HG2 VAL 144 1.646 -7.731 -7.731 469 3HG2 VAL 144 1HG2 VAL 144 2.844 -7.994 -7.994 470 H LEU 145 H LEU 145 -0.176 -4.467 -4.467 471 HA LEU 145 HA LEU 145 -1.005 -2.844 -2.844 472 1HB LEU 145 2HB LEU 145 -1.740 -2.696 -2.696 473 2HB LEU 145 1HB LEU 145 -1.962 -1.351 -1.351 474 HG LEU 145 HG LEU 145 0.683 -2.596 -2.596 475 1HD1 LEU 145 1HD1 LEU 145 -0.803 0.019 0.019 476 2HD1 LEU 145 3HD1 LEU 145 0.950 -0.208 -0.208 477 3HD1 LEU 145 2HD1 LEU 145 -0.277 -1.296 -1.296 478 1HD2 LEU 145 3HD2 LEU 145 -0.103 -0.585 -0.585 479 2HD2 LEU 145 2HD2 LEU 145 0.902 -2.049 -2.049 480 3HD2 LEU 145 1HD2 LEU 145 1.577 -0.606 -0.606 481 H ASN 146 H ASN 146 -3.012 -4.238 -4.238 482 HA ASN 146 HA ASN 146 -5.612 -3.394 -3.394 483 1HB ASN 146 2HB ASN 146 -4.198 -4.946 -4.946 484 2HB ASN 146 1HB ASN 146 -5.430 -6.014 -6.014 485 1HD2 ASN 146 1HD2 ASN 146 -5.777 -6.145 -6.145 486 2HD2 ASN 146 2HD2 ASN 146 -6.946 -5.130 -5.130 487 H ARG 147 H ARG 147 -3.695 -6.385 -6.385 488 HA ARG 147 HA ARG 147 -6.027 -7.084 -7.084 489 1HB ARG 147 2HB ARG 147 -4.794 -8.739 -8.739 490 2HB ARG 147 1HB ARG 147 -3.227 -8.022 -8.022 491 1HG ARG 147 2HG ARG 147 -3.374 -9.059 -9.059 492 2HG ARG 147 1HG ARG 147 -5.202 -8.971 -8.971 493 1HD ARG 147 2HD ARG 147 -4.281 -11.376 -11.376 494 2HD ARG 147 1HD ARG 147 -5.165 -10.920 -10.920 495 HE ARG 147 HE ARG 147 -2.430 -10.143 -10.143 496 1HH1 ARG 147 1HH2 ARG 147 -4.401 -13.084 -13.084 497 2HH1 ARG 147 2HH2 ARG 147 -3.304 -14.118 -14.118 498 1HH2 ARG 147 1HH1 ARG 147 -0.944 -11.555 -11.555 499 2HH2 ARG 147 2HH1 ARG 147 -1.312 -13.236 -13.236 500 H VAL 148 H VAL 148 -3.337 -4.765 -4.765 501 HA VAL 148 HA VAL 148 -3.376 -5.175 -5.175 502 HB VAL 148 HB VAL 148 -2.720 -2.610 -2.610 503 1HG1 VAL 148 1HG1 VAL 148 -2.761 -3.417 -3.417 504 2HG1 VAL 148 3HG1 VAL 148 -1.318 -4.416 -4.416 505 3HG1 VAL 148 2HG1 VAL 148 -1.243 -2.603 -2.603 506 1HG2 VAL 148 3HG2 VAL 148 -0.928 -5.046 -5.046 507 2HG2 VAL 148 2HG2 VAL 148 -1.560 -4.069 -4.069 508 3HG2 VAL 148 1HG2 VAL 148 -0.383 -3.336 -3.336 509 H LYS 149 H LYS 149 -5.002 -2.848 -2.848 510 HA LYS 149 HA LYS 149 -6.527 -1.454 -1.454 511 1HB LYS 149 2HB LYS 149 -6.629 -1.007 -1.007 512 2HB LYS 149 1HB LYS 149 -7.295 -2.669 -2.669 513 1HG LYS 149 2HG LYS 149 -9.285 -2.305 -2.305 514 2HG LYS 149 1HG LYS 149 -8.872 -0.827 -0.827 515 1HD LYS 149 2HD LYS 149 -9.756 -1.160 -1.160 516 2HD LYS 149 1HD LYS 149 -10.360 -0.117 -0.117 517 1HE LYS 149 2HE LYS 149 -9.119 1.632 1.632 518 2HE LYS 149 1HE LYS 149 -7.801 0.640 0.640 519 1HZ LYS 149 3HZ LYS 149 -10.559 1.187 1.187 520 2HZ LYS 149 2HZ LYS 149 -9.141 1.980 1.980 521 3HZ LYS 149 1HZ LYS 149 -9.339 0.323 0.323 522 H ASP 150 H ASP 150 -7.181 -4.775 -4.775 523 HA ASP 150 HA ASP 150 -9.801 -4.704 -4.704 524 1HB ASP 150 2HB ASP 150 -7.796 -6.809 -6.809 525 2HB ASP 150 1HB ASP 150 -9.452 -7.190 -7.190 526 H ASP 151 H ASP 151 -6.763 -6.196 -6.196 527 HA ASP 151 HA ASP 151 -8.460 -7.075 -7.075 528 1HB ASP 151 2HB ASP 151 -6.236 -8.059 -8.059 529 2HB ASP 151 1HB ASP 151 -5.473 -6.726 -6.726 530 H LEU 152 H LEU 152 -6.927 -3.861 -3.861 531 HA LEU 152 HA LEU 152 -7.014 -3.293 -3.293 532 1HB LEU 152 2HB LEU 152 -5.979 -1.933 -1.933 533 2HB LEU 152 1HB LEU 152 -7.228 -0.946 -0.946 534 HG LEU 152 HG LEU 152 -5.152 -0.192 -0.192 535 1HD1 LEU 152 1HD1 LEU 152 -6.768 -0.400 -0.400 536 2HD1 LEU 152 3HD1 LEU 152 -6.240 -2.059 -2.059 537 3HD1 LEU 152 2HD1 LEU 152 -5.110 -0.713 -0.713 538 1HD2 LEU 152 1HD2 LEU 152 -4.467 -3.133 -3.133 539 2HD2 LEU 152 3HD2 LEU 152 -3.747 -1.795 -1.795 540 3HD2 LEU 152 2HD2 LEU 152 -3.428 -1.876 -1.876 541 H GLN 153 H GLN 153 -9.067 -2.737 -2.737 542 HA GLN 153 HA GLN 153 -10.444 -0.854 -0.854 543 1HB GLN 153 2HB GLN 153 -10.541 -3.288 -3.288 544 2HB GLN 153 1HB GLN 153 -12.003 -3.412 -3.412 545 1HG GLN 153 2HG GLN 153 -12.857 -1.326 -1.326 546 2HG GLN 153 1HG GLN 153 -11.215 -1.312 -1.312 547 1HE2 GLN 153 1HE2 GLN 153 -13.761 -3.809 -3.809 548 2HE2 GLN 153 2HE2 GLN 153 -13.764 -4.569 -4.569 549 H GLU 154 H GLU 154 -10.863 -2.966 -2.966 550 HA GLU 154 HA GLU 154 -13.371 -2.371 -2.371 551 1HB GLU 154 2HB GLU 154 -11.050 -2.879 -2.879 552 2HB GLU 154 1HB GLU 154 -12.696 -3.543 -3.543 553 1HG GLU 154 2HG GLU 154 -11.987 -4.982 -4.982 554 2HG GLU 154 1HG GLU 154 -10.351 -4.202 -4.202 555 H LEU 155 H LEU 155 -10.246 -1.185 -1.185 556 HA LEU 155 HA LEU 155 -11.291 0.783 0.783 557 1HB LEU 155 2HB LEU 155 -9.765 -1.066 -1.066 558 2HB LEU 155 1HB LEU 155 -8.508 -0.463 -0.463 559 HG LEU 155 HG LEU 155 -9.539 1.603 1.603 560 1HD1 LEU 155 2HD1 LEU 155 -9.790 -0.399 -0.399 561 2HD1 LEU 155 1HD1 LEU 155 -8.084 -0.877 -0.877 562 3HD1 LEU 155 3HD1 LEU 155 -8.436 0.648 0.648 563 1HD2 LEU 155 2HD2 LEU 155 -7.504 1.910 1.910 564 2HD2 LEU 155 1HD2 LEU 155 -7.106 1.995 1.995 565 3HD2 LEU 155 3HD2 LEU 155 -6.712 0.510 0.510 566 H ALA 156 H ALA 156 -8.915 0.268 0.268 567 HA ALA 156 HA ALA 156 -8.286 3.223 3.223 568 1HB ALA 156 1HB ALA 156 -6.264 1.696 1.696 569 2HB ALA 156 3HB ALA 156 -7.002 0.950 0.950 570 3HB ALA 156 2HB ALA 156 -6.532 2.658 2.658 571 H VAL 157 H VAL 157 -9.090 4.212 4.212 572 HA VAL 157 HA VAL 157 -8.692 1.936 1.936 573 HB VAL 157 HB VAL 157 -10.188 2.885 2.885 574 1HG1 VAL 157 1HG1 VAL 157 -11.480 2.913 2.913 575 2HG1 VAL 157 3HG1 VAL 157 -12.361 2.854 2.854 576 3HG1 VAL 157 2HG1 VAL 157 -11.250 1.484 1.484 577 1HG2 VAL 157 2HG2 VAL 157 -9.547 5.447 5.447 578 2HG2 VAL 157 1HG2 VAL 157 -11.077 5.020 5.020 579 3HG2 VAL 157 3HG2 VAL 157 -11.038 5.173 5.173 580 H VAL 158 H VAL 158 -8.627 3.056 3.056 581 HA VAL 158 HA VAL 158 -6.015 4.216 4.216 582 HB VAL 158 HB VAL 158 -7.745 3.072 3.072 583 1HG1 VAL 158 2HG1 VAL 158 -5.558 4.135 4.135 584 2HG1 VAL 158 1HG1 VAL 158 -4.771 3.061 3.061 585 3HG1 VAL 158 3HG1 VAL 158 -5.549 2.371 2.371 586 1HG2 VAL 158 1HG2 VAL 158 -6.256 1.601 1.601 587 2HG2 VAL 158 3HG2 VAL 158 -7.885 1.233 1.233 588 3HG2 VAL 158 2HG2 VAL 158 -6.379 0.881 0.881 589 H GLU 159 H GLU 159 -5.717 5.892 5.892 590 HA GLU 159 HA GLU 159 -7.887 7.741 7.741 591 1HB GLU 159 2HB GLU 159 -5.522 8.346 8.346 592 2HB GLU 159 1HB GLU 159 -5.182 7.609 7.609 593 1HG GLU 159 2HG GLU 159 -6.639 9.416 9.416 594 2HG GLU 159 1HG GLU 159 -6.955 10.089 10.089 595 H SER 160 H SER 160 -5.958 5.460 5.460 596 HA SER 160 HA SER 160 -7.831 5.608 5.608 597 1HB SER 160 2HB SER 160 -5.972 7.499 7.499 598 2HB SER 160 1HB SER 160 -5.030 6.071 6.071 599 HG SER 160 HG SER 160 -6.655 5.795 5.795 600 H PHE 161 H PHE 161 -7.297 3.802 3.802 601 HA PHE 161 HA PHE 161 -5.075 2.175 2.175 602 1HB PHE 161 2HB PHE 161 -7.711 1.532 1.532 603 2HB PHE 161 1HB PHE 161 -6.704 0.806 0.806 604 HD1 PHE 161 1HD PHE 161 -7.015 1.403 1.403 605 HD2 PHE 161 2HD PHE 161 -5.274 -1.074 -1.074 606 HE1 PHE 161 1HE PHE 161 -5.690 0.315 0.315 607 HE2 PHE 161 2HE PHE 161 -3.691 -1.899 -1.899 608 HZ PHE 161 HZ PHE 161 -3.870 -1.039 -1.039 609 HA PRO 162 HA PRO 162 -4.916 5.157 5.157 610 1HB PRO 162 2HB PRO 162 -2.295 6.200 6.200 611 2HB PRO 162 1HB PRO 162 -3.728 6.501 6.501 612 1HG PRO 162 2HG PRO 162 -1.384 4.866 4.866 613 2HG PRO 162 1HG PRO 162 -2.775 5.319 5.319 614 1HD PRO 162 2HD PRO 162 -2.297 2.752 2.752 615 2HD PRO 162 1HD PRO 162 -3.424 3.077 3.077 616 H THR 163 H THR 163 -1.260 4.152 4.152 617 HA THR 163 HA THR 163 -1.711 5.498 5.498 618 HB THR 163 HB THR 163 0.955 4.416 4.416 619 HG1 THR 163 1HG THR 163 -0.744 5.676 5.676 620 1HG2 THR 163 3HG2 THR 163 -0.469 7.153 7.153 621 2HG2 THR 163 2HG2 THR 163 1.320 6.912 6.912 622 3HG2 THR 163 1HG2 THR 163 0.475 6.593 6.593 623 H LYS 164 H LYS 164 0.511 4.681 4.681 624 HA LYS 164 HA LYS 164 0.604 2.130 2.130 625 1HB LYS 164 2HB LYS 164 -0.643 3.525 3.525 626 2HB LYS 164 1HB LYS 164 0.684 4.735 4.735 627 1HG LYS 164 2HG LYS 164 2.286 3.053 3.053 628 2HG LYS 164 1HG LYS 164 1.014 1.781 1.781 629 1HD LYS 164 2HD LYS 164 -0.366 3.054 3.054 630 2HD LYS 164 1HD LYS 164 0.909 4.323 4.323 631 1HE LYS 164 2HE LYS 164 2.537 2.646 2.646 632 2HE LYS 164 1HE LYS 164 1.282 1.344 1.344 633 1HZ LYS 164 3HZ LYS 164 -0.094 2.584 2.584 634 2HZ LYS 164 2HZ LYS 164 1.080 3.802 3.802 635 3HZ LYS 164 1HZ LYS 164 1.419 2.232 2.232 636 H ILE 165 H ILE 165 2.849 1.605 1.605 637 HA ILE 165 HA ILE 165 4.190 3.118 3.118 638 HB ILE 165 HB ILE 165 5.418 1.017 1.017 639 1HG1 ILE 165 2HG1 ILE 165 3.435 0.673 0.673 640 2HG1 ILE 165 1HG1 ILE 165 3.116 0.181 0.181 641 1HG2 ILE 165 1HG2 ILE 165 6.898 2.159 2.159 642 2HG2 ILE 165 3HG2 ILE 165 5.709 1.749 1.749 643 3HG2 ILE 165 2HG2 ILE 165 6.646 0.458 0.458 644 1HD1 ILE 165 2HD1 ILE 165 5.317 -1.122 -1.122 645 2HD1 ILE 165 1HD1 ILE 165 3.601 -1.625 -1.625 646 3HD1 ILE 165 3HD1 ILE 165 4.560 -1.701 -1.701 647 H GLU 166 H GLU 166 5.752 4.329 4.329 648 HA GLU 166 HA GLU 166 7.041 5.142 5.142 649 1HB GLU 166 2HB GLU 166 6.059 7.005 7.005 650 2HB GLU 166 1HB GLU 166 7.194 7.504 7.504 651 1HG GLU 166 2HG GLU 166 5.426 7.130 7.130 652 2HG GLU 166 1HG GLU 166 4.288 6.533 6.533 653 H GLY 167 H GLY 167 9.200 4.779 4.779 654 1HA GLY 167 2HA GLY 167 11.131 4.506 4.506 655 2HA GLY 167 1HA GLY 167 10.298 5.017 5.017 656 H ARG 168 H ARG 168 11.327 3.334 3.334 657 HA ARG 168 HA ARG 168 10.732 0.661 0.661 658 1HB ARG 168 2HB ARG 168 12.680 1.795 1.795 659 2HB ARG 168 1HB ARG 168 12.609 0.067 0.067 660 1HG ARG 168 2HG ARG 168 13.184 0.750 0.750 661 2HG ARG 168 1HG ARG 168 13.440 2.435 2.435 662 1HD ARG 168 2HD ARG 168 15.305 1.698 1.698 663 2HD ARG 168 1HD ARG 168 14.954 -0.045 -0.045 664 HE ARG 168 HE ARG 168 15.324 1.427 1.427 665 1HH1 ARG 168 1HH2 ARG 168 17.093 0.223 0.223 666 2HH1 ARG 168 2HH2 ARG 168 18.584 -0.021 -0.021 667 1HH2 ARG 168 1HH1 ARG 168 17.348 1.088 1.088 668 2HH2 ARG 168 2HH1 ARG 168 18.731 0.477 0.477 669 H GLN 169 H GLN 169 8.623 2.141 2.141 670 HA GLN 169 HA GLN 169 8.162 0.737 0.737 671 1HB GLN 169 2HB GLN 169 9.268 3.502 3.502 672 2HB GLN 169 1HB GLN 169 8.131 3.091 3.091 673 1HG GLN 169 2HG GLN 169 9.806 1.631 1.631 674 2HG GLN 169 1HG GLN 169 10.903 1.779 1.779 675 1HE2 GLN 169 1HE2 GLN 169 9.020 3.974 3.974 676 2HE2 GLN 169 2HE2 GLN 169 10.297 5.110 5.110 677 H MET 170 H MET 170 6.022 1.316 1.316 678 HA MET 170 HA MET 170 4.607 3.381 3.381 679 1HB MET 170 2HB MET 170 4.179 1.253 1.253 680 2HB MET 170 1HB MET 170 3.599 0.479 0.479 681 1HG MET 170 2HG MET 170 1.684 2.040 2.040 682 2HG MET 170 1HG MET 170 2.400 2.898 2.898 683 1HE MET 170 3HE MET 170 1.977 -0.857 -0.857 684 2HE MET 170 2HE MET 170 0.233 -0.450 -0.450 685 3HE MET 170 1HE MET 170 0.804 -1.463 -1.463 686 H ILE 171 H ILE 171 3.677 4.707 4.707 687 HA ILE 171 HA ILE 171 3.213 3.730 3.730 688 HB ILE 171 HB ILE 171 2.375 6.240 6.240 689 1HG1 ILE 171 2HG1 ILE 171 4.894 5.658 5.658 690 2HG1 ILE 171 1HG1 ILE 171 4.292 7.308 7.308 691 1HG2 ILE 171 3HG2 ILE 171 2.112 5.446 5.446 692 2HG2 ILE 171 2HG2 ILE 171 2.195 7.195 7.195 693 3HG2 ILE 171 1HG2 ILE 171 0.831 6.197 6.197 694 1HD1 ILE 171 2HD1 ILE 171 4.506 4.903 4.903 695 2HD1 ILE 171 1HD1 ILE 171 5.750 6.211 6.211 696 3HD1 ILE 171 3HD1 ILE 171 4.077 6.550 6.550 697 H MET 172 H MET 172 1.306 3.071 3.071 698 HA MET 172 HA MET 172 -1.273 3.905 3.905 699 1HB MET 172 2HB MET 172 -1.518 1.485 1.485 700 2HB MET 172 1HB MET 172 -0.649 1.395 1.395 701 1HG MET 172 2HG MET 172 -3.191 3.037 3.037 702 2HG MET 172 1HG MET 172 -3.398 1.311 1.311 703 1HE MET 172 1HE MET 172 -2.309 -0.505 -0.505 704 2HE MET 172 3HE MET 172 -2.959 -0.384 -0.384 705 3HE MET 172 2HE MET 172 -4.054 -0.089 -0.089 706 H VAL 173 H VAL 173 -2.383 5.255 5.255 707 HA VAL 173 HA VAL 173 -0.769 6.024 6.024 708 HB VAL 173 HB VAL 173 -3.264 7.337 7.337 709 1HG1 VAL 173 3HG1 VAL 173 -1.271 7.684 7.684 710 2HG1 VAL 173 2HG1 VAL 173 -1.696 9.221 9.221 711 3HG1 VAL 173 1HG1 VAL 173 -2.989 8.248 8.248 712 1HG2 VAL 173 1HG2 VAL 173 -0.304 7.782 7.782 713 2HG2 VAL 173 3HG2 VAL 173 -1.658 7.318 7.318 714 3HG2 VAL 173 2HG2 VAL 173 -1.636 8.946 8.946 715 H LEU 174 H LEU 174 -1.643 5.587 5.587 716 HA LEU 174 HA LEU 174 -4.120 4.055 4.055 717 1HB LEU 174 2HB LEU 174 -1.598 3.213 3.213 718 2HB LEU 174 1HB LEU 174 -1.901 3.608 3.608 719 HG LEU 174 HG LEU 174 -2.384 1.196 1.196 720 1HD1 LEU 174 1HD1 LEU 174 -2.128 1.771 1.771 721 2HD1 LEU 174 3HD1 LEU 174 -3.940 1.615 1.615 722 3HD1 LEU 174 2HD1 LEU 174 -2.900 0.247 0.247 723 1HD2 LEU 174 3HD2 LEU 174 -4.864 2.610 2.610 724 2HD2 LEU 174 2HD2 LEU 174 -4.454 2.166 2.166 725 3HD2 LEU 174 1HD2 LEU 174 -4.837 0.845 0.845 726 H ALA 175 H ALA 175 -5.450 6.087 6.087 727 HA ALA 175 HA ALA 175 -4.802 7.226 7.226 728 1HB ALA 175 3HB ALA 175 -5.276 8.474 8.474 729 2HB ALA 175 2HB ALA 175 -6.972 7.725 7.725 730 3HB ALA 175 1HB ALA 175 -6.402 9.033 9.033 731 HA PRO 176 HA PRO 176 -7.949 5.828 5.828 732 1HB PRO 176 2HB PRO 176 -8.941 7.999 7.999 733 2HB PRO 176 1HB PRO 176 -7.342 7.200 7.200 734 1HG PRO 176 2HG PRO 176 -7.914 9.728 9.728 735 2HG PRO 176 1HG PRO 176 -6.602 9.453 9.453 736 1HD PRO 176 2HD PRO 176 -6.075 9.224 9.224 737 2HD PRO 176 1HD PRO 176 -5.391 8.016 8.016 738 H LYS 177 H LYS 177 -10.021 5.158 5.158 739 HA LYS 177 HA LYS 177 -11.591 6.200 6.200 740 1HB LYS 177 2HB LYS 177 -11.607 3.744 3.744 741 2HB LYS 177 1HB LYS 177 -12.581 4.427 4.427 742 1HG LYS 177 2HG LYS 177 -14.100 5.327 5.327 743 2HG LYS 177 1HG LYS 177 -13.344 3.918 3.918 744 1HD LYS 177 2HD LYS 177 -14.917 3.928 3.928 745 2HD LYS 177 1HD LYS 177 -15.579 3.469 3.469 746 1HE LYS 177 2HE LYS 177 -13.978 1.542 1.542 747 2HE LYS 177 1HE LYS 177 -13.330 1.971 1.971 748 1HZ LYS 177 3HZ LYS 177 -15.561 1.718 1.718 749 2HZ LYS 177 2HZ LYS 177 -16.150 1.287 1.287 750 3HZ LYS 177 1HZ LYS 177 -15.019 0.292 0.292 751 H LYS 178 H LYS 178 -13.193 7.608 7.608 752 HA LYS 178 HA LYS 178 -13.792 9.261 9.261 753 1HB LYS 178 2HB LYS 178 -15.490 10.184 10.184 754 2HB LYS 178 1HB LYS 178 -13.934 9.811 9.811 755 1HG LYS 178 2HG LYS 178 -14.932 7.653 7.653 756 2HG LYS 178 1HG LYS 178 -16.528 8.183 8.183 757 1HD LYS 178 2HD LYS 178 -16.423 10.230 10.230 758 2HD LYS 178 1HD LYS 178 -14.820 9.705 9.705 759 1HE LYS 178 2HE LYS 178 -15.879 7.619 7.619 760 2HE LYS 178 1HE LYS 178 -17.495 8.190 8.190 761 1HZ LYS 178 3HZ LYS 178 -17.221 10.158 10.158 762 2HZ LYS 178 2HZ LYS 178 -15.716 9.604 9.604 763 3HZ LYS 178 1HZ LYS 178 -17.129 8.741 8.741 764 H LYS 179 H LYS 179 -15.140 9.119 9.119 765 HA LYS 179 HA LYS 179 -16.596 6.699 6.699 766 1HB LYS 179 2HB LYS 179 -17.298 7.660 7.660 767 2HB LYS 179 1HB LYS 179 -15.516 7.618 7.618 768 1HG LYS 179 2HG LYS 179 -15.556 10.057 10.057 769 2HG LYS 179 1HG LYS 179 -17.309 10.119 10.119 770 1HD LYS 179 2HD LYS 179 -15.056 9.348 9.348 771 2HD LYS 179 1HD LYS 179 -15.808 10.975 10.975 772 1HE LYS 179 2HE LYS 179 -18.029 10.038 10.038 773 2HE LYS 179 1HE LYS 179 -17.291 8.392 8.392 774 1HZ LYS 179 3HZ LYS 179 -16.481 10.831 10.831 775 2HZ LYS 179 2HZ LYS 179 -17.428 9.553 9.553 776 3HZ LYS 179 1HZ LYS 179 -15.807 9.281 9.281 777 H GLN 180 H GLN 180 -18.848 6.450 6.450 778 HA GLN 180 HA GLN 180 -20.313 8.283 8.283 779 1HB GLN 180 2HB GLN 180 -22.262 6.781 6.781 780 2HB GLN 180 1HB GLN 180 -20.843 5.918 5.918 781 1HG GLN 180 2HG GLN 180 -20.247 5.052 5.052 782 2HG GLN 180 1HG GLN 180 -21.665 5.927 5.927 783 1HE2 GLN 180 1HE2 GLN 180 -23.497 4.800 4.800 784 2HE2 GLN 180 2HE2 GLN 180 -23.971 3.434 3.434 Start of MODEL 16 1 HA VAL 90 HA VAL 90 -1.632 16.385 16.385 2 HB VAL 90 HB VAL 90 -3.516 16.634 16.634 3 1HG1 VAL 90 2HG1 VAL 90 -3.583 18.631 18.631 4 2HG1 VAL 90 1HG1 VAL 90 -4.704 17.684 17.684 5 3HG1 VAL 90 3HG1 VAL 90 -5.220 18.156 18.156 6 1HG2 VAL 90 2HG2 VAL 90 -5.200 15.223 15.223 7 2HG2 VAL 90 1HG2 VAL 90 -4.617 14.484 14.484 8 3HG2 VAL 90 3HG2 VAL 90 -5.813 15.809 15.809 9 H ILE 91 H ILE 91 -2.729 15.546 15.546 10 HA ILE 91 HA ILE 91 -2.577 12.612 12.612 11 HB ILE 91 HB ILE 91 -3.378 14.352 14.352 12 1HG1 ILE 91 2HG1 ILE 91 -5.081 14.569 14.569 13 2HG1 ILE 91 1HG1 ILE 91 -5.689 13.410 13.410 14 1HG2 ILE 91 1HG2 ILE 91 -3.389 11.287 11.287 15 2HG2 ILE 91 3HG2 ILE 91 -4.242 12.132 12.132 16 3HG2 ILE 91 2HG2 ILE 91 -2.456 12.206 12.206 17 1HD1 ILE 91 2HD1 ILE 91 -5.018 11.492 11.492 18 2HD1 ILE 91 1HD1 ILE 91 -4.493 12.691 12.691 19 3HD1 ILE 91 3HD1 ILE 91 -6.228 12.601 12.601 20 H GLN 92 H GLN 92 -0.704 11.580 11.580 21 HA GLN 92 HA GLN 92 1.473 13.180 13.180 22 1HB GLN 92 2HB GLN 92 1.518 10.362 10.362 23 2HB GLN 92 1HB GLN 92 2.900 11.514 11.514 24 1HG GLN 92 2HG GLN 92 0.388 11.708 11.708 25 2HG GLN 92 1HG GLN 92 2.025 11.193 11.193 26 1HE2 GLN 92 1HE2 GLN 92 -0.161 13.773 13.773 27 2HE2 GLN 92 2HE2 GLN 92 0.925 15.102 15.102 28 H VAL 93 H VAL 93 3.069 11.833 11.833 29 HA VAL 93 HA VAL 93 1.533 9.867 9.867 30 HB VAL 93 HB VAL 93 4.149 11.186 11.186 31 1HG1 VAL 93 3HG1 VAL 93 2.481 8.806 8.806 32 2HG1 VAL 93 2HG1 VAL 93 3.667 9.659 9.659 33 3HG1 VAL 93 1HG1 VAL 93 4.281 8.745 8.745 34 1HG2 VAL 93 1HG2 VAL 93 1.675 12.175 12.175 35 2HG2 VAL 93 3HG2 VAL 93 2.841 11.953 11.953 36 3HG2 VAL 93 2HG2 VAL 93 1.631 10.671 10.671 37 H LYS 94 H LYS 94 1.733 7.676 7.676 38 HA LYS 94 HA LYS 94 4.608 7.185 7.185 39 1HB LYS 94 2HB LYS 94 2.362 5.204 5.204 40 2HB LYS 94 1HB LYS 94 4.016 5.030 5.030 41 1HG LYS 94 2HG LYS 94 2.096 7.218 7.218 42 2HG LYS 94 1HG LYS 94 2.229 5.617 5.617 43 1HD LYS 94 2HD LYS 94 4.707 5.952 5.952 44 2HD LYS 94 1HD LYS 94 4.539 7.641 7.641 45 1HE LYS 94 2HE LYS 94 3.064 6.529 6.529 46 2HE LYS 94 1HE LYS 94 4.651 7.403 7.403 47 1HZ LYS 94 1HZ LYS 94 3.603 9.283 9.283 48 2HZ LYS 94 3HZ LYS 94 2.110 8.474 8.474 49 3HZ LYS 94 2HZ LYS 94 2.814 8.865 8.865 50 H GLU 95 H GLU 95 5.252 4.942 4.942 51 HA GLU 95 HA GLU 95 4.000 4.635 4.635 52 1HB GLU 95 2HB GLU 95 5.960 6.293 6.293 53 2HB GLU 95 1HB GLU 95 6.912 4.855 4.855 54 1HG GLU 95 2HG GLU 95 6.471 3.741 3.741 55 2HG GLU 95 1HG GLU 95 5.436 5.140 5.140 56 H ILE 96 H ILE 96 4.404 2.583 2.583 57 HA ILE 96 HA ILE 96 5.940 0.714 0.714 58 HB ILE 96 HB ILE 96 3.212 0.599 0.599 59 1HG1 ILE 96 2HG1 ILE 96 3.371 -1.921 -1.921 60 2HG1 ILE 96 1HG1 ILE 96 5.066 -1.855 -1.855 61 1HG2 ILE 96 3HG2 ILE 96 2.963 0.533 0.533 62 2HG2 ILE 96 2HG2 ILE 96 3.718 -1.130 -1.130 63 3HG2 ILE 96 1HG2 ILE 96 2.234 -0.850 -0.850 64 1HD1 ILE 96 2HD1 ILE 96 5.614 -0.384 -0.384 65 2HD1 ILE 96 1HD1 ILE 96 3.890 -0.540 -0.540 66 3HD1 ILE 96 3HD1 ILE 96 4.948 -1.994 -1.994 67 H LYS 97 H LYS 97 6.751 -1.130 -1.130 68 HA LYS 97 HA LYS 97 6.256 -0.359 -0.359 69 1HB LYS 97 2HB LYS 97 8.762 -1.853 -1.853 70 2HB LYS 97 1HB LYS 97 8.173 -1.422 -1.422 71 1HG LYS 97 2HG LYS 97 8.353 1.024 1.024 72 2HG LYS 97 1HG LYS 97 9.122 0.558 0.558 73 1HD LYS 97 2HD LYS 97 10.198 -0.114 -0.114 74 2HD LYS 97 1HD LYS 97 10.760 1.244 1.244 75 1HE LYS 97 2HE LYS 97 11.484 -0.423 -0.423 76 2HE LYS 97 1HE LYS 97 11.037 -1.771 -1.771 77 1HZ LYS 97 1HZ LYS 97 13.006 0.389 0.389 78 2HZ LYS 97 3HZ LYS 97 13.355 -1.219 -1.219 79 3HZ LYS 97 2HZ LYS 97 12.590 -0.878 -0.878 80 H PHE 98 H PHE 98 6.004 -2.044 -2.044 81 HA PHE 98 HA PHE 98 5.884 -4.708 -4.708 82 1HB PHE 98 2HB PHE 98 3.852 -3.361 -3.361 83 2HB PHE 98 1HB PHE 98 3.936 -5.135 -5.135 84 HD1 PHE 98 2HD PHE 98 4.155 -5.866 -5.866 85 HD2 PHE 98 1HD PHE 98 2.238 -2.531 -2.531 86 HE1 PHE 98 2HE PHE 98 2.952 -5.581 -5.581 87 HE2 PHE 98 1HE PHE 98 0.874 -2.268 -2.268 88 HZ PHE 98 HZ PHE 98 1.123 -3.979 -3.979 89 H ARG 99 H ARG 99 6.927 -6.222 -6.222 90 HA ARG 99 HA ARG 99 7.999 -5.125 -5.125 91 1HB ARG 99 2HB ARG 99 8.862 -7.374 -7.374 92 2HB ARG 99 1HB ARG 99 9.637 -6.951 -6.951 93 1HG ARG 99 2HG ARG 99 9.618 -5.202 -5.202 94 2HG ARG 99 1HG ARG 99 10.987 -6.191 -6.191 95 1HD ARG 99 2HD ARG 99 10.950 -4.789 -4.789 96 2HD ARG 99 1HD ARG 99 9.713 -3.736 -3.736 97 HE ARG 99 HE ARG 99 11.357 -2.914 -2.914 98 1HH1 ARG 99 1HH1 ARG 99 12.683 -5.516 -5.516 99 2HH1 ARG 99 2HH1 ARG 99 14.335 -5.132 -5.132 100 1HH2 ARG 99 1HH2 ARG 99 13.597 -2.415 -2.415 101 2HH2 ARG 99 2HH2 ARG 99 14.860 -3.353 -3.353 102 HA PRO 100 HA PRO 100 5.787 -8.535 -8.535 103 1HB PRO 100 2HB PRO 100 8.067 -9.491 -9.491 104 2HB PRO 100 1HB PRO 100 6.753 -8.440 -8.440 105 1HG PRO 100 2HG PRO 100 9.501 -7.751 -7.751 106 2HG PRO 100 1HG PRO 100 8.552 -6.839 -6.839 107 1HD PRO 100 2HD PRO 100 8.914 -5.981 -5.981 108 2HD PRO 100 1HD PRO 100 7.324 -5.674 -5.674 109 H GLY 101 H GLY 101 5.583 -10.699 -10.699 110 1HA GLY 101 2HA GLY 101 6.251 -12.774 -12.774 111 2HA GLY 101 1HA GLY 101 7.949 -12.148 -12.148 112 H THR 102 H THR 102 5.923 -10.356 -10.356 113 HA THR 102 HA THR 102 6.789 -11.529 -11.529 114 HB THR 102 HB THR 102 5.802 -8.647 -8.647 115 HG1 THR 102 1HG THR 102 8.388 -9.805 -9.805 116 1HG2 THR 102 2HG2 THR 102 6.816 -10.616 -10.616 117 2HG2 THR 102 1HG2 THR 102 6.982 -8.818 -8.818 118 3HG2 THR 102 3HG2 THR 102 5.360 -9.572 -9.572 119 H ASP 103 H ASP 103 5.359 -12.924 -12.924 120 HA ASP 103 HA ASP 103 2.705 -12.025 -12.025 121 1HB ASP 103 2HB ASP 103 3.189 -13.445 -13.445 122 2HB ASP 103 1HB ASP 103 3.501 -14.758 -14.758 123 H GLU 104 H GLU 104 3.718 -15.329 -15.329 124 HA GLU 104 HA GLU 104 1.193 -14.027 -14.027 125 1HB GLU 104 2HB GLU 104 1.369 -16.517 -16.517 126 2HB GLU 104 1HB GLU 104 2.006 -16.440 -16.440 127 1HG GLU 104 2HG GLU 104 -0.191 -15.460 -15.460 128 2HG GLU 104 1HG GLU 104 -0.765 -15.412 -15.412 129 H GLY 105 H GLY 105 2.975 -15.210 -15.210 130 1HA GLY 105 2HA GLY 105 2.086 -12.726 -12.726 131 2HA GLY 105 1HA GLY 105 2.509 -14.282 -14.282 132 H ASP 106 H ASP 106 4.279 -12.687 -12.687 133 HA ASP 106 HA ASP 106 5.943 -11.336 -11.336 134 1HB ASP 106 2HB ASP 106 7.018 -12.564 -12.564 135 2HB ASP 106 1HB ASP 106 6.287 -11.372 -11.372 136 H TYR 107 H TYR 107 3.775 -11.249 -11.249 137 HA TYR 107 HA TYR 107 3.828 -8.464 -8.464 138 1HB TYR 107 2HB TYR 107 3.327 -10.279 -10.279 139 2HB TYR 107 1HB TYR 107 1.918 -10.809 -10.809 140 HD1 TYR 107 2HD TYR 107 2.016 -7.215 -7.215 141 HD2 TYR 107 1HD TYR 107 1.035 -10.874 -10.874 142 HE1 TYR 107 2HE TYR 107 -0.013 -6.180 -6.180 143 HE2 TYR 107 1HE TYR 107 -0.629 -9.708 -9.708 144 HH TYR 107 HH TYR 107 -1.955 -7.911 -7.911 145 H GLN 108 H GLN 108 0.825 -10.351 -10.351 146 HA GLN 108 HA GLN 108 -0.310 -8.314 -8.314 147 1HB GLN 108 2HB GLN 108 -1.290 -10.797 -10.797 148 2HB GLN 108 1HB GLN 108 -2.076 -9.462 -9.462 149 1HG GLN 108 2HG GLN 108 -0.375 -11.454 -11.454 150 2HG GLN 108 1HG GLN 108 -1.918 -11.882 -11.882 151 1HE2 GLN 108 1HE2 GLN 108 -0.679 -8.628 -8.628 152 2HE2 GLN 108 2HE2 GLN 108 -1.839 -8.435 -8.435 153 H VAL 109 H VAL 109 2.099 -9.882 -9.882 154 HA VAL 109 HA VAL 109 1.431 -9.003 -9.003 155 HB VAL 109 HB VAL 109 4.080 -9.713 -9.713 156 1HG1 VAL 109 1HG1 VAL 109 3.548 -8.782 -8.782 157 2HG1 VAL 109 3HG1 VAL 109 4.992 -9.741 -9.741 158 3HG1 VAL 109 2HG1 VAL 109 4.751 -8.110 -8.110 159 1HG2 VAL 109 2HG2 VAL 109 2.442 -11.568 -11.568 160 2HG2 VAL 109 1HG2 VAL 109 3.897 -11.704 -11.704 161 3HG2 VAL 109 3HG2 VAL 109 2.340 -11.089 -11.089 162 H LYS 110 H LYS 110 3.155 -7.517 -7.517 163 HA LYS 110 HA LYS 110 3.273 -5.041 -5.041 164 1HB LYS 110 2HB LYS 110 4.411 -5.895 -5.895 165 2HB LYS 110 1HB LYS 110 4.464 -4.221 -4.221 166 1HG LYS 110 2HG LYS 110 5.833 -6.709 -6.709 167 2HG LYS 110 1HG LYS 110 6.465 -5.034 -5.034 168 1HD LYS 110 2HD LYS 110 5.454 -4.131 -4.131 169 2HD LYS 110 1HD LYS 110 4.886 -5.776 -5.776 170 1HE LYS 110 2HE LYS 110 7.271 -6.575 -6.575 171 2HE LYS 110 1HE LYS 110 7.837 -4.908 -4.908 172 1HZ LYS 110 1HZ LYS 110 6.725 -4.089 -4.089 173 2HZ LYS 110 3HZ LYS 110 6.233 -5.662 -5.662 174 3HZ LYS 110 2HZ LYS 110 7.885 -5.271 -5.271 175 H LEU 111 H LEU 111 1.020 -6.527 -6.527 176 HA LEU 111 HA LEU 111 -0.161 -4.066 -4.066 177 1HB LEU 111 2HB LEU 111 -0.524 -6.376 -6.376 178 2HB LEU 111 1HB LEU 111 -1.520 -6.775 -6.775 179 HG LEU 111 HG LEU 111 -2.114 -4.333 -4.333 180 1HD1 LEU 111 3HD1 LEU 111 -1.809 -6.325 -6.325 181 2HD1 LEU 111 2HD1 LEU 111 -3.030 -7.224 -7.224 182 3HD1 LEU 111 1HD1 LEU 111 -3.522 -5.757 -5.757 183 1HD2 LEU 111 2HD2 LEU 111 -3.766 -6.169 -6.169 184 2HD2 LEU 111 1HD2 LEU 111 -3.496 -4.384 -4.384 185 3HD2 LEU 111 3HD2 LEU 111 -4.530 -5.064 -5.064 186 H ARG 112 H ARG 112 0.086 -6.327 -6.327 187 HA ARG 112 HA ARG 112 -1.793 -5.195 -5.195 188 1HB ARG 112 2HB ARG 112 0.058 -7.274 -7.274 189 2HB ARG 112 1HB ARG 112 0.601 -6.116 -6.116 190 1HG ARG 112 2HG ARG 112 -0.860 -7.465 -7.465 191 2HG ARG 112 1HG ARG 112 -1.963 -6.126 -6.126 192 1HD ARG 112 2HD ARG 112 -3.053 -8.356 -8.356 193 2HD ARG 112 1HD ARG 112 -2.713 -7.623 -7.623 194 HE ARG 112 HE ARG 112 -0.449 -9.197 -9.197 195 1HH1 ARG 112 1HH2 ARG 112 -3.901 -9.579 -9.579 196 2HH1 ARG 112 2HH2 ARG 112 -3.716 -11.165 -11.165 197 1HH2 ARG 112 1HH1 ARG 112 -0.207 -11.346 -11.346 198 2HH2 ARG 112 2HH1 ARG 112 -1.586 -12.184 -12.184 199 H SER 113 H SER 113 1.845 -4.415 -4.415 200 HA SER 113 HA SER 113 1.901 -2.576 -2.576 201 1HB SER 113 2HB SER 113 3.870 -3.431 -3.431 202 2HB SER 113 1HB SER 113 3.480 -2.557 -2.557 203 HG SER 113 HG SER 113 3.551 -0.634 -0.634 204 H LEU 114 H LEU 114 0.895 -2.173 -2.173 205 HA LEU 114 HA LEU 114 0.694 0.559 0.559 206 1HB LEU 114 2HB LEU 114 1.190 -1.170 -1.170 207 2HB LEU 114 1HB LEU 114 -0.306 -2.041 -2.041 208 HG LEU 114 HG LEU 114 -1.624 -0.215 -0.215 209 1HD1 LEU 114 1HD1 LEU 114 1.122 1.006 1.006 210 2HD1 LEU 114 3HD1 LEU 114 -0.409 1.624 1.624 211 3HD1 LEU 114 2HD1 LEU 114 -0.151 1.699 1.699 212 1HD2 LEU 114 2HD2 LEU 114 -1.054 -2.149 -2.149 213 2HD2 LEU 114 1HD2 LEU 114 -1.339 -0.685 -0.685 214 3HD2 LEU 114 3HD2 LEU 114 0.346 -1.272 -1.272 215 H ILE 115 H ILE 115 -1.759 -2.126 -2.126 216 HA ILE 115 HA ILE 115 -3.929 -0.488 -0.488 217 HB ILE 115 HB ILE 115 -3.566 -2.146 -2.146 218 1HG1 ILE 115 2HG1 ILE 115 -2.944 -3.745 -3.745 219 2HG1 ILE 115 1HG1 ILE 115 -4.514 -4.122 -4.122 220 1HG2 ILE 115 2HG2 ILE 115 -5.781 -1.163 -1.163 221 2HG2 ILE 115 1HG2 ILE 115 -6.078 -2.370 -2.370 222 3HG2 ILE 115 3HG2 ILE 115 -5.476 -0.732 -0.732 223 1HD1 ILE 115 3HD1 ILE 115 -5.694 -3.167 -3.167 224 2HD1 ILE 115 2HD1 ILE 115 -4.039 -2.851 -2.851 225 3HD1 ILE 115 1HD1 ILE 115 -4.618 -4.548 -4.548 226 H ARG 116 H ARG 116 -1.559 -1.055 -1.055 227 HA ARG 116 HA ARG 116 -2.567 0.509 0.509 228 1HB ARG 116 2HB ARG 116 -0.624 -1.218 -1.218 229 2HB ARG 116 1HB ARG 116 0.429 0.107 0.107 230 1HG ARG 116 2HG ARG 116 0.668 -0.102 -0.102 231 2HG ARG 116 1HG ARG 116 -0.126 1.467 1.467 232 1HD ARG 116 2HD ARG 116 -2.376 0.425 0.425 233 2HD ARG 116 1HD ARG 116 -1.513 -1.128 -1.128 234 HE ARG 116 HE ARG 116 -0.533 -0.174 -0.174 235 1HH1 ARG 116 1HH1 ARG 116 -2.326 2.297 2.297 236 2HH1 ARG 116 2HH1 ARG 116 -2.278 3.479 3.479 237 1HH2 ARG 116 1HH2 ARG 116 -0.482 1.434 1.434 238 2HH2 ARG 116 2HH2 ARG 116 -1.219 2.982 2.982 239 H PHE 117 H PHE 117 -0.358 1.485 1.485 240 HA PHE 117 HA PHE 117 0.049 4.049 4.049 241 1HB PHE 117 2HB PHE 117 -0.349 2.904 2.904 242 2HB PHE 117 1HB PHE 117 0.440 4.464 4.464 243 HD1 PHE 117 2HD PHE 117 1.637 2.383 2.383 244 HD2 PHE 117 1HD PHE 117 1.504 2.931 2.931 245 HE1 PHE 117 2HE PHE 117 3.912 1.478 1.478 246 HE2 PHE 117 1HE PHE 117 3.786 1.857 1.857 247 HZ PHE 117 HZ PHE 117 5.004 1.199 1.199 248 H LEU 118 H LEU 118 -2.500 2.737 2.737 249 HA LEU 118 HA LEU 118 -3.788 5.011 5.011 250 1HB LEU 118 2HB LEU 118 -4.179 2.346 2.346 251 2HB LEU 118 1HB LEU 118 -5.652 2.955 2.955 252 HG LEU 118 HG LEU 118 -5.092 5.077 5.077 253 1HD1 LEU 118 3HD1 LEU 118 -4.192 2.416 2.416 254 2HD1 LEU 118 2HD1 LEU 118 -4.851 3.765 3.765 255 3HD1 LEU 118 1HD1 LEU 118 -3.399 4.059 4.059 256 1HD2 LEU 118 3HD2 LEU 118 -6.931 2.728 2.728 257 2HD2 LEU 118 2HD2 LEU 118 -7.123 4.438 4.438 258 3HD2 LEU 118 1HD2 LEU 118 -6.968 4.125 4.125 259 H GLU 119 H GLU 119 -4.055 2.904 2.904 260 HA GLU 119 HA GLU 119 -6.616 3.622 3.622 261 1HB GLU 119 2HB GLU 119 -5.474 1.357 1.357 262 2HB GLU 119 1HB GLU 119 -4.419 2.036 2.036 263 1HG GLU 119 2HG GLU 119 -7.504 2.041 2.041 264 2HG GLU 119 1HG GLU 119 -6.533 0.573 0.573 265 H GLU 120 H GLU 120 -3.270 4.457 4.457 266 HA GLU 120 HA GLU 120 -4.106 5.980 5.980 267 1HB GLU 120 2HB GLU 120 -1.701 6.677 6.677 268 2HB GLU 120 1HB GLU 120 -1.950 4.904 4.904 269 1HG GLU 120 2HG GLU 120 -1.250 4.950 4.950 270 2HG GLU 120 1HG GLU 120 -0.990 6.732 6.732 271 H GLY 121 H GLY 121 -4.716 6.473 6.473 272 1HA GLY 121 2HA GLY 121 -5.581 8.162 8.162 273 2HA GLY 121 1HA GLY 121 -5.165 9.223 9.223 274 H ASP 122 H ASP 122 -3.522 7.294 7.294 275 HA ASP 122 HA ASP 122 -2.156 9.767 9.767 276 1HB ASP 122 2HB ASP 122 -0.839 7.050 7.050 277 2HB ASP 122 1HB ASP 122 -0.079 8.646 8.646 278 H LYS 123 H LYS 123 -1.315 9.535 9.535 279 HA LYS 123 HA LYS 123 -3.191 8.072 8.072 280 1HB LYS 123 2HB LYS 123 -3.301 10.555 10.555 281 2HB LYS 123 1HB LYS 123 -1.495 10.606 10.606 282 1HG LYS 123 2HG LYS 123 -2.444 8.816 8.816 283 2HG LYS 123 1HG LYS 123 -3.155 10.457 10.457 284 1HD LYS 123 2HD LYS 123 -1.153 11.432 11.432 285 2HD LYS 123 1HD LYS 123 -0.306 10.538 10.538 286 1HE LYS 123 2HE LYS 123 0.368 8.817 8.817 287 2HE LYS 123 1HE LYS 123 -1.068 8.888 8.888 288 1HZ LYS 123 2HZ LYS 123 1.202 10.816 10.816 289 2HZ LYS 123 1HZ LYS 123 0.969 9.586 9.586 290 3HZ LYS 123 3HZ LYS 123 -0.134 10.873 10.873 291 H ALA 124 H ALA 124 -2.299 6.230 6.230 292 HA ALA 124 HA ALA 124 0.561 6.046 6.046 293 1HB ALA 124 3HB ALA 124 -1.706 4.065 4.065 294 2HB ALA 124 2HB ALA 124 0.069 3.630 3.630 295 3HB ALA 124 1HB ALA 124 -0.820 4.215 4.215 296 H LYS 125 H LYS 125 1.978 5.596 5.596 297 HA LYS 125 HA LYS 125 0.371 5.460 5.460 298 1HB LYS 125 2HB LYS 125 1.714 7.656 7.656 299 2HB LYS 125 1HB LYS 125 3.126 6.691 6.691 300 1HG LYS 125 2HG LYS 125 3.349 5.839 5.839 301 2HG LYS 125 1HG LYS 125 2.054 7.003 7.003 302 1HD LYS 125 2HD LYS 125 4.733 7.676 7.676 303 2HD LYS 125 1HD LYS 125 4.449 7.804 7.804 304 1HE LYS 125 2HE LYS 125 2.688 9.523 9.523 305 2HE LYS 125 1HE LYS 125 3.048 9.490 9.490 306 1HZ LYS 125 2HZ LYS 125 4.974 10.129 10.129 307 2HZ LYS 125 1HZ LYS 125 4.222 11.235 11.235 308 3HZ LYS 125 3HZ LYS 125 5.313 10.087 10.087 309 H ILE 126 H ILE 126 0.742 3.499 3.499 310 HA ILE 126 HA ILE 126 2.905 1.842 1.842 311 HB ILE 126 HB ILE 126 1.247 1.699 1.699 312 1HG1 ILE 126 2HG1 ILE 126 -0.478 1.965 1.965 313 2HG1 ILE 126 1HG1 ILE 126 -0.319 0.217 0.217 314 1HG2 ILE 126 1HG2 ILE 126 2.763 -0.242 -0.242 315 2HG2 ILE 126 3HG2 ILE 126 1.597 -0.762 -0.762 316 3HG2 ILE 126 2HG2 ILE 126 3.107 0.096 0.096 317 1HD1 ILE 126 1HD1 ILE 126 1.042 -0.035 -0.035 318 2HD1 ILE 126 3HD1 ILE 126 0.663 1.690 1.690 319 3HD1 ILE 126 2HD1 ILE 126 -0.657 0.467 0.467 320 H THR 127 H THR 127 4.901 1.700 1.700 321 HA THR 127 HA THR 127 5.107 2.937 2.937 322 HB THR 127 HB THR 127 7.385 2.338 2.338 323 HG1 THR 127 1HG THR 127 6.136 4.795 4.795 324 1HG2 THR 127 1HG2 THR 127 7.060 3.793 3.793 325 2HG2 THR 127 3HG2 THR 127 8.564 3.885 3.885 326 3HG2 THR 127 2HG2 THR 127 8.033 2.304 2.304 327 H LEU 128 H LEU 128 4.874 1.435 1.435 328 HA LEU 128 HA LEU 128 5.772 -1.313 -1.313 329 1HB LEU 128 2HB LEU 128 3.708 -0.500 -0.500 330 2HB LEU 128 1HB LEU 128 5.010 -0.086 -0.086 331 HG LEU 128 HG LEU 128 5.739 -2.383 -2.383 332 1HD1 LEU 128 2HD1 LEU 128 3.373 -3.115 -3.115 333 2HD1 LEU 128 1HD1 LEU 128 4.286 -4.270 -4.270 334 3HD1 LEU 128 3HD1 LEU 128 5.124 -3.444 -3.444 335 1HD2 LEU 128 3HD2 LEU 128 3.850 -1.059 -1.059 336 2HD2 LEU 128 2HD2 LEU 128 3.949 -2.860 -2.860 337 3HD2 LEU 128 1HD2 LEU 128 2.723 -2.095 -2.095 338 H ARG 129 H ARG 129 7.575 -2.217 -2.217 339 HA ARG 129 HA ARG 129 9.246 -0.345 -0.345 340 1HB ARG 129 2HB ARG 129 9.808 0.023 0.023 341 2HB ARG 129 1HB ARG 129 10.012 -1.744 -1.744 342 1HG ARG 129 2HG ARG 129 11.959 -1.769 -1.769 343 2HG ARG 129 1HG ARG 129 11.590 -0.129 -0.129 344 1HD ARG 129 2HD ARG 129 12.482 -0.764 -0.764 345 2HD ARG 129 1HD ARG 129 13.554 -0.115 -0.115 346 HE ARG 129 HE ARG 129 11.191 1.539 1.539 347 1HH1 ARG 129 1HH2 ARG 129 14.257 0.678 0.678 348 2HH1 ARG 129 2HH2 ARG 129 14.429 2.198 2.198 349 1HH2 ARG 129 1HH1 ARG 129 11.428 3.597 3.597 350 2HH2 ARG 129 2HH1 ARG 129 12.796 3.882 3.882 351 H PHE 130 H PHE 130 9.347 -1.459 -1.459 352 HA PHE 130 HA PHE 130 8.612 -4.260 -4.260 353 1HB PHE 130 2HB PHE 130 9.608 -2.027 -2.027 354 2HB PHE 130 1HB PHE 130 9.149 -3.691 -3.691 355 HD1 PHE 130 2HD PHE 130 7.004 -4.590 -4.590 356 HD2 PHE 130 1HD PHE 130 7.978 -0.563 -0.563 357 HE1 PHE 130 2HE PHE 130 4.630 -3.930 -3.930 358 HE2 PHE 130 1HE PHE 130 5.580 0.017 0.017 359 HZ PHE 130 HZ PHE 130 3.895 -1.733 -1.733 360 H ARG 131 H ARG 131 10.610 -5.085 -5.085 361 HA ARG 131 HA ARG 131 12.998 -5.043 -5.043 362 1HB ARG 131 2HB ARG 131 12.998 -5.240 -5.240 363 2HB ARG 131 1HB ARG 131 14.462 -5.458 -5.458 364 1HG ARG 131 2HG ARG 131 12.804 -2.877 -2.877 365 2HG ARG 131 1HG ARG 131 14.268 -3.189 -3.189 366 1HD ARG 131 2HD ARG 131 15.671 -3.368 -3.368 367 2HD ARG 131 1HD ARG 131 14.232 -3.126 -3.126 368 HE ARG 131 HE ARG 131 15.518 -1.095 -1.095 369 1HH1 ARG 131 1HH2 ARG 131 12.934 -1.904 -1.904 370 2HH1 ARG 131 2HH2 ARG 131 12.502 -0.252 -0.252 371 1HH2 ARG 131 1HH1 ARG 131 14.910 1.120 1.120 372 2HH2 ARG 131 2HH1 ARG 131 13.635 1.481 1.481 373 H GLY 132 H GLY 132 10.675 -6.691 -6.691 374 1HA GLY 132 2HA GLY 132 11.893 -9.249 -9.249 375 2HA GLY 132 1HA GLY 132 10.153 -8.970 -8.970 376 H ARG 133 H ARG 133 10.813 -7.003 -7.003 377 HA ARG 133 HA ARG 133 12.739 -7.926 -7.926 378 1HB ARG 133 2HB ARG 133 10.561 -9.005 -9.005 379 2HB ARG 133 1HB ARG 133 9.929 -7.343 -7.343 380 1HG ARG 133 2HG ARG 133 11.786 -6.851 -6.851 381 2HG ARG 133 1HG ARG 133 12.547 -8.440 -8.440 382 1HD ARG 133 2HD ARG 133 9.816 -8.059 -8.059 383 2HD ARG 133 1HD ARG 133 11.377 -8.477 -8.477 384 HE ARG 133 HE ARG 133 11.423 -10.583 -10.583 385 1HH1 ARG 133 1HH2 ARG 133 8.271 -8.908 -8.908 386 2HH1 ARG 133 2HH2 ARG 133 7.342 -10.349 -10.349 387 1HH2 ARG 133 1HH1 ARG 133 10.145 -12.490 -12.490 388 2HH2 ARG 133 2HH1 ARG 133 8.415 -12.401 -12.401 389 H GLU 134 H GLU 134 13.830 -6.104 -6.104 390 HA GLU 134 HA GLU 134 13.373 -4.118 -4.118 391 1HB GLU 134 2HB GLU 134 15.255 -4.000 -4.000 392 2HB GLU 134 1HB GLU 134 15.302 -2.949 -2.949 393 1HG GLU 134 2HG GLU 134 15.619 -5.014 -5.014 394 2HG GLU 134 1HG GLU 134 15.799 -5.992 -5.992 395 H MET 135 H MET 135 11.976 -4.207 -4.207 396 HA MET 135 HA MET 135 11.836 -1.416 -1.416 397 1HB MET 135 2HB MET 135 11.762 -3.049 -3.049 398 2HB MET 135 1HB MET 135 10.135 -3.559 -3.559 399 1HG MET 135 2HG MET 135 10.144 -1.961 -1.961 400 2HG MET 135 1HG MET 135 9.207 -1.359 -1.359 401 1HE MET 135 1HE MET 135 12.501 -1.155 -1.155 402 2HE MET 135 3HE MET 135 13.413 0.205 0.205 403 3HE MET 135 2HE MET 135 13.236 -1.339 -1.339 404 H ALA 136 H ALA 136 8.700 -3.269 -3.269 405 HA ALA 136 HA ALA 136 7.486 -1.963 -1.963 406 1HB ALA 136 2HB ALA 136 7.818 -0.246 -0.246 407 2HB ALA 136 1HB ALA 136 6.415 -0.067 -0.067 408 3HB ALA 136 3HB ALA 136 8.052 0.259 0.259 409 H HIS 137 H HIS 137 5.816 -3.374 -3.374 410 HA HIS 137 HA HIS 137 4.573 -3.906 -3.906 411 1HB HIS 137 2HB HIS 137 4.757 -6.005 -6.005 412 2HB HIS 137 1HB HIS 137 3.961 -6.088 -6.088 413 HD1 HIS 137 1HD HIS 137 5.442 -7.137 -7.137 414 HD2 HIS 137 2HD HIS 137 7.670 -5.012 -5.012 415 HE1 HIS 137 1HE HIS 137 7.903 -7.258 -7.258 416 H GLN 138 H GLN 138 2.287 -4.152 -4.152 417 HA GLN 138 HA GLN 138 1.006 -2.839 -2.839 418 1HB GLN 138 2HB GLN 138 -1.117 -3.015 -3.015 419 2HB GLN 138 1HB GLN 138 0.179 -2.163 -2.163 420 1HG GLN 138 2HG GLN 138 0.633 -4.179 -4.179 421 2HG GLN 138 1HG GLN 138 -0.568 -5.144 -5.144 422 1HE2 GLN 138 1HE2 GLN 138 -2.590 -5.227 -5.227 423 2HE2 GLN 138 2HE2 GLN 138 -3.352 -4.105 -4.105 424 H GLN 139 H GLN 139 1.940 -5.788 -5.788 425 HA GLN 139 HA GLN 139 -0.250 -7.275 -7.275 426 1HB GLN 139 2HB GLN 139 2.569 -8.445 -8.445 427 2HB GLN 139 1HB GLN 139 1.007 -9.280 -9.280 428 1HG GLN 139 2HG GLN 139 0.538 -7.876 -7.876 429 2HG GLN 139 1HG GLN 139 2.186 -7.139 -7.139 430 1HE2 GLN 139 1HE2 GLN 139 3.946 -8.138 -8.138 431 2HE2 GLN 139 2HE2 GLN 139 4.017 -9.755 -9.755 432 H ILE 140 H ILE 140 3.278 -6.756 -6.756 433 HA ILE 140 HA ILE 140 3.598 -7.868 -7.868 434 HB ILE 140 HB ILE 140 5.045 -5.773 -5.773 435 1HG1 ILE 140 2HG1 ILE 140 5.573 -8.701 -8.701 436 2HG1 ILE 140 1HG1 ILE 140 4.921 -8.203 -8.203 437 1HG2 ILE 140 2HG2 ILE 140 5.358 -7.083 -7.083 438 2HG2 ILE 140 1HG2 ILE 140 6.744 -6.348 -6.348 439 3HG2 ILE 140 3HG2 ILE 140 5.390 -5.321 -5.321 440 1HD1 ILE 140 3HD1 ILE 140 6.949 -6.755 -6.755 441 2HD1 ILE 140 2HD1 ILE 140 7.693 -7.480 -7.480 442 3HD1 ILE 140 1HD1 ILE 140 7.305 -8.525 -8.525 443 H GLY 141 H GLY 141 2.454 -4.602 -4.602 444 1HA GLY 141 2HA GLY 141 2.349 -3.990 -3.990 445 2HA GLY 141 1HA GLY 141 1.619 -3.039 -3.039 446 H MET 142 H MET 142 -0.317 -4.653 -4.653 447 HA MET 142 HA MET 142 -1.952 -3.944 -3.944 448 1HB MET 142 2HB MET 142 -3.498 -3.443 -3.443 449 2HB MET 142 1HB MET 142 -1.984 -3.428 -3.428 450 1HG MET 142 2HG MET 142 -2.532 -5.873 -5.873 451 2HG MET 142 1HG MET 142 -4.007 -5.600 -5.600 452 1HE MET 142 2HE MET 142 -5.012 -6.656 -6.656 453 2HE MET 142 1HE MET 142 -4.916 -5.887 -5.887 454 3HE MET 142 3HE MET 142 -3.432 -6.547 -6.547 455 H GLU 143 H GLU 143 -0.663 -7.096 -7.096 456 HA GLU 143 HA GLU 143 -2.895 -8.117 -8.117 457 1HB GLU 143 2HB GLU 143 -0.809 -9.570 -9.570 458 2HB GLU 143 1HB GLU 143 -0.122 -9.192 -9.192 459 1HG GLU 143 2HG GLU 143 -1.207 -11.138 -11.138 460 2HG GLU 143 1HG GLU 143 -2.600 -10.088 -10.088 461 H VAL 144 H VAL 144 0.248 -6.981 -6.981 462 HA VAL 144 HA VAL 144 -0.260 -7.532 -7.532 463 HB VAL 144 HB VAL 144 1.788 -5.701 -5.701 464 1HG1 VAL 144 1HG1 VAL 144 1.243 -7.060 -7.060 465 2HG1 VAL 144 3HG1 VAL 144 2.895 -6.585 -6.585 466 3HG1 VAL 144 2HG1 VAL 144 1.618 -5.319 -5.319 467 1HG2 VAL 144 1HG2 VAL 144 1.160 -8.648 -8.648 468 2HG2 VAL 144 3HG2 VAL 144 1.786 -7.909 -7.909 469 3HG2 VAL 144 2HG2 VAL 144 2.908 -8.121 -8.121 470 H LEU 145 H LEU 145 0.026 -4.447 -4.447 471 HA LEU 145 HA LEU 145 -0.795 -2.748 -2.748 472 1HB LEU 145 2HB LEU 145 -1.210 -2.769 -2.769 473 2HB LEU 145 1HB LEU 145 -1.639 -1.354 -1.354 474 HG LEU 145 HG LEU 145 1.142 -2.588 -2.588 475 1HD1 LEU 145 2HD1 LEU 145 -0.231 0.048 0.048 476 2HD1 LEU 145 1HD1 LEU 145 1.542 -0.256 -0.256 477 3HD1 LEU 145 3HD1 LEU 145 0.359 -1.283 -1.283 478 1HD2 LEU 145 1HD2 LEU 145 0.052 -0.600 -0.600 479 2HD2 LEU 145 3HD2 LEU 145 1.124 -2.006 -2.006 480 3HD2 LEU 145 2HD2 LEU 145 1.814 -0.537 -0.537 481 H ASN 146 H ASN 146 -2.862 -4.078 -4.078 482 HA ASN 146 HA ASN 146 -5.375 -3.136 -3.136 483 1HB ASN 146 2HB ASN 146 -4.179 -4.250 -4.250 484 2HB ASN 146 1HB ASN 146 -5.058 -5.710 -5.710 485 1HD2 ASN 146 1HD2 ASN 146 -5.923 -6.109 -6.109 486 2HD2 ASN 146 2HD2 ASN 146 -6.937 -5.133 -5.133 487 H ARG 147 H ARG 147 -3.572 -6.172 -6.172 488 HA ARG 147 HA ARG 147 -5.873 -6.945 -6.945 489 1HB ARG 147 2HB ARG 147 -4.613 -8.559 -8.559 490 2HB ARG 147 1HB ARG 147 -3.057 -7.856 -7.856 491 1HG ARG 147 2HG ARG 147 -3.252 -8.905 -8.905 492 2HG ARG 147 1HG ARG 147 -5.078 -8.882 -8.882 493 1HD ARG 147 2HD ARG 147 -4.058 -11.248 -11.248 494 2HD ARG 147 1HD ARG 147 -4.890 -10.807 -10.807 495 HE ARG 147 HE ARG 147 -2.258 -9.894 -9.894 496 1HH1 ARG 147 1HH2 ARG 147 -3.813 -13.005 -13.005 497 2HH1 ARG 147 2HH2 ARG 147 -2.523 -13.974 -13.974 498 1HH2 ARG 147 1HH1 ARG 147 -0.519 -11.215 -11.215 499 2HH2 ARG 147 2HH1 ARG 147 -0.624 -12.942 -12.942 500 H VAL 148 H VAL 148 -3.207 -4.607 -4.607 501 HA VAL 148 HA VAL 148 -3.204 -5.097 -5.097 502 HB VAL 148 HB VAL 148 -2.532 -2.500 -2.500 503 1HG1 VAL 148 2HG1 VAL 148 -2.622 -3.261 -3.261 504 2HG1 VAL 148 1HG1 VAL 148 -1.208 -4.309 -4.309 505 3HG1 VAL 148 3HG1 VAL 148 -1.083 -2.503 -2.503 506 1HG2 VAL 148 3HG2 VAL 148 -0.753 -4.950 -4.950 507 2HG2 VAL 148 2HG2 VAL 148 -1.335 -3.939 -3.939 508 3HG2 VAL 148 1HG2 VAL 148 -0.188 -3.239 -3.239 509 H LYS 149 H LYS 149 -4.777 -2.737 -2.737 510 HA LYS 149 HA LYS 149 -6.281 -1.249 -1.249 511 1HB LYS 149 2HB LYS 149 -6.172 -1.117 -1.117 512 2HB LYS 149 1HB LYS 149 -7.077 -2.678 -2.678 513 1HG LYS 149 2HG LYS 149 -9.021 -1.933 -1.933 514 2HG LYS 149 1HG LYS 149 -8.461 -0.392 -0.392 515 1HD LYS 149 2HD LYS 149 -8.545 -1.133 -1.133 516 2HD LYS 149 1HD LYS 149 -9.827 -0.155 -0.155 517 1HE LYS 149 2HE LYS 149 -8.466 1.782 1.782 518 2HE LYS 149 1HE LYS 149 -7.083 0.843 0.843 519 1HZ LYS 149 3HZ LYS 149 -9.794 1.265 1.265 520 2HZ LYS 149 2HZ LYS 149 -8.384 2.118 2.118 521 3HZ LYS 149 1HZ LYS 149 -8.492 0.453 0.453 522 H ASP 150 H ASP 150 -7.028 -4.535 -4.535 523 HA ASP 150 HA ASP 150 -9.660 -4.479 -4.479 524 1HB ASP 150 2HB ASP 150 -7.748 -6.332 -6.332 525 2HB ASP 150 1HB ASP 150 -9.176 -6.985 -6.985 526 H ASP 151 H ASP 151 -6.586 -6.053 -6.053 527 HA ASP 151 HA ASP 151 -8.236 -7.014 -7.014 528 1HB ASP 151 2HB ASP 151 -6.060 -8.018 -8.018 529 2HB ASP 151 1HB ASP 151 -5.244 -6.691 -6.691 530 H LEU 152 H LEU 152 -6.720 -3.775 -3.775 531 HA LEU 152 HA LEU 152 -6.777 -3.195 -3.195 532 1HB LEU 152 2HB LEU 152 -5.914 -1.784 -1.784 533 2HB LEU 152 1HB LEU 152 -7.208 -0.883 -0.883 534 HG LEU 152 HG LEU 152 -5.175 0.039 0.039 535 1HD1 LEU 152 1HD1 LEU 152 -6.064 -1.844 -1.844 536 2HD1 LEU 152 3HD1 LEU 152 -4.991 -0.437 -0.437 537 3HD1 LEU 152 2HD1 LEU 152 -6.682 -0.213 -0.213 538 1HD2 LEU 152 1HD2 LEU 152 -4.236 -2.829 -2.829 539 2HD2 LEU 152 3HD2 LEU 152 -3.655 -1.416 -1.416 540 3HD2 LEU 152 2HD2 LEU 152 -3.305 -1.482 -1.482 541 H GLN 153 H GLN 153 -8.928 -2.807 -2.807 542 HA GLN 153 HA GLN 153 -10.471 -1.031 -1.031 543 1HB GLN 153 2HB GLN 153 -10.359 -3.409 -3.409 544 2HB GLN 153 1HB GLN 153 -11.808 -3.696 -3.696 545 1HG GLN 153 2HG GLN 153 -12.849 -1.669 -1.669 546 2HG GLN 153 1HG GLN 153 -11.196 -1.424 -1.424 547 1HE2 GLN 153 1HE2 GLN 153 -13.364 -4.311 -4.311 548 2HE2 GLN 153 2HE2 GLN 153 -13.269 -4.922 -4.922 549 H GLU 154 H GLU 154 -10.544 -3.006 -3.006 550 HA GLU 154 HA GLU 154 -13.089 -2.572 -2.572 551 1HB GLU 154 2HB GLU 154 -10.660 -2.796 -2.796 552 2HB GLU 154 1HB GLU 154 -12.263 -3.560 -3.560 553 1HG GLU 154 2HG GLU 154 -11.556 -5.080 -5.080 554 2HG GLU 154 1HG GLU 154 -9.962 -4.211 -4.211 555 H LEU 155 H LEU 155 -9.959 -1.167 -1.167 556 HA LEU 155 HA LEU 155 -11.121 0.964 0.964 557 1HB LEU 155 2HB LEU 155 -8.455 -0.402 -0.402 558 2HB LEU 155 1HB LEU 155 -8.334 1.380 1.380 559 HG LEU 155 HG LEU 155 -10.002 1.236 1.236 560 1HD1 LEU 155 2HD1 LEU 155 -10.127 -1.271 -1.271 561 2HD1 LEU 155 1HD1 LEU 155 -8.335 -1.357 -1.357 562 3HD1 LEU 155 3HD1 LEU 155 -9.358 -0.635 -0.635 563 1HD2 LEU 155 3HD2 LEU 155 -7.845 2.433 2.433 564 2HD2 LEU 155 2HD2 LEU 155 -8.005 1.517 1.517 565 3HD2 LEU 155 1HD2 LEU 155 -6.945 0.888 0.888 566 H ALA 156 H ALA 156 -8.859 0.327 0.327 567 HA ALA 156 HA ALA 156 -8.633 3.234 3.234 568 1HB ALA 156 3HB ALA 156 -6.430 1.808 1.808 569 2HB ALA 156 2HB ALA 156 -7.034 1.098 1.098 570 3HB ALA 156 1HB ALA 156 -6.674 2.843 2.843 571 H VAL 157 H VAL 157 -9.377 4.176 4.176 572 HA VAL 157 HA VAL 157 -8.473 2.065 2.065 573 HB VAL 157 HB VAL 157 -9.677 2.985 2.985 574 1HG1 VAL 157 3HG1 VAL 157 -11.488 2.837 2.837 575 2HG1 VAL 157 2HG1 VAL 157 -12.048 2.748 2.748 576 3HG1 VAL 157 1HG1 VAL 157 -10.970 1.446 1.446 577 1HG2 VAL 157 3HG2 VAL 157 -9.444 5.561 5.561 578 2HG2 VAL 157 2HG2 VAL 157 -10.821 5.015 5.015 579 3HG2 VAL 157 1HG2 VAL 157 -10.998 5.134 5.134 580 H VAL 158 H VAL 158 -7.906 2.671 2.671 581 HA VAL 158 HA VAL 158 -5.537 4.196 4.196 582 HB VAL 158 HB VAL 158 -7.076 3.116 3.116 583 1HG1 VAL 158 2HG1 VAL 158 -4.848 4.110 4.110 584 2HG1 VAL 158 1HG1 VAL 158 -4.113 2.839 2.839 585 3HG1 VAL 158 3HG1 VAL 158 -5.002 2.359 2.359 586 1HG2 VAL 158 1HG2 VAL 158 -5.709 1.443 1.443 587 2HG2 VAL 158 3HG2 VAL 158 -7.358 1.253 1.253 588 3HG2 VAL 158 2HG2 VAL 158 -5.895 0.837 0.837 589 H GLU 159 H GLU 159 -5.227 5.985 5.985 590 HA GLU 159 HA GLU 159 -7.483 7.726 7.726 591 1HB GLU 159 2HB GLU 159 -5.176 8.380 8.380 592 2HB GLU 159 1HB GLU 159 -4.702 7.963 7.963 593 1HG GLU 159 2HG GLU 159 -6.152 9.890 9.890 594 2HG GLU 159 1HG GLU 159 -6.681 10.193 10.193 595 H SER 160 H SER 160 -5.321 5.868 5.868 596 HA SER 160 HA SER 160 -7.131 6.154 6.154 597 1HB SER 160 2HB SER 160 -5.209 7.983 7.983 598 2HB SER 160 1HB SER 160 -4.342 6.516 6.516 599 HG SER 160 HG SER 160 -6.784 7.607 7.607 600 H PHE 161 H PHE 161 -6.980 4.336 4.336 601 HA PHE 161 HA PHE 161 -4.612 2.652 2.652 602 1HB PHE 161 2HB PHE 161 -7.083 1.657 1.657 603 2HB PHE 161 1HB PHE 161 -6.772 1.684 1.684 604 HD1 PHE 161 2HD PHE 161 -4.850 0.543 0.543 605 HD2 PHE 161 1HD PHE 161 -6.056 0.120 0.120 606 HE1 PHE 161 2HE PHE 161 -3.137 -1.219 -1.219 607 HE2 PHE 161 1HE PHE 161 -4.471 -1.327 -1.327 608 HZ PHE 161 HZ PHE 161 -2.971 -2.254 -2.254 609 HA PRO 162 HA PRO 162 -4.544 5.085 5.085 610 1HB PRO 162 2HB PRO 162 -1.734 3.979 3.979 611 2HB PRO 162 1HB PRO 162 -2.298 5.687 5.687 612 1HG PRO 162 2HG PRO 162 -0.843 4.773 4.773 613 2HG PRO 162 1HG PRO 162 -2.220 5.939 5.939 614 1HD PRO 162 2HD PRO 162 -2.254 2.897 2.897 615 2HD PRO 162 1HD PRO 162 -2.927 4.145 4.145 616 H THR 163 H THR 163 -2.294 2.285 2.285 617 HA THR 163 HA THR 163 -3.886 0.165 0.165 618 HB THR 163 HB THR 163 -3.600 1.986 1.986 619 HG1 THR 163 1HG THR 163 -5.672 1.468 1.468 620 1HG2 THR 163 3HG2 THR 163 -3.184 -1.028 -1.028 621 2HG2 THR 163 2HG2 THR 163 -3.790 -0.257 -0.257 622 3HG2 THR 163 1HG2 THR 163 -2.221 0.278 0.278 623 H LYS 164 H LYS 164 -1.548 2.381 2.381 624 HA LYS 164 HA LYS 164 0.581 0.422 0.422 625 1HB LYS 164 2HB LYS 164 1.428 1.059 1.059 626 2HB LYS 164 1HB LYS 164 -0.170 0.278 0.278 627 1HG LYS 164 2HG LYS 164 -1.285 2.518 2.518 628 2HG LYS 164 1HG LYS 164 0.321 3.326 3.326 629 1HD LYS 164 2HD LYS 164 -0.352 3.190 3.190 630 2HD LYS 164 1HD LYS 164 1.017 2.050 2.050 631 1HE LYS 164 2HE LYS 164 -0.599 0.120 0.120 632 2HE LYS 164 1HE LYS 164 -1.982 1.279 1.279 633 1HZ LYS 164 2HZ LYS 164 -1.039 1.983 1.983 634 2HZ LYS 164 1HZ LYS 164 0.258 0.901 0.901 635 3HZ LYS 164 3HZ LYS 164 -1.325 0.308 0.308 636 H ILE 165 H ILE 165 2.707 1.501 1.501 637 HA ILE 165 HA ILE 165 3.148 3.549 3.549 638 HB ILE 165 HB ILE 165 5.199 2.222 2.222 639 1HG1 ILE 165 2HG1 ILE 165 5.511 0.512 0.512 640 2HG1 ILE 165 1HG1 ILE 165 3.829 0.830 0.830 641 1HG2 ILE 165 1HG2 ILE 165 5.046 3.149 3.149 642 2HG2 ILE 165 3HG2 ILE 165 6.482 2.353 2.353 643 3HG2 ILE 165 2HG2 ILE 165 5.965 3.970 3.970 644 1HD1 ILE 165 2HD1 ILE 165 4.354 0.047 0.047 645 2HD1 ILE 165 1HD1 ILE 165 4.502 -1.187 -1.187 646 3HD1 ILE 165 3HD1 ILE 165 2.933 -0.318 -0.318 647 H GLU 166 H GLU 166 4.313 5.420 5.420 648 HA GLU 166 HA GLU 166 4.971 5.954 5.954 649 1HB GLU 166 2HB GLU 166 4.274 7.982 7.982 650 2HB GLU 166 1HB GLU 166 5.071 8.414 8.414 651 1HG GLU 166 2HG GLU 166 3.063 7.654 7.654 652 2HG GLU 166 1HG GLU 166 2.265 7.138 7.138 653 H GLY 167 H GLY 167 6.935 4.710 4.710 654 1HA GLY 167 2HA GLY 167 9.235 5.527 5.527 655 2HA GLY 167 1HA GLY 167 8.473 5.586 5.586 656 H ARG 168 H ARG 168 10.161 3.983 3.983 657 HA ARG 168 HA ARG 168 9.561 1.349 1.349 658 1HB ARG 168 2HB ARG 168 12.138 2.428 2.428 659 2HB ARG 168 1HB ARG 168 11.904 0.737 0.737 660 1HG ARG 168 2HG ARG 168 11.618 1.502 1.502 661 2HG ARG 168 1HG ARG 168 11.700 3.222 3.222 662 1HD ARG 168 2HD ARG 168 13.868 2.547 2.547 663 2HD ARG 168 1HD ARG 168 14.058 2.875 2.875 664 HE ARG 168 HE ARG 168 13.472 0.065 0.065 665 1HH1 ARG 168 1HH1 ARG 168 15.993 2.564 2.564 666 2HH1 ARG 168 2HH1 ARG 168 17.319 1.459 1.459 667 1HH2 ARG 168 1HH2 ARG 168 15.288 -1.433 -1.433 668 2HH2 ARG 168 2HH2 ARG 168 16.914 -0.839 -0.839 669 H GLN 169 H GLN 169 7.916 2.308 2.308 670 HA GLN 169 HA GLN 169 8.312 0.957 0.957 671 1HB GLN 169 2HB GLN 169 10.528 2.108 2.108 672 2HB GLN 169 1HB GLN 169 9.667 3.627 3.627 673 1HG GLN 169 2HG GLN 169 8.472 3.218 3.218 674 2HG GLN 169 1HG GLN 169 9.507 1.735 1.735 675 1HE2 GLN 169 1HE2 GLN 169 9.231 4.874 4.874 676 2HE2 GLN 169 2HE2 GLN 169 10.890 5.322 5.322 677 H MET 170 H MET 170 6.164 1.134 1.134 678 HA MET 170 HA MET 170 4.772 3.472 3.472 679 1HB MET 170 2HB MET 170 3.923 1.052 1.052 680 2HB MET 170 1HB MET 170 3.344 0.919 0.919 681 1HG MET 170 2HG MET 170 1.958 2.991 2.991 682 2HG MET 170 1HG MET 170 2.530 2.968 2.968 683 1HE MET 170 3HE MET 170 2.205 -0.671 -0.671 684 2HE MET 170 2HE MET 170 0.641 -0.917 -0.917 685 3HE MET 170 1HE MET 170 1.917 0.048 0.048 686 H ILE 171 H ILE 171 4.203 5.004 5.004 687 HA ILE 171 HA ILE 171 3.671 4.151 4.151 688 HB ILE 171 HB ILE 171 3.213 6.801 6.801 689 1HG1 ILE 171 2HG1 ILE 171 5.601 5.876 5.876 690 2HG1 ILE 171 1HG1 ILE 171 5.199 7.542 7.542 691 1HG2 ILE 171 1HG2 ILE 171 2.611 5.745 5.745 692 2HG2 ILE 171 3HG2 ILE 171 2.943 7.515 7.515 693 3HG2 ILE 171 2HG2 ILE 171 1.527 6.764 6.764 694 1HD1 ILE 171 3HD1 ILE 171 4.595 6.211 6.211 695 2HD1 ILE 171 2HD1 ILE 171 5.264 4.827 4.827 696 3HD1 ILE 171 1HD1 ILE 171 6.346 6.212 6.212 697 H MET 172 H MET 172 1.835 3.337 3.337 698 HA MET 172 HA MET 172 -0.696 4.171 4.171 699 1HB MET 172 2HB MET 172 -0.714 1.746 1.746 700 2HB MET 172 1HB MET 172 0.129 1.632 1.632 701 1HG MET 172 2HG MET 172 -1.844 2.304 2.304 702 2HG MET 172 1HG MET 172 -2.612 2.937 2.937 703 1HE MET 172 2HE MET 172 -3.050 0.922 0.922 704 2HE MET 172 1HE MET 172 -3.744 -0.623 -0.623 705 3HE MET 172 3HE MET 172 -1.950 -0.442 -0.442 706 H VAL 173 H VAL 173 -1.775 5.521 5.521 707 HA VAL 173 HA VAL 173 -0.358 6.225 6.225 708 HB VAL 173 HB VAL 173 -2.764 7.554 7.554 709 1HG1 VAL 173 3HG1 VAL 173 -0.816 8.015 8.015 710 2HG1 VAL 173 2HG1 VAL 173 -1.572 9.471 9.471 711 3HG1 VAL 173 1HG1 VAL 173 -2.609 8.260 8.260 712 1HG2 VAL 173 1HG2 VAL 173 0.257 8.072 8.072 713 2HG2 VAL 173 3HG2 VAL 173 -0.860 7.592 7.592 714 3HG2 VAL 173 2HG2 VAL 173 -1.022 9.206 9.206 715 H LEU 174 H LEU 174 -1.423 6.002 6.002 716 HA LEU 174 HA LEU 174 -3.881 4.483 4.483 717 1HB LEU 174 2HB LEU 174 -1.463 3.419 3.419 718 2HB LEU 174 1HB LEU 174 -1.655 3.828 3.828 719 HG LEU 174 HG LEU 174 -2.327 1.477 1.477 720 1HD1 LEU 174 2HD1 LEU 174 -2.338 2.141 2.141 721 2HD1 LEU 174 1HD1 LEU 174 -4.120 2.055 2.055 722 3HD1 LEU 174 3HD1 LEU 174 -3.084 0.637 0.637 723 1HD2 LEU 174 1HD2 LEU 174 -4.183 2.544 2.544 724 2HD2 LEU 174 3HD2 LEU 174 -4.771 1.237 1.237 725 3HD2 LEU 174 2HD2 LEU 174 -4.877 3.014 3.014 726 H ALA 175 H ALA 175 -5.238 6.351 6.351 727 HA ALA 175 HA ALA 175 -4.499 7.561 7.561 728 1HB ALA 175 1HB ALA 175 -5.537 8.685 8.685 729 2HB ALA 175 3HB ALA 175 -7.019 7.658 7.658 730 3HB ALA 175 2HB ALA 175 -6.592 9.003 9.003 731 HA PRO 176 HA PRO 176 -7.903 5.932 5.932 732 1HB PRO 176 2HB PRO 176 -8.966 8.782 8.782 733 2HB PRO 176 1HB PRO 176 -8.879 7.603 7.603 734 1HG PRO 176 2HG PRO 176 -7.009 9.592 9.592 735 2HG PRO 176 1HG PRO 176 -6.478 7.898 7.898 736 1HD PRO 176 2HD PRO 176 -6.355 9.354 9.354 737 2HD PRO 176 1HD PRO 176 -5.155 8.229 8.229 738 H LYS 177 H LYS 177 -10.084 5.229 5.229 739 HA LYS 177 HA LYS 177 -11.200 5.941 5.941 740 1HB LYS 177 2HB LYS 177 -11.622 3.697 3.697 741 2HB LYS 177 1HB LYS 177 -12.469 4.591 4.591 742 1HG LYS 177 2HG LYS 177 -14.176 5.376 5.376 743 2HG LYS 177 1HG LYS 177 -13.357 4.300 4.300 744 1HD LYS 177 2HD LYS 177 -14.587 3.451 3.451 745 2HD LYS 177 1HD LYS 177 -15.450 3.375 3.375 746 1HE LYS 177 2HE LYS 177 -12.867 1.784 1.784 747 2HE LYS 177 1HE LYS 177 -14.553 1.140 1.140 748 1HZ LYS 177 1HZ LYS 177 -14.822 1.692 1.692 749 2HZ LYS 177 3HZ LYS 177 -13.233 2.286 2.286 750 3HZ LYS 177 2HZ LYS 177 -13.508 0.643 0.643 751 H LYS 178 H LYS 178 -12.431 7.662 7.662 752 HA LYS 178 HA LYS 178 -12.680 9.682 9.682 753 1HB LYS 178 2HB LYS 178 -13.883 10.861 10.861 754 2HB LYS 178 1HB LYS 178 -12.523 9.889 9.889 755 1HG LYS 178 2HG LYS 178 -14.164 8.089 8.089 756 2HG LYS 178 1HG LYS 178 -15.514 9.177 9.177 757 1HD LYS 178 2HD LYS 178 -13.388 9.785 9.785 758 2HD LYS 178 1HD LYS 178 -15.060 9.196 9.196 759 1HE LYS 178 2HE LYS 178 -15.990 11.296 11.296 760 2HE LYS 178 1HE LYS 178 -14.303 11.914 11.914 761 1HZ LYS 178 3HZ LYS 178 -13.976 11.740 11.740 762 2HZ LYS 178 2HZ LYS 178 -15.563 11.176 11.176 763 3HZ LYS 178 1HZ LYS 178 -15.292 12.747 12.747 764 H LYS 179 H LYS 179 -14.260 10.574 10.574 765 HA LYS 179 HA LYS 179 -15.714 10.545 10.545 766 1HB LYS 179 2HB LYS 179 -17.448 10.606 10.606 767 2HB LYS 179 1HB LYS 179 -17.535 8.816 8.816 768 1HG LYS 179 2HG LYS 179 -19.413 9.798 9.798 769 2HG LYS 179 1HG LYS 179 -18.370 8.928 8.928 770 1HD LYS 179 2HD LYS 179 -17.373 11.140 11.140 771 2HD LYS 179 1HD LYS 179 -18.416 11.977 11.977 772 1HE LYS 179 2HE LYS 179 -19.407 12.146 12.146 773 2HE LYS 179 1HE LYS 179 -20.463 11.100 11.100 774 1HZ LYS 179 1HZ LYS 179 -19.392 9.174 9.174 775 2HZ LYS 179 3HZ LYS 179 -18.431 10.169 10.169 776 3HZ LYS 179 2HZ LYS 179 -20.118 10.153 10.153 777 H GLN 180 H GLN 180 -14.233 9.477 9.477 778 HA GLN 180 HA GLN 180 -14.183 6.652 6.652 779 1HB GLN 180 2HB GLN 180 -13.325 8.755 8.755 780 2HB GLN 180 1HB GLN 180 -12.961 6.988 6.988 781 1HG GLN 180 2HG GLN 180 -11.598 7.147 7.147 782 2HG GLN 180 1HG GLN 180 -11.998 8.899 8.899 783 1HE2 GLN 180 1HE2 GLN 180 -11.727 7.966 7.966 784 2HE2 GLN 180 2HE2 GLN 180 -10.107 8.505 8.505 Start of MODEL 17 1 HA VAL 90 HA VAL 90 -2.782 16.490 16.490 2 HB VAL 90 HB VAL 90 -4.525 16.447 16.447 3 1HG1 VAL 90 2HG1 VAL 90 -5.161 18.267 18.267 4 2HG1 VAL 90 1HG1 VAL 90 -6.167 17.038 17.038 5 3HG1 VAL 90 3HG1 VAL 90 -6.597 17.519 17.519 6 1HG2 VAL 90 3HG2 VAL 90 -6.091 14.563 14.563 7 2HG2 VAL 90 2HG2 VAL 90 -5.214 14.082 14.082 8 3HG2 VAL 90 1HG2 VAL 90 -6.650 15.138 15.138 9 H ILE 91 H ILE 91 -3.936 15.239 15.239 10 HA ILE 91 HA ILE 91 -3.369 12.400 12.400 11 HB ILE 91 HB ILE 91 -4.303 13.891 13.891 12 1HG1 ILE 91 2HG1 ILE 91 -6.029 14.012 14.012 13 2HG1 ILE 91 1HG1 ILE 91 -6.510 12.802 12.802 14 1HG2 ILE 91 1HG2 ILE 91 -3.959 10.884 10.884 15 2HG2 ILE 91 3HG2 ILE 91 -4.907 11.516 11.516 16 3HG2 ILE 91 2HG2 ILE 91 -3.143 11.822 11.822 17 1HD1 ILE 91 2HD1 ILE 91 -5.725 10.949 10.949 18 2HD1 ILE 91 1HD1 ILE 91 -5.331 12.185 12.185 19 3HD1 ILE 91 3HD1 ILE 91 -7.037 11.958 11.958 20 H GLN 92 H GLN 92 -1.450 11.631 11.631 21 HA GLN 92 HA GLN 92 0.663 13.329 13.329 22 1HB GLN 92 2HB GLN 92 0.683 10.770 10.770 23 2HB GLN 92 1HB GLN 92 2.066 11.901 11.901 24 1HG GLN 92 2HG GLN 92 0.975 13.585 13.585 25 2HG GLN 92 1HG GLN 92 -0.632 12.846 12.846 26 1HE2 GLN 92 1HE2 GLN 92 -1.459 11.753 11.753 27 2HE2 GLN 92 2HE2 GLN 92 -0.615 10.968 10.968 28 H VAL 93 H VAL 93 2.560 12.036 12.036 29 HA VAL 93 HA VAL 93 1.357 9.917 9.917 30 HB VAL 93 HB VAL 93 3.937 11.413 11.413 31 1HG1 VAL 93 3HG1 VAL 93 2.457 8.993 8.993 32 2HG1 VAL 93 2HG1 VAL 93 3.670 9.923 9.923 33 3HG1 VAL 93 1HG1 VAL 93 4.229 8.999 8.999 34 1HG2 VAL 93 1HG2 VAL 93 1.470 12.305 12.305 35 2HG2 VAL 93 3HG2 VAL 93 2.742 12.159 12.159 36 3HG2 VAL 93 2HG2 VAL 93 1.578 10.809 10.809 37 H LYS 94 H LYS 94 1.600 7.801 7.801 38 HA LYS 94 HA LYS 94 4.453 7.388 7.388 39 1HB LYS 94 2HB LYS 94 2.274 5.320 5.320 40 2HB LYS 94 1HB LYS 94 3.881 5.206 5.206 41 1HG LYS 94 2HG LYS 94 1.790 7.284 7.284 42 2HG LYS 94 1HG LYS 94 1.919 5.679 5.679 43 1HD LYS 94 2HD LYS 94 4.252 6.071 6.071 44 2HD LYS 94 1HD LYS 94 4.270 7.671 7.671 45 1HE LYS 94 2HE LYS 94 2.416 6.991 6.991 46 2HE LYS 94 1HE LYS 94 4.016 7.830 7.830 47 1HZ LYS 94 3HZ LYS 94 3.196 9.529 9.529 48 2HZ LYS 94 2HZ LYS 94 1.689 8.756 8.756 49 3HZ LYS 94 1HZ LYS 94 2.207 9.379 9.379 50 H GLU 95 H GLU 95 5.218 5.183 5.183 51 HA GLU 95 HA GLU 95 4.109 4.987 4.987 52 1HB GLU 95 2HB GLU 95 6.093 6.598 6.598 53 2HB GLU 95 1HB GLU 95 6.998 5.133 5.133 54 1HG GLU 95 2HG GLU 95 6.712 4.119 4.119 55 2HG GLU 95 1HG GLU 95 5.633 5.490 5.490 56 H ILE 96 H ILE 96 4.671 2.910 2.910 57 HA ILE 96 HA ILE 96 6.269 1.123 1.123 58 HB ILE 96 HB ILE 96 3.569 0.853 0.853 59 1HG1 ILE 96 2HG1 ILE 96 3.883 -1.633 -1.633 60 2HG1 ILE 96 1HG1 ILE 96 5.548 -1.502 -1.502 61 1HG2 ILE 96 1HG2 ILE 96 3.240 0.789 0.789 62 2HG2 ILE 96 3HG2 ILE 96 4.024 -0.861 -0.861 63 3HG2 ILE 96 2HG2 ILE 96 2.570 -0.605 -0.605 64 1HD1 ILE 96 2HD1 ILE 96 4.471 -0.034 -0.034 65 2HD1 ILE 96 1HD1 ILE 96 5.481 -1.529 -1.529 66 3HD1 ILE 96 3HD1 ILE 96 6.173 0.016 0.016 67 H LYS 97 H LYS 97 6.976 -0.789 -0.789 68 HA LYS 97 HA LYS 97 6.395 -0.059 -0.059 69 1HB LYS 97 2HB LYS 97 8.883 -1.610 -1.610 70 2HB LYS 97 1HB LYS 97 8.273 -1.179 -1.179 71 1HG LYS 97 2HG LYS 97 8.632 1.245 1.245 72 2HG LYS 97 1HG LYS 97 9.219 0.833 0.833 73 1HD LYS 97 2HD LYS 97 11.081 -0.503 -0.503 74 2HD LYS 97 1HD LYS 97 10.517 -0.056 -0.056 75 1HE LYS 97 2HE LYS 97 11.017 2.341 2.341 76 2HE LYS 97 1HE LYS 97 11.397 1.976 1.976 77 1HZ LYS 97 1HZ LYS 97 13.204 0.587 0.587 78 2HZ LYS 97 3HZ LYS 97 12.859 0.933 0.933 79 3HZ LYS 97 2HZ LYS 97 13.369 2.172 2.172 80 H PHE 98 H PHE 98 6.100 -1.852 -1.852 81 HA PHE 98 HA PHE 98 5.943 -4.426 -4.426 82 1HB PHE 98 2HB PHE 98 3.788 -3.153 -3.153 83 2HB PHE 98 1HB PHE 98 3.919 -4.924 -4.924 84 HD1 PHE 98 2HD PHE 98 4.334 -5.579 -5.579 85 HD2 PHE 98 1HD PHE 98 2.100 -2.468 -2.468 86 HE1 PHE 98 2HE PHE 98 3.184 -5.329 -5.329 87 HE2 PHE 98 1HE PHE 98 0.810 -2.230 -2.230 88 HZ PHE 98 HZ PHE 98 1.213 -3.876 -3.876 89 H ARG 99 H ARG 99 6.071 -6.186 -6.186 90 HA ARG 99 HA ARG 99 7.971 -5.562 -5.562 91 1HB ARG 99 2HB ARG 99 7.100 -8.099 -8.099 92 2HB ARG 99 1HB ARG 99 8.400 -7.987 -7.987 93 1HG ARG 99 2HG ARG 99 9.940 -7.006 -7.006 94 2HG ARG 99 1HG ARG 99 8.689 -6.357 -6.357 95 1HD ARG 99 2HD ARG 99 10.008 -8.322 -8.322 96 2HD ARG 99 1HD ARG 99 8.206 -8.550 -8.550 97 HE ARG 99 HE ARG 99 9.492 -9.592 -9.592 98 1HH1 ARG 99 1HH1 ARG 99 8.762 -10.235 -10.235 99 2HH1 ARG 99 2HH1 ARG 99 8.693 -11.955 -11.955 100 1HH2 ARG 99 1HH2 ARG 99 9.394 -11.929 -11.929 101 2HH2 ARG 99 2HH2 ARG 99 9.058 -12.929 -12.929 102 HA PRO 100 HA PRO 100 5.196 -7.581 -7.581 103 1HB PRO 100 2HB PRO 100 7.686 -9.390 -9.390 104 2HB PRO 100 1HB PRO 100 6.698 -8.809 -8.809 105 1HG PRO 100 2HG PRO 100 9.104 -7.649 -7.649 106 2HG PRO 100 1HG PRO 100 7.755 -6.660 -6.660 107 1HD PRO 100 2HD PRO 100 8.769 -6.635 -6.635 108 2HD PRO 100 1HD PRO 100 7.609 -5.516 -5.516 109 H GLY 101 H GLY 101 3.968 -9.394 -9.394 110 1HA GLY 101 2HA GLY 101 2.723 -10.472 -10.472 111 2HA GLY 101 1HA GLY 101 3.325 -11.602 -11.602 112 H THR 102 H THR 102 2.904 -10.899 -10.899 113 HA THR 102 HA THR 102 5.500 -11.602 -11.602 114 HB THR 102 HB THR 102 3.385 -10.321 -10.321 115 HG1 THR 102 1HG THR 102 3.103 -9.514 -9.514 116 1HG2 THR 102 1HG2 THR 102 6.360 -9.761 -9.761 117 2HG2 THR 102 3HG2 THR 102 5.360 -8.742 -8.742 118 3HG2 THR 102 2HG2 THR 102 5.750 -10.430 -10.430 119 H ASP 103 H ASP 103 4.422 -11.669 -11.669 120 HA ASP 103 HA ASP 103 4.586 -14.560 -14.560 121 1HB ASP 103 2HB ASP 103 5.935 -12.280 -12.280 122 2HB ASP 103 1HB ASP 103 5.122 -12.672 -12.672 123 H GLU 104 H GLU 104 3.949 -15.280 -15.280 124 HA GLU 104 HA GLU 104 1.322 -14.323 -14.323 125 1HB GLU 104 2HB GLU 104 3.069 -16.395 -16.395 126 2HB GLU 104 1HB GLU 104 1.395 -15.971 -15.971 127 1HG GLU 104 2HG GLU 104 0.529 -16.759 -16.759 128 2HG GLU 104 1HG GLU 104 2.215 -17.145 -17.145 129 H GLY 105 H GLY 105 4.023 -14.953 -14.953 130 1HA GLY 105 2HA GLY 105 3.382 -12.326 -12.326 131 2HA GLY 105 1HA GLY 105 4.044 -13.743 -13.743 132 H ASP 106 H ASP 106 4.949 -12.438 -12.438 133 HA ASP 106 HA ASP 106 6.949 -10.841 -10.841 134 1HB ASP 106 2HB ASP 106 7.661 -12.112 -12.112 135 2HB ASP 106 1HB ASP 106 6.700 -10.920 -10.920 136 H TYR 107 H TYR 107 4.139 -11.130 -11.130 137 HA TYR 107 HA TYR 107 4.227 -8.283 -8.283 138 1HB TYR 107 2HB TYR 107 3.566 -10.196 -10.196 139 2HB TYR 107 1HB TYR 107 2.144 -10.440 -10.440 140 HD1 TYR 107 1HD TYR 107 2.247 -6.989 -6.989 141 HD2 TYR 107 2HD TYR 107 1.496 -10.675 -10.675 142 HE1 TYR 107 1HE TYR 107 0.086 -6.110 -6.110 143 HE2 TYR 107 2HE TYR 107 -0.445 -9.665 -9.665 144 HH TYR 107 HH TYR 107 -1.555 -6.415 -6.415 145 H GLN 108 H GLN 108 1.420 -10.304 -10.304 146 HA GLN 108 HA GLN 108 0.263 -8.284 -8.284 147 1HB GLN 108 2HB GLN 108 -0.521 -10.815 -10.815 148 2HB GLN 108 1HB GLN 108 -1.442 -9.539 -9.539 149 1HG GLN 108 2HG GLN 108 0.275 -11.457 -11.457 150 2HG GLN 108 1HG GLN 108 -1.195 -11.949 -11.949 151 1HE2 GLN 108 1HE2 GLN 108 -0.173 -8.672 -8.672 152 2HE2 GLN 108 2HE2 GLN 108 -1.427 -8.529 -8.529 153 H VAL 109 H VAL 109 2.849 -9.594 -9.594 154 HA VAL 109 HA VAL 109 2.362 -8.713 -8.713 155 HB VAL 109 HB VAL 109 4.954 -8.862 -8.862 156 1HG1 VAL 109 2HG1 VAL 109 4.537 -8.168 -8.168 157 2HG1 VAL 109 1HG1 VAL 109 6.092 -8.768 -8.768 158 3HG1 VAL 109 3HG1 VAL 109 5.439 -7.207 -7.207 159 1HG2 VAL 109 1HG2 VAL 109 3.770 -11.043 -11.043 160 2HG2 VAL 109 3HG2 VAL 109 5.388 -10.903 -10.903 161 3HG2 VAL 109 2HG2 VAL 109 3.890 -10.664 -10.664 162 H LYS 110 H LYS 110 3.626 -7.154 -7.154 163 HA LYS 110 HA LYS 110 3.524 -4.600 -4.600 164 1HB LYS 110 2HB LYS 110 4.486 -5.495 -5.495 165 2HB LYS 110 1HB LYS 110 4.351 -3.791 -3.791 166 1HG LYS 110 2HG LYS 110 6.184 -5.954 -5.954 167 2HG LYS 110 1HG LYS 110 6.506 -4.236 -4.236 168 1HD LYS 110 2HD LYS 110 5.576 -3.376 -3.376 169 2HD LYS 110 1HD LYS 110 5.305 -5.062 -5.062 170 1HE LYS 110 2HE LYS 110 7.386 -4.149 -4.149 171 2HE LYS 110 1HE LYS 110 7.808 -5.480 -5.480 172 1HZ LYS 110 3HZ LYS 110 8.291 -3.800 -3.800 173 2HZ LYS 110 2HZ LYS 110 7.909 -2.558 -2.558 174 3HZ LYS 110 1HZ LYS 110 9.231 -3.581 -3.581 175 H LEU 111 H LEU 111 1.332 -6.450 -6.450 176 HA LEU 111 HA LEU 111 -0.207 -4.189 -4.189 177 1HB LEU 111 2HB LEU 111 -0.435 -6.577 -6.577 178 2HB LEU 111 1HB LEU 111 -1.327 -6.942 -6.942 179 HG LEU 111 HG LEU 111 -2.066 -4.600 -4.600 180 1HD1 LEU 111 3HD1 LEU 111 -1.770 -6.553 -6.553 181 2HD1 LEU 111 2HD1 LEU 111 -2.873 -7.537 -7.537 182 3HD1 LEU 111 1HD1 LEU 111 -3.516 -6.118 -6.118 183 1HD2 LEU 111 2HD2 LEU 111 -3.658 -6.450 -6.450 184 2HD2 LEU 111 1HD2 LEU 111 -3.396 -4.666 -4.666 185 3HD2 LEU 111 3HD2 LEU 111 -4.454 -5.333 -5.333 186 H ARG 112 H ARG 112 0.423 -6.257 -6.257 187 HA ARG 112 HA ARG 112 -1.371 -5.146 -5.146 188 1HB ARG 112 2HB ARG 112 0.384 -7.151 -7.151 189 2HB ARG 112 1HB ARG 112 1.247 -5.829 -5.829 190 1HG ARG 112 2HG ARG 112 -0.067 -6.800 -6.800 191 2HG ARG 112 1HG ARG 112 -1.076 -5.405 -5.405 192 1HD ARG 112 2HD ARG 112 -2.257 -7.116 -7.116 193 2HD ARG 112 1HD ARG 112 -1.430 -8.408 -8.408 194 HE ARG 112 HE ARG 112 -2.687 -6.587 -6.587 195 1HH1 ARG 112 1HH1 ARG 112 -3.509 -8.934 -8.934 196 2HH1 ARG 112 2HH1 ARG 112 -5.046 -9.357 -9.357 197 1HH2 ARG 112 1HH2 ARG 112 -4.777 -7.172 -7.172 198 2HH2 ARG 112 2HH2 ARG 112 -5.777 -8.342 -8.342 199 H SER 113 H SER 113 2.011 -3.998 -3.998 200 HA SER 113 HA SER 113 2.113 -2.070 -2.070 201 1HB SER 113 2HB SER 113 3.979 -2.812 -2.812 202 2HB SER 113 1HB SER 113 3.342 -1.950 -1.950 203 HG SER 113 HG SER 113 4.846 -0.737 -0.737 204 H LEU 114 H LEU 114 0.617 -1.838 -1.838 205 HA LEU 114 HA LEU 114 -0.016 0.873 0.873 206 1HB LEU 114 2HB LEU 114 -1.415 -1.493 -1.493 207 2HB LEU 114 1HB LEU 114 -1.904 0.219 0.219 208 HG LEU 114 HG LEU 114 -0.760 0.027 0.027 209 1HD1 LEU 114 1HD1 LEU 114 0.271 1.768 1.768 210 2HD1 LEU 114 3HD1 LEU 114 1.684 0.694 0.694 211 3HD1 LEU 114 2HD1 LEU 114 1.295 1.354 1.354 212 1HD2 LEU 114 2HD2 LEU 114 -0.011 -2.356 -2.356 213 2HD2 LEU 114 1HD2 LEU 114 0.767 -1.378 -1.378 214 3HD2 LEU 114 3HD2 LEU 114 1.618 -1.576 -1.576 215 H ILE 115 H ILE 115 -1.820 -2.080 -2.080 216 HA ILE 115 HA ILE 115 -4.249 -0.779 -0.779 217 HB ILE 115 HB ILE 115 -3.617 -2.238 -2.238 218 1HG1 ILE 115 2HG1 ILE 115 -2.587 -3.723 -3.723 219 2HG1 ILE 115 1HG1 ILE 115 -3.966 -4.464 -4.464 220 1HG2 ILE 115 1HG2 ILE 115 -5.888 -1.920 -1.920 221 2HG2 ILE 115 3HG2 ILE 115 -5.951 -3.026 -3.026 222 3HG2 ILE 115 2HG2 ILE 115 -5.646 -1.265 -1.265 223 1HD1 ILE 115 1HD1 ILE 115 -5.469 -3.860 -3.860 224 2HD1 ILE 115 3HD1 ILE 115 -3.973 -3.193 -3.193 225 3HD1 ILE 115 2HD1 ILE 115 -4.112 -4.969 -4.969 226 H ARG 116 H ARG 116 -1.611 -1.086 -1.086 227 HA ARG 116 HA ARG 116 -2.388 0.309 0.309 228 1HB ARG 116 2HB ARG 116 -0.307 -1.138 -1.138 229 2HB ARG 116 1HB ARG 116 0.502 0.296 0.296 230 1HG ARG 116 2HG ARG 116 -0.804 0.348 0.348 231 2HG ARG 116 1HG ARG 116 0.792 -0.425 -0.425 232 1HD ARG 116 2HD ARG 116 0.222 2.556 2.556 233 2HD ARG 116 1HD ARG 116 1.040 1.914 1.914 234 HE ARG 116 HE ARG 116 2.115 1.983 1.983 235 1HH1 ARG 116 1HH1 ARG 116 2.499 0.840 0.840 236 2HH1 ARG 116 2HH1 ARG 116 4.191 0.505 0.505 237 1HH2 ARG 116 1HH2 ARG 116 4.396 1.522 1.522 238 2HH2 ARG 116 2HH2 ARG 116 5.279 0.896 0.896 239 H PHE 117 H PHE 117 -0.657 1.570 1.570 240 HA PHE 117 HA PHE 117 -0.401 4.127 4.127 241 1HB PHE 117 2HB PHE 117 -0.866 2.918 2.918 242 2HB PHE 117 1HB PHE 117 -0.203 4.557 4.557 243 HD1 PHE 117 2HD PHE 117 1.289 2.605 2.605 244 HD2 PHE 117 1HD PHE 117 1.004 3.144 3.144 245 HE1 PHE 117 2HE PHE 117 3.686 2.038 2.038 246 HE2 PHE 117 1HE PHE 117 3.408 2.420 2.420 247 HZ PHE 117 HZ PHE 117 4.753 1.951 1.951 248 H LEU 118 H LEU 118 -3.026 2.704 2.704 249 HA LEU 118 HA LEU 118 -4.558 5.043 5.043 250 1HB LEU 118 2HB LEU 118 -4.806 2.116 2.116 251 2HB LEU 118 1HB LEU 118 -6.238 3.206 3.206 252 HG LEU 118 HG LEU 118 -3.672 4.420 4.420 253 1HD1 LEU 118 2HD1 LEU 118 -3.950 1.765 1.765 254 2HD1 LEU 118 1HD1 LEU 118 -4.499 2.830 2.830 255 3HD1 LEU 118 3HD1 LEU 118 -2.868 3.116 3.116 256 1HD2 LEU 118 3HD2 LEU 118 -6.070 5.235 5.235 257 2HD2 LEU 118 2HD2 LEU 118 -5.014 5.291 5.291 258 3HD2 LEU 118 1HD2 LEU 118 -6.292 4.019 4.019 259 H GLU 119 H GLU 119 -4.380 2.703 2.703 260 HA GLU 119 HA GLU 119 -6.875 3.141 3.141 261 1HB GLU 119 2HB GLU 119 -4.220 1.988 1.988 262 2HB GLU 119 1HB GLU 119 -5.403 2.511 2.511 263 1HG GLU 119 2HG GLU 119 -7.055 0.873 0.873 264 2HG GLU 119 1HG GLU 119 -5.957 0.400 0.400 265 H GLU 120 H GLU 120 -3.529 4.467 4.467 266 HA GLU 120 HA GLU 120 -4.152 6.264 6.264 267 1HB GLU 120 2HB GLU 120 -2.105 6.820 6.820 268 2HB GLU 120 1HB GLU 120 -2.174 7.573 7.573 269 1HG GLU 120 2HG GLU 120 -1.622 5.269 5.269 270 2HG GLU 120 1HG GLU 120 -1.378 4.685 4.685 271 H GLY 121 H GLY 121 -4.774 6.205 6.205 272 1HA GLY 121 2HA GLY 121 -5.921 7.545 7.545 273 2HA GLY 121 1HA GLY 121 -5.994 8.778 8.778 274 H ASP 122 H ASP 122 -3.668 7.006 7.006 275 HA ASP 122 HA ASP 122 -2.425 9.590 9.590 276 1HB ASP 122 2HB ASP 122 -0.974 6.925 6.925 277 2HB ASP 122 1HB ASP 122 -0.272 8.568 8.568 278 H LYS 123 H LYS 123 -1.537 9.347 9.347 279 HA LYS 123 HA LYS 123 -3.289 7.621 7.621 280 1HB LYS 123 2HB LYS 123 -3.570 10.052 10.052 281 2HB LYS 123 1HB LYS 123 -1.782 10.221 10.221 282 1HG LYS 123 2HG LYS 123 -3.090 8.134 8.134 283 2HG LYS 123 1HG LYS 123 -3.459 9.852 9.852 284 1HD LYS 123 2HD LYS 123 -0.631 8.612 8.612 285 2HD LYS 123 1HD LYS 123 -1.622 9.088 9.088 286 1HE LYS 123 2HE LYS 123 -1.726 11.435 11.435 287 2HE LYS 123 1HE LYS 123 -0.355 10.770 10.770 288 1HZ LYS 123 1HZ LYS 123 0.872 10.346 10.346 289 2HZ LYS 123 3HZ LYS 123 -0.401 10.936 10.936 290 3HZ LYS 123 2HZ LYS 123 0.443 11.987 11.987 291 H ALA 124 H ALA 124 -2.154 5.826 5.826 292 HA ALA 124 HA ALA 124 0.735 6.079 6.079 293 1HB ALA 124 3HB ALA 124 -0.484 4.012 4.012 294 2HB ALA 124 2HB ALA 124 -0.990 3.698 3.698 295 3HB ALA 124 1HB ALA 124 0.767 3.659 3.659 296 H LYS 125 H LYS 125 2.106 5.754 5.754 297 HA LYS 125 HA LYS 125 0.346 5.380 5.380 298 1HB LYS 125 2HB LYS 125 1.242 7.732 7.732 299 2HB LYS 125 1HB LYS 125 2.858 7.094 7.094 300 1HG LYS 125 2HG LYS 125 3.394 6.464 6.464 301 2HG LYS 125 1HG LYS 125 1.673 6.555 6.555 302 1HD LYS 125 2HD LYS 125 2.960 8.466 8.466 303 2HD LYS 125 1HD LYS 125 1.705 9.030 9.030 304 1HE LYS 125 2HE LYS 125 3.406 9.332 9.332 305 2HE LYS 125 1HE LYS 125 4.689 8.638 8.638 306 1HZ LYS 125 2HZ LYS 125 4.286 10.455 10.455 307 2HZ LYS 125 1HZ LYS 125 3.093 11.099 11.099 308 3HZ LYS 125 3HZ LYS 125 4.709 11.030 11.030 309 H ILE 126 H ILE 126 0.823 3.539 3.539 310 HA ILE 126 HA ILE 126 3.091 2.007 2.007 311 HB ILE 126 HB ILE 126 1.340 1.722 1.722 312 1HG1 ILE 126 2HG1 ILE 126 -0.346 2.026 2.026 313 2HG1 ILE 126 1HG1 ILE 126 -0.179 0.279 0.279 314 1HG2 ILE 126 3HG2 ILE 126 2.843 -0.164 -0.164 315 2HG2 ILE 126 2HG2 ILE 126 1.780 -0.681 -0.681 316 3HG2 ILE 126 1HG2 ILE 126 3.312 0.182 0.182 317 1HD1 ILE 126 3HD1 ILE 126 1.232 0.059 0.059 318 2HD1 ILE 126 2HD1 ILE 126 0.821 1.780 1.780 319 3HD1 ILE 126 1HD1 ILE 126 -0.477 0.514 0.514 320 H THR 127 H THR 127 5.028 1.933 1.933 321 HA THR 127 HA THR 127 5.038 3.137 3.137 322 HB THR 127 HB THR 127 7.445 2.515 2.515 323 HG1 THR 127 1HG THR 127 6.153 4.987 4.987 324 1HG2 THR 127 1HG2 THR 127 6.911 4.020 4.020 325 2HG2 THR 127 3HG2 THR 127 8.479 4.123 4.123 326 3HG2 THR 127 2HG2 THR 127 7.929 2.541 2.541 327 H LEU 128 H LEU 128 4.763 1.629 1.629 328 HA LEU 128 HA LEU 128 5.637 -1.078 -1.078 329 1HB LEU 128 2HB LEU 128 3.658 -0.387 -0.387 330 2HB LEU 128 1HB LEU 128 4.935 -0.013 -0.013 331 HG LEU 128 HG LEU 128 5.592 -2.229 -2.229 332 1HD1 LEU 128 3HD1 LEU 128 3.819 -3.025 -3.025 333 2HD1 LEU 128 2HD1 LEU 128 4.380 -4.176 -4.176 334 3HD1 LEU 128 1HD1 LEU 128 5.591 -3.341 -3.341 335 1HD2 LEU 128 2HD2 LEU 128 3.332 -1.090 -1.090 336 2HD2 LEU 128 1HD2 LEU 128 3.626 -2.875 -2.875 337 3HD2 LEU 128 3HD2 LEU 128 2.570 -2.299 -2.299 338 H ARG 129 H ARG 129 7.431 -2.131 -2.131 339 HA ARG 129 HA ARG 129 9.212 -0.497 -0.497 340 1HB ARG 129 2HB ARG 129 10.014 -0.069 -0.069 341 2HB ARG 129 1HB ARG 129 9.958 -1.842 -1.842 342 1HG ARG 129 2HG ARG 129 11.763 -2.259 -2.259 343 2HG ARG 129 1HG ARG 129 11.524 -0.666 -0.666 344 1HD ARG 129 2HD ARG 129 12.649 -1.043 -1.043 345 2HD ARG 129 1HD ARG 129 13.652 -0.814 -0.814 346 HE ARG 129 HE ARG 129 11.613 1.269 1.269 347 1HH1 ARG 129 1HH2 ARG 129 14.823 0.149 0.149 348 2HH1 ARG 129 2HH2 ARG 129 15.396 1.732 1.732 349 1HH2 ARG 129 1HH1 ARG 129 12.406 3.412 3.412 350 2HH2 ARG 129 2HH1 ARG 129 14.005 3.609 3.609 351 H PHE 130 H PHE 130 8.821 -1.666 -1.666 352 HA PHE 130 HA PHE 130 8.171 -4.464 -4.464 353 1HB PHE 130 2HB PHE 130 9.262 -2.405 -2.405 354 2HB PHE 130 1HB PHE 130 8.756 -4.112 -4.112 355 HD1 PHE 130 1HD PHE 130 6.572 -4.885 -4.885 356 HD2 PHE 130 2HD PHE 130 7.654 -0.817 -0.817 357 HE1 PHE 130 1HE PHE 130 4.251 -4.199 -4.199 358 HE2 PHE 130 2HE PHE 130 5.271 -0.145 -0.145 359 HZ PHE 130 HZ PHE 130 3.553 -1.921 -1.921 360 H ARG 131 H ARG 131 9.811 -5.886 -5.886 361 HA ARG 131 HA ARG 131 12.648 -5.308 -5.308 362 1HB ARG 131 2HB ARG 131 11.208 -7.991 -7.991 363 2HB ARG 131 1HB ARG 131 12.987 -7.769 -7.769 364 1HG ARG 131 2HG ARG 131 12.942 -6.398 -6.398 365 2HG ARG 131 1HG ARG 131 11.144 -6.404 -6.404 366 1HD ARG 131 2HD ARG 131 12.872 -8.947 -8.947 367 2HD ARG 131 1HD ARG 131 12.116 -8.032 -8.032 368 HE ARG 131 HE ARG 131 10.025 -8.519 -8.519 369 1HH1 ARG 131 1HH2 ARG 131 12.363 -10.403 -10.403 370 2HH1 ARG 131 2HH2 ARG 131 11.323 -11.774 -11.774 371 1HH2 ARG 131 1HH1 ARG 131 8.619 -10.386 -10.386 372 2HH2 ARG 131 2HH1 ARG 131 9.166 -11.766 -11.766 373 H GLY 132 H GLY 132 13.098 -5.014 -5.014 374 1HA GLY 132 2HA GLY 132 10.918 -5.182 -5.182 375 2HA GLY 132 1HA GLY 132 12.568 -4.763 -4.763 376 H ARG 133 H ARG 133 10.023 -6.592 -6.592 377 HA ARG 133 HA ARG 133 11.327 -9.041 -9.041 378 1HB ARG 133 2HB ARG 133 8.482 -8.185 -8.185 379 2HB ARG 133 1HB ARG 133 9.021 -9.405 -9.405 380 1HG ARG 133 2HG ARG 133 8.099 -10.512 -10.512 381 2HG ARG 133 1HG ARG 133 9.821 -10.932 -10.932 382 1HD ARG 133 2HD ARG 133 10.548 -9.443 -9.443 383 2HD ARG 133 1HD ARG 133 8.845 -8.942 -8.942 384 HE ARG 133 HE ARG 133 10.145 -11.529 -11.529 385 1HH1 ARG 133 1HH2 ARG 133 7.058 -9.769 -9.769 386 2HH1 ARG 133 2HH2 ARG 133 6.197 -10.766 -10.766 387 1HH2 ARG 133 1HH1 ARG 133 8.961 -12.856 -12.856 388 2HH2 ARG 133 2HH1 ARG 133 7.287 -12.535 -12.535 389 H GLU 134 H GLU 134 9.178 -7.402 -7.402 390 HA GLU 134 HA GLU 134 10.870 -6.892 -6.892 391 1HB GLU 134 2HB GLU 134 8.380 -7.014 -7.014 392 2HB GLU 134 1HB GLU 134 8.172 -5.554 -5.554 393 1HG GLU 134 2HG GLU 134 9.503 -4.201 -4.201 394 2HG GLU 134 1HG GLU 134 9.708 -5.688 -5.688 395 H MET 135 H MET 135 9.098 -4.794 -4.794 396 HA MET 135 HA MET 135 11.505 -3.678 -3.678 397 1HB MET 135 2HB MET 135 11.118 -2.371 -2.371 398 2HB MET 135 1HB MET 135 9.637 -1.722 -1.722 399 1HG MET 135 2HG MET 135 11.062 -0.684 -0.684 400 2HG MET 135 1HG MET 135 12.512 -1.462 -1.462 401 1HE MET 135 2HE MET 135 12.808 1.270 1.270 402 2HE MET 135 1HE MET 135 13.997 0.451 0.451 403 3HE MET 135 3HE MET 135 13.429 2.108 2.108 404 H ALA 136 H ALA 136 7.975 -4.037 -4.037 405 HA ALA 136 HA ALA 136 7.183 -2.981 -2.981 406 1HB ALA 136 3HB ALA 136 7.548 -0.885 -0.885 407 2HB ALA 136 2HB ALA 136 6.365 -0.705 -0.705 408 3HB ALA 136 1HB ALA 136 8.114 -0.740 -0.740 409 H HIS 137 H HIS 137 5.297 -4.134 -4.134 410 HA HIS 137 HA HIS 137 3.816 -3.918 -3.918 411 1HB HIS 137 2HB HIS 137 3.524 -6.326 -6.326 412 2HB HIS 137 1HB HIS 137 2.745 -5.972 -5.972 413 HD1 HIS 137 1HD HIS 137 3.612 -8.167 -8.167 414 HD2 HIS 137 2HD HIS 137 6.670 -5.606 -5.606 415 HE1 HIS 137 1HE HIS 137 5.821 -9.091 -9.091 416 H GLN 138 H GLN 138 1.432 -3.932 -3.932 417 HA GLN 138 HA GLN 138 0.579 -3.125 -3.125 418 1HB GLN 138 2HB GLN 138 -0.890 -2.915 -2.915 419 2HB GLN 138 1HB GLN 138 -1.597 -2.511 -2.511 420 1HG GLN 138 2HG GLN 138 0.182 -0.787 -0.787 421 2HG GLN 138 1HG GLN 138 0.870 -1.140 -1.140 422 1HE2 GLN 138 1HE2 GLN 138 0.297 0.339 0.339 423 2HE2 GLN 138 2HE2 GLN 138 -1.241 1.123 1.123 424 H GLN 139 H GLN 139 1.409 -5.859 -5.859 425 HA GLN 139 HA GLN 139 -0.998 -7.296 -7.296 426 1HB GLN 139 2HB GLN 139 1.718 -8.517 -8.517 427 2HB GLN 139 1HB GLN 139 0.148 -9.332 -9.332 428 1HG GLN 139 2HG GLN 139 -0.603 -7.763 -7.763 429 2HG GLN 139 1HG GLN 139 1.140 -7.229 -7.229 430 1HE2 GLN 139 1HE2 GLN 139 2.019 -8.124 -8.124 431 2HE2 GLN 139 2HE2 GLN 139 1.967 -9.801 -9.801 432 H ILE 140 H ILE 140 2.567 -6.846 -6.846 433 HA ILE 140 HA ILE 140 3.105 -8.143 -8.143 434 HB ILE 140 HB ILE 140 4.413 -5.998 -5.998 435 1HG1 ILE 140 2HG1 ILE 140 4.782 -9.046 -9.046 436 2HG1 ILE 140 1HG1 ILE 140 4.043 -8.272 -8.272 437 1HG2 ILE 140 3HG2 ILE 140 5.056 -7.740 -7.740 438 2HG2 ILE 140 2HG2 ILE 140 6.347 -6.903 -6.903 439 3HG2 ILE 140 1HG2 ILE 140 5.134 -5.937 -5.937 440 1HD1 ILE 140 3HD1 ILE 140 6.206 -6.926 -6.926 441 2HD1 ILE 140 2HD1 ILE 140 6.948 -8.022 -8.022 442 3HD1 ILE 140 1HD1 ILE 140 6.325 -8.703 -8.703 443 H GLY 141 H GLY 141 2.090 -4.810 -4.810 444 1HA GLY 141 2HA GLY 141 2.249 -4.245 -4.245 445 2HA GLY 141 1HA GLY 141 1.478 -3.226 -3.226 446 H MET 142 H MET 142 -0.649 -4.780 -4.780 447 HA MET 142 HA MET 142 -2.087 -4.053 -4.053 448 1HB MET 142 2HB MET 142 -3.794 -3.558 -3.558 449 2HB MET 142 1HB MET 142 -2.394 -3.456 -3.456 450 1HG MET 142 2HG MET 142 -2.963 -5.893 -5.893 451 2HG MET 142 1HG MET 142 -4.317 -5.709 -5.709 452 1HE MET 142 2HE MET 142 -5.767 -6.633 -6.633 453 2HE MET 142 1HE MET 142 -5.913 -5.904 -5.904 454 3HE MET 142 3HE MET 142 -4.356 -6.633 -6.633 455 H GLU 143 H GLU 143 -0.856 -7.185 -7.185 456 HA GLU 143 HA GLU 143 -3.001 -8.212 -8.212 457 1HB GLU 143 2HB GLU 143 -0.864 -9.636 -9.636 458 2HB GLU 143 1HB GLU 143 -0.200 -9.228 -9.228 459 1HG GLU 143 2HG GLU 143 -1.231 -11.200 -11.200 460 2HG GLU 143 1HG GLU 143 -2.595 -10.136 -10.136 461 H VAL 144 H VAL 144 0.175 -6.892 -6.892 462 HA VAL 144 HA VAL 144 -0.203 -7.551 -7.551 463 HB VAL 144 HB VAL 144 1.735 -5.600 -5.600 464 1HG1 VAL 144 1HG1 VAL 144 1.393 -7.167 -7.167 465 2HG1 VAL 144 3HG1 VAL 144 2.977 -6.522 -6.522 466 3HG1 VAL 144 2HG1 VAL 144 1.623 -5.386 -5.386 467 1HG2 VAL 144 1HG2 VAL 144 1.212 -8.588 -8.588 468 2HG2 VAL 144 3HG2 VAL 144 1.747 -7.727 -7.727 469 3HG2 VAL 144 2HG2 VAL 144 2.932 -7.996 -7.996 470 H LEU 145 H LEU 145 -0.093 -4.467 -4.467 471 HA LEU 145 HA LEU 145 -0.781 -2.757 -2.757 472 1HB LEU 145 2HB LEU 145 -1.305 -2.931 -2.931 473 2HB LEU 145 1HB LEU 145 -1.715 -1.457 -1.457 474 HG LEU 145 HG LEU 145 1.036 -2.704 -2.704 475 1HD1 LEU 145 3HD1 LEU 145 -0.362 -0.057 -0.057 476 2HD1 LEU 145 2HD1 LEU 145 1.384 -0.393 -0.393 477 3HD1 LEU 145 1HD1 LEU 145 0.115 -1.417 -1.417 478 1HD2 LEU 145 2HD2 LEU 145 0.193 -0.520 -0.520 479 2HD2 LEU 145 1HD2 LEU 145 1.090 -2.031 -2.031 480 3HD2 LEU 145 3HD2 LEU 145 1.919 -0.727 -0.727 481 H ASN 146 H ASN 146 -2.962 -4.095 -4.095 482 HA ASN 146 HA ASN 146 -5.449 -3.198 -3.198 483 1HB ASN 146 2HB ASN 146 -4.275 -4.309 -4.309 484 2HB ASN 146 1HB ASN 146 -5.113 -5.769 -5.769 485 1HD2 ASN 146 1HD2 ASN 146 -6.061 -6.212 -6.212 486 2HD2 ASN 146 2HD2 ASN 146 -7.122 -5.267 -5.267 487 H ARG 147 H ARG 147 -3.542 -6.233 -6.233 488 HA ARG 147 HA ARG 147 -5.793 -7.083 -7.083 489 1HB ARG 147 2HB ARG 147 -4.501 -8.669 -8.669 490 2HB ARG 147 1HB ARG 147 -2.961 -7.904 -7.904 491 1HG ARG 147 2HG ARG 147 -2.983 -9.038 -9.038 492 2HG ARG 147 1HG ARG 147 -4.815 -8.960 -8.960 493 1HD ARG 147 2HD ARG 147 -3.996 -11.345 -11.345 494 2HD ARG 147 1HD ARG 147 -4.812 -10.854 -10.854 495 HE ARG 147 HE ARG 147 -2.047 -10.155 -10.155 496 1HH1 ARG 147 1HH2 ARG 147 -4.090 -13.047 -13.047 497 2HH1 ARG 147 2HH2 ARG 147 -2.950 -14.135 -14.135 498 1HH2 ARG 147 1HH1 ARG 147 -0.502 -11.639 -11.639 499 2HH2 ARG 147 2HH1 ARG 147 -0.884 -13.323 -13.323 500 H VAL 148 H VAL 148 -3.157 -4.695 -4.695 501 HA VAL 148 HA VAL 148 -3.101 -5.174 -5.174 502 HB VAL 148 HB VAL 148 -2.609 -2.531 -2.531 503 1HG1 VAL 148 1HG1 VAL 148 -2.643 -3.389 -3.389 504 2HG1 VAL 148 3HG1 VAL 148 -1.148 -4.288 -4.288 505 3HG1 VAL 148 2HG1 VAL 148 -1.164 -2.468 -2.468 506 1HG2 VAL 148 3HG2 VAL 148 -0.662 -4.851 -4.851 507 2HG2 VAL 148 2HG2 VAL 148 -1.404 -3.967 -3.967 508 3HG2 VAL 148 1HG2 VAL 148 -0.281 -3.105 -3.105 509 H LYS 149 H LYS 149 -4.855 -2.795 -2.795 510 HA LYS 149 HA LYS 149 -6.363 -1.446 -1.446 511 1HB LYS 149 2HB LYS 149 -6.254 -1.328 -1.328 512 2HB LYS 149 1HB LYS 149 -7.193 -2.854 -2.854 513 1HG LYS 149 2HG LYS 149 -9.096 -2.067 -2.067 514 2HG LYS 149 1HG LYS 149 -8.474 -0.460 -0.460 515 1HD LYS 149 2HD LYS 149 -8.408 -1.382 -1.382 516 2HD LYS 149 1HD LYS 149 -9.972 -0.671 -0.671 517 1HE LYS 149 2HE LYS 149 -8.628 1.504 1.504 518 2HE LYS 149 1HE LYS 149 -7.406 0.626 0.626 519 1HZ LYS 149 2HZ LYS 149 -9.101 0.265 0.265 520 2HZ LYS 149 1HZ LYS 149 -10.267 1.050 1.050 521 3HZ LYS 149 3HZ LYS 149 -8.943 1.921 1.921 522 H ASP 150 H ASP 150 -7.053 -4.689 -4.689 523 HA ASP 150 HA ASP 150 -9.674 -4.741 -4.741 524 1HB ASP 150 2HB ASP 150 -7.685 -6.531 -6.531 525 2HB ASP 150 1HB ASP 150 -9.105 -7.229 -7.229 526 H ASP 151 H ASP 151 -6.566 -6.284 -6.284 527 HA ASP 151 HA ASP 151 -8.277 -7.353 -7.353 528 1HB ASP 151 2HB ASP 151 -6.101 -8.360 -8.360 529 2HB ASP 151 1HB ASP 151 -5.255 -7.058 -7.058 530 H LEU 152 H LEU 152 -6.654 -4.133 -4.133 531 HA LEU 152 HA LEU 152 -6.766 -3.732 -3.732 532 1HB LEU 152 2HB LEU 152 -6.127 -2.355 -2.355 533 2HB LEU 152 1HB LEU 152 -7.002 -1.356 -1.356 534 HG LEU 152 HG LEU 152 -4.652 -3.079 -3.079 535 1HD1 LEU 152 2HD1 LEU 152 -4.117 -1.943 -1.943 536 2HD1 LEU 152 1HD1 LEU 152 -4.404 -0.342 -0.342 537 3HD1 LEU 152 3HD1 LEU 152 -3.044 -1.410 -1.410 538 1HD2 LEU 152 3HD2 LEU 152 -5.843 -0.415 -0.415 539 2HD2 LEU 152 2HD2 LEU 152 -5.893 -2.015 -2.015 540 3HD2 LEU 152 1HD2 LEU 152 -4.322 -1.149 -1.149 541 H GLN 153 H GLN 153 -8.824 -3.101 -3.101 542 HA GLN 153 HA GLN 153 -10.210 -1.281 -1.281 543 1HB GLN 153 2HB GLN 153 -10.333 -3.672 -3.672 544 2HB GLN 153 1HB GLN 153 -11.753 -3.843 -3.843 545 1HG GLN 153 2HG GLN 153 -12.729 -1.792 -1.792 546 2HG GLN 153 1HG GLN 153 -11.076 -1.628 -1.628 547 1HE2 GLN 153 1HE2 GLN 153 -13.186 -4.535 -4.535 548 2HE2 GLN 153 2HE2 GLN 153 -13.207 -5.091 -5.091 549 H GLU 154 H GLU 154 -10.604 -3.272 -3.272 550 HA GLU 154 HA GLU 154 -13.047 -2.496 -2.496 551 1HB GLU 154 2HB GLU 154 -10.623 -2.892 -2.892 552 2HB GLU 154 1HB GLU 154 -12.275 -3.511 -3.511 553 1HG GLU 154 2HG GLU 154 -11.731 -5.127 -5.127 554 2HG GLU 154 1HG GLU 154 -10.064 -4.402 -4.402 555 H LEU 155 H LEU 155 -9.806 -1.388 -1.388 556 HA LEU 155 HA LEU 155 -10.469 0.786 0.786 557 1HB LEU 155 2HB LEU 155 -8.061 -0.813 -0.813 558 2HB LEU 155 1HB LEU 155 -7.727 0.933 0.933 559 HG LEU 155 HG LEU 155 -7.054 -0.334 -0.334 560 1HD1 LEU 155 2HD1 LEU 155 -7.570 1.923 1.923 561 2HD1 LEU 155 1HD1 LEU 155 -9.278 1.507 1.507 562 3HD1 LEU 155 3HD1 LEU 155 -7.846 0.846 0.846 563 1HD2 LEU 155 3HD2 LEU 155 -8.634 -2.233 -2.233 564 2HD2 LEU 155 2HD2 LEU 155 -8.573 -1.473 -1.473 565 3HD2 LEU 155 1HD2 LEU 155 -9.981 -1.155 -1.155 566 H ALA 156 H ALA 156 -8.682 0.057 0.057 567 HA ALA 156 HA ALA 156 -8.192 2.985 2.985 568 1HB ALA 156 1HB ALA 156 -6.134 1.555 1.555 569 2HB ALA 156 3HB ALA 156 -6.718 0.640 0.640 570 3HB ALA 156 2HB ALA 156 -6.324 2.384 2.384 571 H VAL 157 H VAL 157 -8.910 3.896 3.896 572 HA VAL 157 HA VAL 157 -8.283 1.680 1.680 573 HB VAL 157 HB VAL 157 -9.644 2.760 2.760 574 1HG1 VAL 157 3HG1 VAL 157 -11.145 2.480 2.480 575 2HG1 VAL 157 2HG1 VAL 157 -11.943 2.605 2.605 576 3HG1 VAL 157 1HG1 VAL 157 -10.860 1.182 1.182 577 1HG2 VAL 157 2HG2 VAL 157 -9.197 5.230 5.230 578 2HG2 VAL 157 1HG2 VAL 157 -10.868 4.843 4.843 579 3HG2 VAL 157 3HG2 VAL 157 -10.438 4.857 4.857 580 H VAL 158 H VAL 158 -7.925 2.265 2.265 581 HA VAL 158 HA VAL 158 -5.553 3.876 3.876 582 HB VAL 158 HB VAL 158 -7.017 2.712 2.712 583 1HG1 VAL 158 1HG1 VAL 158 -4.963 4.095 4.095 584 2HG1 VAL 158 3HG1 VAL 158 -4.056 2.881 2.881 585 3HG1 VAL 158 2HG1 VAL 158 -4.866 2.378 2.378 586 1HG2 VAL 158 2HG2 VAL 158 -5.092 1.152 1.152 587 2HG2 VAL 158 1HG2 VAL 158 -6.849 0.814 0.814 588 3HG2 VAL 158 3HG2 VAL 158 -5.734 0.541 0.541 589 H GLU 159 H GLU 159 -5.447 5.714 5.714 590 HA GLU 159 HA GLU 159 -7.783 7.329 7.329 591 1HB GLU 159 2HB GLU 159 -5.507 8.087 8.087 592 2HB GLU 159 1HB GLU 159 -5.016 7.659 7.659 593 1HG GLU 159 2HG GLU 159 -6.496 9.545 9.545 594 2HG GLU 159 1HG GLU 159 -7.070 9.843 9.843 595 H SER 160 H SER 160 -5.653 5.610 5.610 596 HA SER 160 HA SER 160 -7.516 5.867 5.867 597 1HB SER 160 2HB SER 160 -5.892 7.878 7.878 598 2HB SER 160 1HB SER 160 -4.706 6.610 6.610 599 HG SER 160 HG SER 160 -6.164 6.181 6.181 600 H PHE 161 H PHE 161 -7.013 4.213 4.213 601 HA PHE 161 HA PHE 161 -4.702 2.547 2.547 602 1HB PHE 161 2HB PHE 161 -7.102 1.515 1.515 603 2HB PHE 161 1HB PHE 161 -6.756 1.448 1.448 604 HD1 PHE 161 1HD PHE 161 -4.732 0.422 0.422 605 HD2 PHE 161 2HD PHE 161 -6.094 0.044 0.044 606 HE1 PHE 161 1HE PHE 161 -2.977 -1.251 -1.251 607 HE2 PHE 161 2HE PHE 161 -4.497 -1.424 -1.424 608 HZ PHE 161 HZ PHE 161 -2.955 -2.341 -2.341 609 HA PRO 162 HA PRO 162 -4.605 5.596 5.596 610 1HB PRO 162 2HB PRO 162 -2.018 6.669 6.669 611 2HB PRO 162 1HB PRO 162 -3.406 6.849 6.849 612 1HG PRO 162 2HG PRO 162 -0.992 5.193 5.193 613 2HG PRO 162 1HG PRO 162 -2.303 5.630 5.630 614 1HD PRO 162 2HD PRO 162 -1.948 3.124 3.124 615 2HD PRO 162 1HD PRO 162 -3.019 3.422 3.422 616 H THR 163 H THR 163 -0.950 4.699 4.699 617 HA THR 163 HA THR 163 -1.542 6.125 6.125 618 HB THR 163 HB THR 163 1.206 5.179 5.179 619 HG1 THR 163 1HG THR 163 -0.466 6.164 6.164 620 1HG2 THR 163 3HG2 THR 163 -0.393 7.796 7.796 621 2HG2 THR 163 2HG2 THR 163 1.411 7.675 7.675 622 3HG2 THR 163 1HG2 THR 163 0.539 7.428 7.428 623 H LYS 164 H LYS 164 0.615 5.597 5.597 624 HA LYS 164 HA LYS 164 0.727 3.167 3.167 625 1HB LYS 164 2HB LYS 164 -0.182 4.976 4.976 626 2HB LYS 164 1HB LYS 164 1.223 6.009 6.009 627 1HG LYS 164 2HG LYS 164 2.783 4.332 4.332 628 2HG LYS 164 1HG LYS 164 1.381 3.258 3.258 629 1HD LYS 164 2HD LYS 164 0.432 5.004 5.004 630 2HD LYS 164 1HD LYS 164 1.783 6.117 6.117 631 1HE LYS 164 2HE LYS 164 2.205 5.042 5.042 632 2HE LYS 164 1HE LYS 164 3.431 4.475 4.475 633 1HZ LYS 164 1HZ LYS 164 2.112 2.490 2.490 634 2HZ LYS 164 3HZ LYS 164 0.968 3.024 3.024 635 3HZ LYS 164 2HZ LYS 164 2.557 2.683 2.683 636 H ILE 165 H ILE 165 2.784 2.324 2.324 637 HA ILE 165 HA ILE 165 4.262 3.709 3.709 638 HB ILE 165 HB ILE 165 5.231 1.349 1.349 639 1HG1 ILE 165 2HG1 ILE 165 3.129 1.263 1.263 640 2HG1 ILE 165 1HG1 ILE 165 2.753 0.926 0.926 641 1HG2 ILE 165 2HG2 ILE 165 5.486 2.411 2.411 642 2HG2 ILE 165 1HG2 ILE 165 6.087 0.775 0.775 643 3HG2 ILE 165 3HG2 ILE 165 6.800 2.223 2.223 644 1HD1 ILE 165 2HD1 ILE 165 4.756 -0.749 -0.749 645 2HD1 ILE 165 1HD1 ILE 165 2.993 -1.082 -1.082 646 3HD1 ILE 165 3HD1 ILE 165 4.005 -1.097 -1.097 647 H GLU 166 H GLU 166 6.019 4.670 4.670 648 HA GLU 166 HA GLU 166 7.462 5.033 5.033 649 1HB GLU 166 2HB GLU 166 6.988 7.142 7.142 650 2HB GLU 166 1HB GLU 166 8.433 7.136 7.136 651 1HG GLU 166 2HG GLU 166 6.952 8.583 8.583 652 2HG GLU 166 1HG GLU 166 6.864 7.053 7.053 653 H GLY 167 H GLY 167 9.535 4.250 4.250 654 1HA GLY 167 2HA GLY 167 11.395 3.477 3.477 655 2HA GLY 167 1HA GLY 167 10.799 4.143 4.143 656 H ARG 168 H ARG 168 11.533 2.223 2.223 657 HA ARG 168 HA ARG 168 9.943 -0.116 -0.116 658 1HB ARG 168 2HB ARG 168 11.710 -1.416 -1.416 659 2HB ARG 168 1HB ARG 168 12.250 -0.681 -0.681 660 1HG ARG 168 2HG ARG 168 13.325 1.206 1.206 661 2HG ARG 168 1HG ARG 168 12.862 0.465 0.465 662 1HD ARG 168 2HD ARG 168 14.218 -1.569 -1.569 663 2HD ARG 168 1HD ARG 168 14.641 -0.849 -0.849 664 HE ARG 168 HE ARG 168 15.300 1.022 1.022 665 1HH1 ARG 168 1HH2 ARG 168 16.275 -2.089 -2.089 666 2HH1 ARG 168 2HH2 ARG 168 17.950 -1.923 -1.923 667 1HH2 ARG 168 1HH1 ARG 168 17.579 1.243 1.243 668 2HH2 ARG 168 2HH1 ARG 168 18.702 -0.002 -0.002 669 H GLN 169 H GLN 169 8.611 1.900 1.900 670 HA GLN 169 HA GLN 169 8.137 0.711 0.711 671 1HB GLN 169 2HB GLN 169 9.490 3.340 3.340 672 2HB GLN 169 1HB GLN 169 8.370 3.121 3.121 673 1HG GLN 169 2HG GLN 169 9.911 1.464 1.464 674 2HG GLN 169 1HG GLN 169 11.022 1.590 1.590 675 1HE2 GLN 169 1HE2 GLN 169 9.322 3.631 3.631 676 2HE2 GLN 169 2HE2 GLN 169 10.567 4.816 4.816 677 H MET 170 H MET 170 6.034 1.320 1.320 678 HA MET 170 HA MET 170 4.877 3.614 3.614 679 1HB MET 170 2HB MET 170 4.084 1.526 1.526 680 2HB MET 170 1HB MET 170 3.455 0.886 0.886 681 1HG MET 170 2HG MET 170 1.852 2.704 2.704 682 2HG MET 170 1HG MET 170 2.596 3.462 3.462 683 1HE MET 170 3HE MET 170 1.566 -0.328 -0.328 684 2HE MET 170 2HE MET 170 0.219 0.632 0.632 685 3HE MET 170 1HE MET 170 -0.074 -0.381 -0.381 686 H ILE 171 H ILE 171 4.245 5.047 5.047 687 HA ILE 171 HA ILE 171 3.632 4.110 4.110 688 HB ILE 171 HB ILE 171 3.132 6.711 6.711 689 1HG1 ILE 171 2HG1 ILE 171 5.528 5.922 5.922 690 2HG1 ILE 171 1HG1 ILE 171 5.040 7.603 7.603 691 1HG2 ILE 171 2HG2 ILE 171 2.500 5.973 5.973 692 2HG2 ILE 171 1HG2 ILE 171 2.802 7.688 7.688 693 3HG2 ILE 171 3HG2 ILE 171 1.408 6.816 6.816 694 1HD1 ILE 171 2HD1 ILE 171 4.831 5.116 5.116 695 2HD1 ILE 171 1HD1 ILE 171 6.209 6.283 6.283 696 3HD1 ILE 171 3HD1 ILE 171 4.522 6.772 6.772 697 H MET 172 H MET 172 1.720 3.545 3.545 698 HA MET 172 HA MET 172 -0.866 4.357 4.357 699 1HB MET 172 2HB MET 172 -0.799 1.927 1.927 700 2HB MET 172 1HB MET 172 0.154 1.770 1.770 701 1HG MET 172 2HG MET 172 -1.754 2.311 2.311 702 2HG MET 172 1HG MET 172 -2.647 2.944 2.944 703 1HE MET 172 1HE MET 172 -2.881 0.990 0.990 704 2HE MET 172 3HE MET 172 -3.616 -0.561 -0.561 705 3HE MET 172 2HE MET 172 -1.819 -0.409 -0.409 706 H VAL 173 H VAL 173 -2.024 5.624 5.624 707 HA VAL 173 HA VAL 173 -0.451 6.231 6.231 708 HB VAL 173 HB VAL 173 -2.907 7.663 7.663 709 1HG1 VAL 173 3HG1 VAL 173 -0.922 7.908 7.908 710 2HG1 VAL 173 2HG1 VAL 173 -0.317 9.035 9.035 711 3HG1 VAL 173 1HG1 VAL 173 -1.968 9.301 9.301 712 1HG2 VAL 173 1HG2 VAL 173 -0.127 7.842 7.842 713 2HG2 VAL 173 3HG2 VAL 173 -1.694 7.441 7.441 714 3HG2 VAL 173 2HG2 VAL 173 -1.407 9.088 9.088 715 H LEU 174 H LEU 174 -1.645 6.083 6.083 716 HA LEU 174 HA LEU 174 -4.026 4.421 4.421 717 1HB LEU 174 2HB LEU 174 -1.528 3.538 3.538 718 2HB LEU 174 1HB LEU 174 -1.621 3.796 3.796 719 HG LEU 174 HG LEU 174 -2.150 1.507 1.507 720 1HD1 LEU 174 1HD1 LEU 174 -1.954 2.026 2.026 721 2HD1 LEU 174 3HD1 LEU 174 -3.754 1.775 1.775 722 3HD1 LEU 174 2HD1 LEU 174 -2.609 0.491 0.491 723 1HD2 LEU 174 2HD2 LEU 174 -4.168 2.500 2.500 724 2HD2 LEU 174 1HD2 LEU 174 -4.586 1.046 1.046 725 3HD2 LEU 174 3HD2 LEU 174 -4.763 2.735 2.735 726 H ALA 175 H ALA 175 -5.288 6.368 6.368 727 HA ALA 175 HA ALA 175 -4.847 7.289 7.289 728 1HB ALA 175 3HB ALA 175 -5.468 8.710 8.710 729 2HB ALA 175 2HB ALA 175 -7.043 7.743 7.743 730 3HB ALA 175 1HB ALA 175 -6.686 8.977 8.977 731 HA PRO 176 HA PRO 176 -8.078 5.664 5.664 732 1HB PRO 176 2HB PRO 176 -9.222 8.450 8.450 733 2HB PRO 176 1HB PRO 176 -8.935 7.131 7.131 734 1HG PRO 176 2HG PRO 176 -7.145 9.188 9.188 735 2HG PRO 176 1HG PRO 176 -6.538 7.482 7.482 736 1HD PRO 176 2HD PRO 176 -6.770 9.227 9.227 737 2HD PRO 176 1HD PRO 176 -5.481 8.035 8.035 738 H LYS 177 H LYS 177 -10.058 4.704 4.704 739 HA LYS 177 HA LYS 177 -11.634 5.660 5.660 740 1HB LYS 177 2HB LYS 177 -11.344 3.175 3.175 741 2HB LYS 177 1HB LYS 177 -12.284 3.529 3.529 742 1HG LYS 177 2HG LYS 177 -14.282 4.144 4.144 743 2HG LYS 177 1HG LYS 177 -13.279 3.895 3.895 744 1HD LYS 177 2HD LYS 177 -14.786 1.986 1.986 745 2HD LYS 177 1HD LYS 177 -13.057 1.493 1.493 746 1HE LYS 177 2HE LYS 177 -14.445 0.421 0.421 747 2HE LYS 177 1HE LYS 177 -13.152 1.477 1.477 748 1HZ LYS 177 1HZ LYS 177 -16.015 2.210 2.210 749 2HZ LYS 177 3HZ LYS 177 -15.268 1.799 1.799 750 3HZ LYS 177 2HZ LYS 177 -14.808 3.214 3.214 751 H LYS 178 H LYS 178 -13.379 6.922 6.922 752 HA LYS 178 HA LYS 178 -14.180 7.873 7.873 753 1HB LYS 178 2HB LYS 178 -14.841 8.671 8.671 754 2HB LYS 178 1HB LYS 178 -15.815 9.276 9.276 755 1HG LYS 178 2HG LYS 178 -13.756 10.218 10.218 756 2HG LYS 178 1HG LYS 178 -12.782 9.675 9.675 757 1HD LYS 178 2HD LYS 178 -14.054 11.183 11.183 758 2HD LYS 178 1HD LYS 178 -15.188 11.602 11.602 759 1HE LYS 178 2HE LYS 178 -13.516 13.428 13.428 760 2HE LYS 178 1HE LYS 178 -13.317 12.683 12.683 761 1HZ LYS 178 1HZ LYS 178 -11.707 12.049 12.049 762 2HZ LYS 178 3HZ LYS 178 -11.229 13.020 13.020 763 3HZ LYS 178 2HZ LYS 178 -11.520 11.363 11.363 764 H LYS 179 H LYS 179 -15.359 6.312 6.312 765 HA LYS 179 HA LYS 179 -17.424 4.909 4.909 766 1HB LYS 179 2HB LYS 179 -16.240 3.935 3.935 767 2HB LYS 179 1HB LYS 179 -16.906 5.275 5.275 768 1HG LYS 179 2HG LYS 179 -18.167 3.221 3.221 769 2HG LYS 179 1HG LYS 179 -19.240 4.416 4.416 770 1HD LYS 179 2HD LYS 179 -18.871 3.245 3.245 771 2HD LYS 179 1HD LYS 179 -17.811 2.053 2.053 772 1HE LYS 179 2HE LYS 179 -19.758 1.325 1.325 773 2HE LYS 179 1HE LYS 179 -20.812 2.542 2.542 774 1HZ LYS 179 2HZ LYS 179 -20.352 1.423 1.423 775 2HZ LYS 179 1HZ LYS 179 -19.380 0.276 0.276 776 3HZ LYS 179 3HZ LYS 179 -21.042 0.363 0.363 777 H GLN 180 H GLN 180 -19.385 5.709 5.709 778 HA GLN 180 HA GLN 180 -21.088 7.019 7.019 779 1HB GLN 180 2HB GLN 180 -21.490 6.121 6.121 780 2HB GLN 180 1HB GLN 180 -20.756 7.618 7.618 781 1HG GLN 180 2HG GLN 180 -22.567 8.979 8.979 782 2HG GLN 180 1HG GLN 180 -23.278 7.447 7.447 783 1HE2 GLN 180 1HE2 GLN 180 -23.299 9.687 9.687 784 2HE2 GLN 180 2HE2 GLN 180 -24.086 8.737 8.737 Start of MODEL 18 1 HA VAL 90 HA VAL 90 -3.453 17.448 17.448 2 HB VAL 90 HB VAL 90 -2.037 17.610 17.610 3 1HG1 VAL 90 1HG1 VAL 90 -2.290 19.944 19.944 4 2HG1 VAL 90 3HG1 VAL 90 -2.033 20.017 20.017 5 3HG1 VAL 90 2HG1 VAL 90 -3.517 19.222 19.222 6 1HG2 VAL 90 2HG2 VAL 90 0.143 18.437 18.437 7 2HG2 VAL 90 1HG2 VAL 90 0.127 16.987 16.987 8 3HG2 VAL 90 3HG2 VAL 90 0.172 18.640 18.640 9 H ILE 91 H ILE 91 -2.831 16.091 16.091 10 HA ILE 91 HA ILE 91 -2.371 13.370 13.370 11 HB ILE 91 HB ILE 91 -3.480 14.445 14.445 12 1HG1 ILE 91 2HG1 ILE 91 -5.057 14.931 14.931 13 2HG1 ILE 91 1HG1 ILE 91 -5.662 13.516 13.516 14 1HG2 ILE 91 1HG2 ILE 91 -3.232 11.560 11.560 15 2HG2 ILE 91 3HG2 ILE 91 -4.225 12.045 12.045 16 3HG2 ILE 91 2HG2 ILE 91 -2.446 12.240 12.240 17 1HD1 ILE 91 3HD1 ILE 91 -4.712 11.987 11.987 18 2HD1 ILE 91 2HD1 ILE 91 -4.207 13.438 13.438 19 3HD1 ILE 91 1HD1 ILE 91 -5.960 13.127 13.127 20 H GLN 92 H GLN 92 -0.518 12.219 12.219 21 HA GLN 92 HA GLN 92 1.507 13.791 13.791 22 1HB GLN 92 2HB GLN 92 1.744 11.070 11.070 23 2HB GLN 92 1HB GLN 92 3.078 12.244 12.244 24 1HG GLN 92 2HG GLN 92 0.728 12.532 12.532 25 2HG GLN 92 1HG GLN 92 2.415 12.091 12.091 26 1HE2 GLN 92 1HE2 GLN 92 0.156 14.575 14.575 27 2HE2 GLN 92 2HE2 GLN 92 1.215 15.947 15.947 28 H VAL 93 H VAL 93 3.019 12.463 12.463 29 HA VAL 93 HA VAL 93 1.557 10.164 10.164 30 HB VAL 93 HB VAL 93 4.036 11.526 11.526 31 1HG1 VAL 93 2HG1 VAL 93 2.383 8.960 8.960 32 2HG1 VAL 93 1HG1 VAL 93 3.443 9.669 9.669 33 3HG1 VAL 93 3HG1 VAL 93 4.206 8.998 8.998 34 1HG2 VAL 93 3HG2 VAL 93 1.506 12.361 12.361 35 2HG2 VAL 93 2HG2 VAL 93 2.587 11.956 11.956 36 3HG2 VAL 93 1HG2 VAL 93 1.452 10.709 10.709 37 H LYS 94 H LYS 94 1.985 8.387 8.387 38 HA LYS 94 HA LYS 94 4.936 8.007 8.007 39 1HB LYS 94 2HB LYS 94 2.902 6.079 6.079 40 2HB LYS 94 1HB LYS 94 4.617 6.242 6.242 41 1HG LYS 94 2HG LYS 94 2.431 8.338 8.338 42 2HG LYS 94 1HG LYS 94 2.954 7.079 7.079 43 1HD LYS 94 2HD LYS 94 5.319 7.991 7.991 44 2HD LYS 94 1HD LYS 94 4.705 9.352 9.352 45 1HE LYS 94 2HE LYS 94 4.859 10.095 10.095 46 2HE LYS 94 1HE LYS 94 3.104 9.946 9.946 47 1HZ LYS 94 2HZ LYS 94 3.088 7.790 7.790 48 2HZ LYS 94 1HZ LYS 94 4.731 7.935 7.935 49 3HZ LYS 94 3HZ LYS 94 3.592 9.001 9.001 50 H GLU 95 H GLU 95 5.507 5.594 5.594 51 HA GLU 95 HA GLU 95 4.101 4.999 4.999 52 1HB GLU 95 2HB GLU 95 6.195 6.489 6.489 53 2HB GLU 95 1HB GLU 95 7.039 4.986 4.986 54 1HG GLU 95 2HG GLU 95 6.427 3.863 3.863 55 2HG GLU 95 1HG GLU 95 5.544 5.357 5.357 56 H ILE 96 H ILE 96 4.476 2.742 2.742 57 HA ILE 96 HA ILE 96 5.981 0.976 0.976 58 HB ILE 96 HB ILE 96 3.154 1.317 1.317 59 1HG1 ILE 96 2HG1 ILE 96 4.519 0.445 0.445 60 2HG1 ILE 96 1HG1 ILE 96 2.941 -0.334 -0.334 61 1HG2 ILE 96 3HG2 ILE 96 3.039 0.446 0.446 62 2HG2 ILE 96 2HG2 ILE 96 3.819 -1.163 -1.163 63 3HG2 ILE 96 1HG2 ILE 96 2.251 -0.701 -0.701 64 1HD1 ILE 96 2HD1 ILE 96 4.082 -2.307 -2.307 65 2HD1 ILE 96 1HD1 ILE 96 5.686 -1.551 -1.551 66 3HD1 ILE 96 3HD1 ILE 96 4.574 -2.018 -2.018 67 H LYS 97 H LYS 97 6.690 -0.919 -0.919 68 HA LYS 97 HA LYS 97 6.078 -0.287 -0.287 69 1HB LYS 97 2HB LYS 97 8.565 -1.791 -1.791 70 2HB LYS 97 1HB LYS 97 7.967 -1.426 -1.426 71 1HG LYS 97 2HG LYS 97 8.181 1.041 1.041 72 2HG LYS 97 1HG LYS 97 8.954 0.640 0.640 73 1HD LYS 97 2HD LYS 97 10.004 -0.141 -0.141 74 2HD LYS 97 1HD LYS 97 10.609 1.216 1.216 75 1HE LYS 97 2HE LYS 97 11.323 -0.437 -0.437 76 2HE LYS 97 1HE LYS 97 10.791 -1.796 -1.796 77 1HZ LYS 97 3HZ LYS 97 12.329 -0.993 -0.993 78 2HZ LYS 97 2HZ LYS 97 12.846 0.252 0.252 79 3HZ LYS 97 1HZ LYS 97 13.118 -1.371 -1.371 80 H PHE 98 H PHE 98 5.841 -2.112 -2.112 81 HA PHE 98 HA PHE 98 5.615 -4.710 -4.710 82 1HB PHE 98 2HB PHE 98 3.457 -3.293 -3.293 83 2HB PHE 98 1HB PHE 98 3.562 -5.067 -5.067 84 HD1 PHE 98 1HD PHE 98 3.902 -5.868 -5.868 85 HD2 PHE 98 2HD PHE 98 1.821 -2.613 -2.613 86 HE1 PHE 98 1HE PHE 98 2.626 -5.742 -5.742 87 HE2 PHE 98 2HE PHE 98 0.422 -2.476 -2.476 88 HZ PHE 98 HZ PHE 98 0.738 -4.188 -4.188 89 H ARG 99 H ARG 99 7.676 -5.102 -5.102 90 HA ARG 99 HA ARG 99 7.830 -4.572 -4.572 91 1HB ARG 99 2HB ARG 99 10.138 -5.368 -5.368 92 2HB ARG 99 1HB ARG 99 9.631 -4.360 -4.360 93 1HG ARG 99 2HG ARG 99 9.209 -6.417 -6.417 94 2HG ARG 99 1HG ARG 99 9.752 -7.437 -7.437 95 1HD ARG 99 2HD ARG 99 11.597 -7.263 -7.263 96 2HD ARG 99 1HD ARG 99 12.016 -6.209 -6.209 97 HE ARG 99 HE ARG 99 10.670 -4.574 -4.574 98 1HH1 ARG 99 1HH2 ARG 99 13.618 -6.557 -6.557 99 2HH1 ARG 99 2HH2 ARG 99 14.525 -5.656 -5.656 100 1HH2 ARG 99 1HH1 ARG 99 11.916 -3.348 -3.348 101 2HH2 ARG 99 2HH1 ARG 99 13.545 -3.810 -3.810 102 HA PRO 100 HA PRO 100 6.461 -8.515 -8.515 103 1HB PRO 100 2HB PRO 100 8.562 -9.482 -9.482 104 2HB PRO 100 1HB PRO 100 7.171 -8.464 -8.464 105 1HG PRO 100 2HG PRO 100 10.005 -7.666 -7.666 106 2HG PRO 100 1HG PRO 100 8.935 -6.914 -6.914 107 1HD PRO 100 2HD PRO 100 9.398 -5.782 -5.782 108 2HD PRO 100 1HD PRO 100 7.751 -5.632 -5.632 109 H GLY 101 H GLY 101 6.672 -10.768 -10.768 110 1HA GLY 101 2HA GLY 101 7.736 -12.608 -12.608 111 2HA GLY 101 1HA GLY 101 9.206 -11.581 -11.581 112 H THR 102 H THR 102 6.559 -10.081 -10.081 113 HA THR 102 HA THR 102 6.686 -10.927 -10.927 114 HB THR 102 HB THR 102 5.518 -8.239 -8.239 115 HG1 THR 102 1HG THR 102 7.478 -7.433 -7.433 116 1HG2 THR 102 1HG2 THR 102 5.135 -9.789 -9.789 117 2HG2 THR 102 3HG2 THR 102 6.780 -9.241 -9.241 118 3HG2 THR 102 2HG2 THR 102 5.475 -8.006 -8.006 119 H ASP 103 H ASP 103 5.382 -12.530 -12.530 120 HA ASP 103 HA ASP 103 2.642 -11.838 -11.838 121 1HB ASP 103 2HB ASP 103 3.949 -13.339 -13.339 122 2HB ASP 103 1HB ASP 103 3.768 -14.527 -14.527 123 H GLU 104 H GLU 104 1.890 -14.657 -14.657 124 HA GLU 104 HA GLU 104 0.527 -12.946 -12.946 125 1HB GLU 104 2HB GLU 104 -0.143 -15.237 -15.237 126 2HB GLU 104 1HB GLU 104 0.729 -15.905 -15.905 127 1HG GLU 104 2HG GLU 104 -0.863 -14.715 -14.715 128 2HG GLU 104 1HG GLU 104 -1.632 -13.906 -13.906 129 H GLY 105 H GLY 105 3.046 -15.109 -15.109 130 1HA GLY 105 2HA GLY 105 2.240 -14.057 -14.057 131 2HA GLY 105 1HA GLY 105 3.392 -15.448 -15.448 132 H ASP 106 H ASP 106 4.282 -12.987 -12.987 133 HA ASP 106 HA ASP 106 6.052 -11.724 -11.724 134 1HB ASP 106 2HB ASP 106 6.679 -12.790 -12.790 135 2HB ASP 106 1HB ASP 106 6.025 -11.338 -11.338 136 H TYR 107 H TYR 107 3.310 -11.532 -11.532 137 HA TYR 107 HA TYR 107 3.536 -8.708 -8.708 138 1HB TYR 107 2HB TYR 107 3.002 -10.426 -10.426 139 2HB TYR 107 1HB TYR 107 1.573 -10.963 -10.963 140 HD1 TYR 107 1HD TYR 107 1.709 -7.363 -7.363 141 HD2 TYR 107 2HD TYR 107 0.791 -11.005 -11.005 142 HE1 TYR 107 1HE TYR 107 -0.390 -6.379 -6.379 143 HE2 TYR 107 2HE TYR 107 -0.960 -9.826 -9.826 144 HH TYR 107 HH TYR 107 -2.029 -6.622 -6.622 145 H GLN 108 H GLN 108 0.528 -10.524 -10.524 146 HA GLN 108 HA GLN 108 -0.537 -8.487 -8.487 147 1HB GLN 108 2HB GLN 108 -1.506 -11.005 -11.005 148 2HB GLN 108 1HB GLN 108 -2.316 -9.640 -9.640 149 1HG GLN 108 2HG GLN 108 -0.689 -11.600 -11.600 150 2HG GLN 108 1HG GLN 108 -2.205 -12.042 -12.042 151 1HE2 GLN 108 1HE2 GLN 108 -1.043 -8.765 -8.765 152 2HE2 GLN 108 2HE2 GLN 108 -2.272 -8.551 -8.551 153 H VAL 109 H VAL 109 1.938 -10.162 -10.162 154 HA VAL 109 HA VAL 109 1.520 -9.444 -9.444 155 HB VAL 109 HB VAL 109 4.103 -9.745 -9.745 156 1HG1 VAL 109 2HG1 VAL 109 3.619 -9.350 -9.350 157 2HG1 VAL 109 1HG1 VAL 109 5.133 -10.034 -10.034 158 3HG1 VAL 109 3HG1 VAL 109 4.670 -8.354 -8.354 159 1HG2 VAL 109 3HG2 VAL 109 2.568 -11.617 -11.617 160 2HG2 VAL 109 2HG2 VAL 109 2.741 -11.828 -11.828 161 3HG2 VAL 109 1HG2 VAL 109 4.187 -11.953 -11.953 162 H LYS 110 H LYS 110 3.036 -7.793 -7.793 163 HA LYS 110 HA LYS 110 3.155 -5.328 -5.328 164 1HB LYS 110 2HB LYS 110 4.079 -6.109 -6.109 165 2HB LYS 110 1HB LYS 110 4.271 -4.484 -4.484 166 1HG LYS 110 2HG LYS 110 5.583 -7.105 -7.105 167 2HG LYS 110 1HG LYS 110 6.275 -5.459 -5.459 168 1HD LYS 110 2HD LYS 110 5.581 -4.558 -4.558 169 2HD LYS 110 1HD LYS 110 4.830 -6.125 -6.125 170 1HE LYS 110 2HE LYS 110 7.085 -7.234 -7.234 171 2HE LYS 110 1HE LYS 110 7.838 -5.643 -5.643 172 1HZ LYS 110 2HZ LYS 110 6.988 -4.747 -4.747 173 2HZ LYS 110 1HZ LYS 110 6.300 -6.245 -6.245 174 3HZ LYS 110 3HZ LYS 110 7.986 -6.093 -6.093 175 H LEU 111 H LEU 111 0.734 -6.787 -6.787 176 HA LEU 111 HA LEU 111 -0.456 -4.310 -4.310 177 1HB LEU 111 2HB LEU 111 -0.936 -6.586 -6.586 178 2HB LEU 111 1HB LEU 111 -1.802 -7.019 -7.019 179 HG LEU 111 HG LEU 111 -2.535 -4.524 -4.524 180 1HD1 LEU 111 2HD1 LEU 111 -2.305 -6.453 -6.453 181 2HD1 LEU 111 1HD1 LEU 111 -3.471 -7.397 -7.397 182 3HD1 LEU 111 3HD1 LEU 111 -4.008 -5.884 -5.884 183 1HD2 LEU 111 1HD2 LEU 111 -4.077 -6.528 -6.528 184 2HD2 LEU 111 3HD2 LEU 111 -3.789 -4.773 -4.773 185 3HD2 LEU 111 2HD2 LEU 111 -4.899 -5.291 -5.291 186 H ARG 112 H ARG 112 -0.054 -6.593 -6.593 187 HA ARG 112 HA ARG 112 -1.764 -5.285 -5.285 188 1HB ARG 112 2HB ARG 112 -0.610 -7.563 -7.563 189 2HB ARG 112 1HB ARG 112 0.685 -6.591 -6.591 190 1HG ARG 112 2HG ARG 112 -1.016 -5.614 -5.614 191 2HG ARG 112 1HG ARG 112 -2.304 -6.551 -6.551 192 1HD ARG 112 2HD ARG 112 -1.128 -8.713 -8.713 193 2HD ARG 112 1HD ARG 112 0.089 -7.717 -7.717 194 HE ARG 112 HE ARG 112 -1.547 -7.168 -7.168 195 1HH1 ARG 112 1HH1 ARG 112 -3.029 -8.967 -8.967 196 2HH1 ARG 112 2HH1 ARG 112 -4.508 -9.283 -9.283 197 1HH2 ARG 112 1HH2 ARG 112 -3.552 -7.605 -7.605 198 2HH2 ARG 112 2HH2 ARG 112 -4.808 -8.505 -8.505 199 H SER 113 H SER 113 1.856 -4.696 -4.696 200 HA SER 113 HA SER 113 2.107 -2.634 -2.634 201 1HB SER 113 2HB SER 113 3.471 -3.037 -3.037 202 2HB SER 113 1HB SER 113 3.746 -1.651 -1.651 203 HG SER 113 HG SER 113 4.078 -3.168 -3.168 204 H LEU 114 H LEU 114 0.635 -2.635 -2.635 205 HA LEU 114 HA LEU 114 0.329 0.139 0.139 206 1HB LEU 114 2HB LEU 114 -1.006 -2.145 -2.145 207 2HB LEU 114 1HB LEU 114 -1.751 -0.516 -0.516 208 HG LEU 114 HG LEU 114 1.135 -1.112 -1.112 209 1HD1 LEU 114 3HD1 LEU 114 -0.561 -2.299 -2.299 210 2HD1 LEU 114 2HD1 LEU 114 -1.414 -0.749 -0.749 211 3HD1 LEU 114 1HD1 LEU 114 0.258 -1.031 -1.031 212 1HD2 LEU 114 3HD2 LEU 114 -0.601 1.454 1.454 213 2HD2 LEU 114 2HD2 LEU 114 0.963 1.258 1.258 214 3HD2 LEU 114 1HD2 LEU 114 0.895 1.211 1.211 215 H ILE 115 H ILE 115 -1.852 -2.306 -2.306 216 HA ILE 115 HA ILE 115 -4.017 -0.617 -0.617 217 HB ILE 115 HB ILE 115 -3.371 -2.199 -2.199 218 1HG1 ILE 115 2HG1 ILE 115 -2.887 -3.810 -3.810 219 2HG1 ILE 115 1HG1 ILE 115 -4.355 -4.234 -4.234 220 1HG2 ILE 115 2HG2 ILE 115 -5.768 -1.321 -1.321 221 2HG2 ILE 115 1HG2 ILE 115 -5.923 -2.433 -2.433 222 3HG2 ILE 115 3HG2 ILE 115 -5.263 -0.772 -0.772 223 1HD1 ILE 115 1HD1 ILE 115 -5.759 -3.322 -3.322 224 2HD1 ILE 115 3HD1 ILE 115 -4.186 -3.041 -3.041 225 3HD1 ILE 115 2HD1 ILE 115 -4.716 -4.723 -4.723 226 H ARG 116 H ARG 116 -1.287 -1.137 -1.137 227 HA ARG 116 HA ARG 116 -1.767 0.553 0.553 228 1HB ARG 116 2HB ARG 116 0.218 -1.107 -1.107 229 2HB ARG 116 1HB ARG 116 1.098 0.337 0.337 230 1HG ARG 116 2HG ARG 116 -0.319 0.273 0.273 231 2HG ARG 116 1HG ARG 116 1.315 -0.431 -0.431 232 1HD ARG 116 2HD ARG 116 2.298 1.713 1.713 233 2HD ARG 116 1HD ARG 116 0.698 2.542 2.542 234 HE ARG 116 HE ARG 116 2.294 1.693 1.693 235 1HH1 ARG 116 1HH1 ARG 116 -0.914 2.693 2.693 236 2HH1 ARG 116 2HH1 ARG 116 -1.473 3.266 3.266 237 1HH2 ARG 116 1HH2 ARG 116 1.517 2.477 2.477 238 2HH2 ARG 116 2HH2 ARG 116 -0.077 3.142 3.142 239 H PHE 117 H PHE 117 -0.032 1.397 1.397 240 HA PHE 117 HA PHE 117 0.438 4.082 4.082 241 1HB PHE 117 2HB PHE 117 0.047 2.666 2.666 242 2HB PHE 117 1HB PHE 117 0.410 4.460 4.460 243 HD1 PHE 117 1HD PHE 117 2.132 5.171 5.171 244 HD2 PHE 117 2HD PHE 117 1.682 1.171 1.171 245 HE1 PHE 117 1HE PHE 117 4.533 4.778 4.778 246 HE2 PHE 117 2HE PHE 117 4.044 0.655 0.655 247 HZ PHE 117 HZ PHE 117 5.463 2.496 2.496 248 H LEU 118 H LEU 118 -2.328 2.657 2.657 249 HA LEU 118 HA LEU 118 -3.900 4.801 4.801 250 1HB LEU 118 2HB LEU 118 -3.958 1.947 1.947 251 2HB LEU 118 1HB LEU 118 -5.441 2.634 2.634 252 HG LEU 118 HG LEU 118 -5.623 1.882 1.882 253 1HD1 LEU 118 1HD1 LEU 118 -7.201 3.609 3.609 254 2HD1 LEU 118 3HD1 LEU 118 -6.056 4.898 4.898 255 3HD1 LEU 118 2HD1 LEU 118 -6.881 3.825 3.825 256 1HD2 LEU 118 2HD2 LEU 118 -3.453 2.658 2.658 257 2HD2 LEU 118 1HD2 LEU 118 -4.940 3.224 3.224 258 3HD2 LEU 118 3HD2 LEU 118 -4.010 4.378 4.378 259 H GLU 119 H GLU 119 -3.677 2.953 2.953 260 HA GLU 119 HA GLU 119 -5.904 4.224 4.224 261 1HB GLU 119 2HB GLU 119 -3.811 2.235 2.235 262 2HB GLU 119 1HB GLU 119 -5.026 2.949 2.949 263 1HG GLU 119 2HG GLU 119 -6.894 2.028 2.028 264 2HG GLU 119 1HG GLU 119 -5.733 1.332 1.332 265 H GLU 120 H GLU 120 -2.447 4.836 4.836 266 HA GLU 120 HA GLU 120 -2.337 6.425 6.425 267 1HB GLU 120 2HB GLU 120 -0.702 6.559 6.559 268 2HB GLU 120 1HB GLU 120 -0.372 7.567 7.567 269 1HG GLU 120 2HG GLU 120 0.011 5.442 5.442 270 2HG GLU 120 1HG GLU 120 -0.128 4.503 4.503 271 H GLY 121 H GLY 121 -3.760 6.839 6.839 272 1HA GLY 121 2HA GLY 121 -5.119 8.428 8.428 273 2HA GLY 121 1HA GLY 121 -4.604 9.465 9.465 274 H ASP 122 H ASP 122 -2.884 7.700 7.700 275 HA ASP 122 HA ASP 122 -1.950 10.235 10.235 276 1HB ASP 122 2HB ASP 122 -0.302 7.672 7.672 277 2HB ASP 122 1HB ASP 122 0.241 9.331 9.331 278 H LYS 123 H LYS 123 -1.179 9.835 9.835 279 HA LYS 123 HA LYS 123 -3.058 8.133 8.133 280 1HB LYS 123 2HB LYS 123 -3.355 10.493 10.493 281 2HB LYS 123 1HB LYS 123 -1.553 10.747 10.747 282 1HG LYS 123 2HG LYS 123 -3.039 9.206 9.206 283 2HG LYS 123 1HG LYS 123 -3.148 10.971 10.971 284 1HD LYS 123 2HD LYS 123 -1.291 11.161 11.161 285 2HD LYS 123 1HD LYS 123 -0.453 10.684 10.684 286 1HE LYS 123 2HE LYS 123 0.024 8.529 8.529 287 2HE LYS 123 1HE LYS 123 -1.390 8.516 8.516 288 1HZ LYS 123 1HZ LYS 123 -0.225 10.140 10.140 289 2HZ LYS 123 3HZ LYS 123 1.088 10.150 10.150 290 3HZ LYS 123 2HZ LYS 123 0.716 8.741 8.741 291 H ALA 124 H ALA 124 -2.263 6.326 6.326 292 HA ALA 124 HA ALA 124 0.590 5.971 5.971 293 1HB ALA 124 2HB ALA 124 -1.665 4.007 4.007 294 2HB ALA 124 1HB ALA 124 0.103 3.542 3.542 295 3HB ALA 124 3HB ALA 124 -0.744 4.158 4.158 296 H LYS 125 H LYS 125 2.094 5.684 5.684 297 HA LYS 125 HA LYS 125 0.578 5.514 5.514 298 1HB LYS 125 2HB LYS 125 2.065 7.622 7.622 299 2HB LYS 125 1HB LYS 125 3.444 6.543 6.543 300 1HG LYS 125 2HG LYS 125 3.370 5.656 5.656 301 2HG LYS 125 1HG LYS 125 2.001 6.755 6.755 302 1HD LYS 125 2HD LYS 125 4.786 7.641 7.641 303 2HD LYS 125 1HD LYS 125 4.395 7.461 7.461 304 1HE LYS 125 2HE LYS 125 3.039 9.468 9.468 305 2HE LYS 125 1HE LYS 125 4.268 9.802 9.802 306 1HZ LYS 125 1HZ LYS 125 2.722 8.953 8.953 307 2HZ LYS 125 3HZ LYS 125 1.564 8.646 8.646 308 3HZ LYS 125 2HZ LYS 125 2.044 10.241 10.241 309 H ILE 126 H ILE 126 0.647 3.624 3.624 310 HA ILE 126 HA ILE 126 2.659 1.761 1.761 311 HB ILE 126 HB ILE 126 0.866 1.590 1.590 312 1HG1 ILE 126 2HG1 ILE 126 -0.826 2.193 2.193 313 2HG1 ILE 126 1HG1 ILE 126 -0.840 0.408 0.408 314 1HG2 ILE 126 1HG2 ILE 126 2.129 -0.336 -0.336 315 2HG2 ILE 126 3HG2 ILE 126 0.987 -0.852 -0.852 316 3HG2 ILE 126 2HG2 ILE 126 2.599 -0.168 -0.168 317 1HD1 ILE 126 1HD1 ILE 126 0.723 0.558 0.558 318 2HD1 ILE 126 3HD1 ILE 126 -0.035 2.179 2.179 319 3HD1 ILE 126 2HD1 ILE 126 -1.084 0.703 0.703 320 H THR 127 H THR 127 4.545 1.472 1.472 321 HA THR 127 HA THR 127 4.643 2.736 2.736 322 HB THR 127 HB THR 127 6.859 2.333 2.333 323 HG1 THR 127 1HG THR 127 5.507 4.670 4.670 324 1HG2 THR 127 3HG2 THR 127 6.688 3.623 3.623 325 2HG2 THR 127 2HG2 THR 127 8.044 3.964 3.964 326 3HG2 THR 127 1HG2 THR 127 7.790 2.291 2.291 327 H LEU 128 H LEU 128 4.740 1.161 1.161 328 HA LEU 128 HA LEU 128 5.641 -1.544 -1.544 329 1HB LEU 128 2HB LEU 128 4.547 0.018 0.018 330 2HB LEU 128 1HB LEU 128 6.041 -0.736 -0.736 331 HG LEU 128 HG LEU 128 4.122 -2.088 -2.088 332 1HD1 LEU 128 3HD1 LEU 128 5.666 -3.434 -3.434 333 2HD1 LEU 128 2HD1 LEU 128 4.393 -4.291 -4.291 334 3HD1 LEU 128 1HD1 LEU 128 5.850 -3.626 -3.626 335 1HD2 LEU 128 3HD2 LEU 128 3.187 -1.616 -1.616 336 2HD2 LEU 128 2HD2 LEU 128 2.565 -1.020 -1.020 337 3HD2 LEU 128 1HD2 LEU 128 2.430 -2.782 -2.782 338 H ARG 129 H ARG 129 7.751 -2.348 -2.348 339 HA ARG 129 HA ARG 129 9.423 -0.424 -0.424 340 1HB ARG 129 2HB ARG 129 9.948 -0.131 -0.131 341 2HB ARG 129 1HB ARG 129 10.200 -1.905 -1.905 342 1HG ARG 129 2HG ARG 129 12.153 -1.765 -1.765 343 2HG ARG 129 1HG ARG 129 11.581 -0.199 -0.199 344 1HD ARG 129 2HD ARG 129 12.169 0.914 0.914 345 2HD ARG 129 1HD ARG 129 12.816 -0.679 -0.679 346 HE ARG 129 HE ARG 129 14.049 -0.176 -0.176 347 1HH1 ARG 129 1HH2 ARG 129 13.823 1.268 1.268 348 2HH1 ARG 129 2HH2 ARG 129 15.408 1.968 1.968 349 1HH2 ARG 129 1HH1 ARG 129 16.202 0.778 0.778 350 2HH2 ARG 129 2HH1 ARG 129 16.781 1.682 1.682 351 H PHE 130 H PHE 130 9.153 -1.451 -1.451 352 HA PHE 130 HA PHE 130 8.687 -4.227 -4.227 353 1HB PHE 130 2HB PHE 130 9.664 -1.881 -1.881 354 2HB PHE 130 1HB PHE 130 9.325 -3.579 -3.579 355 HD1 PHE 130 2HD PHE 130 7.142 -4.608 -4.608 356 HD2 PHE 130 1HD PHE 130 7.967 -0.487 -0.487 357 HE1 PHE 130 2HE PHE 130 4.766 -4.097 -4.097 358 HE2 PHE 130 1HE PHE 130 5.586 0.007 0.007 359 HZ PHE 130 HZ PHE 130 3.963 -1.817 -1.817 360 H ARG 131 H ARG 131 10.276 -5.806 -5.806 361 HA ARG 131 HA ARG 131 13.076 -4.943 -4.943 362 1HB ARG 131 2HB ARG 131 12.041 -7.674 -7.674 363 2HB ARG 131 1HB ARG 131 13.764 -7.156 -7.156 364 1HG ARG 131 2HG ARG 131 11.568 -5.909 -5.909 365 2HG ARG 131 1HG ARG 131 12.756 -7.147 -7.147 366 1HD ARG 131 2HD ARG 131 14.636 -5.558 -5.558 367 2HD ARG 131 1HD ARG 131 13.475 -4.294 -4.294 368 HE ARG 131 HE ARG 131 12.535 -5.198 -5.198 369 1HH1 ARG 131 1HH2 ARG 131 15.296 -3.488 -3.488 370 2HH1 ARG 131 2HH2 ARG 131 15.615 -2.503 -2.503 371 1HH2 ARG 131 1HH1 ARG 131 12.979 -3.857 -3.857 372 2HH2 ARG 131 2HH1 ARG 131 14.281 -2.715 -2.715 373 H GLY 132 H GLY 132 11.159 -5.055 -5.055 374 1HA GLY 132 2HA GLY 132 12.804 -6.726 -6.726 375 2HA GLY 132 1HA GLY 132 11.004 -6.597 -6.597 376 H ARG 133 H ARG 133 11.426 -4.075 -4.075 377 HA ARG 133 HA ARG 133 10.858 -2.024 -2.024 378 1HB ARG 133 2HB ARG 133 12.840 -0.619 -0.619 379 2HB ARG 133 1HB ARG 133 11.892 -1.593 -1.593 380 1HG ARG 133 2HG ARG 133 13.621 -3.377 -3.377 381 2HG ARG 133 1HG ARG 133 14.629 -2.417 -2.417 382 1HD ARG 133 2HD ARG 133 14.902 -0.633 -0.633 383 2HD ARG 133 1HD ARG 133 13.710 -1.464 -1.464 384 HE ARG 133 HE ARG 133 15.898 -3.245 -3.245 385 1HH1 ARG 133 1HH2 ARG 133 14.959 -0.514 -0.514 386 2HH1 ARG 133 2HH2 ARG 133 16.083 -0.899 -0.899 387 1HH2 ARG 133 1HH1 ARG 133 17.431 -3.756 -3.756 388 2HH2 ARG 133 2HH1 ARG 133 17.509 -2.766 -2.766 389 H GLU 134 H GLU 134 10.667 -2.274 -2.274 390 HA GLU 134 HA GLU 134 12.559 -0.438 -0.438 391 1HB GLU 134 2HB GLU 134 11.584 -3.044 -3.044 392 2HB GLU 134 1HB GLU 134 12.332 -1.674 -1.674 393 1HG GLU 134 2HG GLU 134 14.470 -1.966 -1.966 394 2HG GLU 134 1HG GLU 134 13.777 -3.369 -3.369 395 H MET 135 H MET 135 9.935 -0.582 -0.582 396 HA MET 135 HA MET 135 7.792 -0.428 -0.428 397 1HB MET 135 2HB MET 135 8.058 0.801 0.801 398 2HB MET 135 1HB MET 135 6.537 0.640 0.640 399 1HG MET 135 2HG MET 135 7.536 2.074 2.074 400 2HG MET 135 1HG MET 135 8.981 2.333 2.333 401 1HE MET 135 2HE MET 135 7.159 4.508 4.508 402 2HE MET 135 1HE MET 135 8.607 4.887 4.887 403 3HE MET 135 3HE MET 135 7.057 5.747 5.747 404 H ALA 136 H ALA 136 7.993 -2.812 -2.812 405 HA ALA 136 HA ALA 136 8.014 -4.023 -4.023 406 1HB ALA 136 1HB ALA 136 9.382 -4.858 -4.858 407 2HB ALA 136 3HB ALA 136 7.800 -5.339 -5.339 408 3HB ALA 136 2HB ALA 136 8.415 -6.153 -6.153 409 H HIS 137 H HIS 137 6.342 -3.467 -3.467 410 HA HIS 137 HA HIS 137 4.520 -5.666 -5.666 411 1HB HIS 137 2HB HIS 137 4.455 -3.741 -3.741 412 2HB HIS 137 1HB HIS 137 4.545 -5.525 -5.525 413 HD1 HIS 137 1HD HIS 137 6.922 -2.471 -2.471 414 HD2 HIS 137 2HD HIS 137 7.079 -6.533 -6.533 415 HE1 HIS 137 1HE HIS 137 9.349 -3.076 -3.076 416 H GLN 138 H GLN 138 2.252 -5.525 -5.525 417 HA GLN 138 HA GLN 138 1.637 -3.065 -3.065 418 1HB GLN 138 2HB GLN 138 0.550 -2.936 -2.936 419 2HB GLN 138 1HB GLN 138 -0.536 -4.248 -4.248 420 1HG GLN 138 2HG GLN 138 -1.387 -2.711 -2.711 421 2HG GLN 138 1HG GLN 138 -0.207 -1.447 -1.447 422 1HE2 GLN 138 1HE2 GLN 138 -3.394 -2.320 -2.320 423 2HE2 GLN 138 2HE2 GLN 138 -3.842 -1.651 -1.651 424 H GLN 139 H GLN 139 2.233 -6.089 -6.089 425 HA GLN 139 HA GLN 139 -0.076 -7.263 -7.263 426 1HB GLN 139 2HB GLN 139 2.622 -8.701 -8.701 427 2HB GLN 139 1HB GLN 139 0.996 -9.409 -9.409 428 1HG GLN 139 2HG GLN 139 2.341 -7.568 -7.568 429 2HG GLN 139 1HG GLN 139 2.041 -9.336 -9.336 430 1HE2 GLN 139 1HE2 GLN 139 -0.467 -9.873 -9.873 431 2HE2 GLN 139 2HE2 GLN 139 -1.630 -8.942 -8.942 432 H ILE 140 H ILE 140 3.461 -7.003 -7.003 433 HA ILE 140 HA ILE 140 3.685 -7.850 -7.850 434 HB ILE 140 HB ILE 140 5.344 -6.309 -6.309 435 1HG1 ILE 140 2HG1 ILE 140 5.329 -9.029 -9.029 436 2HG1 ILE 140 1HG1 ILE 140 4.703 -8.812 -8.812 437 1HG2 ILE 140 3HG2 ILE 140 5.688 -7.093 -7.093 438 2HG2 ILE 140 2HG2 ILE 140 7.023 -6.537 -6.537 439 3HG2 ILE 140 1HG2 ILE 140 5.707 -5.415 -5.415 440 1HD1 ILE 140 2HD1 ILE 140 7.614 -8.114 -8.114 441 2HD1 ILE 140 1HD1 ILE 140 7.073 -9.793 -9.793 442 3HD1 ILE 140 3HD1 ILE 140 6.797 -8.470 -8.470 443 H GLY 141 H GLY 141 2.651 -4.691 -4.691 444 1HA GLY 141 2HA GLY 141 2.522 -3.766 -3.766 445 2HA GLY 141 1HA GLY 141 1.764 -3.001 -3.001 446 H MET 142 H MET 142 -0.163 -4.685 -4.685 447 HA MET 142 HA MET 142 -1.822 -3.798 -3.798 448 1HB MET 142 2HB MET 142 -3.443 -3.502 -3.502 449 2HB MET 142 1HB MET 142 -1.914 -3.327 -3.327 450 1HG MET 142 2HG MET 142 -2.296 -5.864 -5.864 451 2HG MET 142 1HG MET 142 -3.808 -5.663 -5.663 452 1HE MET 142 2HE MET 142 -4.549 -6.788 -6.788 453 2HE MET 142 1HE MET 142 -4.413 -5.969 -5.969 454 3HE MET 142 3HE MET 142 -2.932 -6.514 -6.514 455 H GLU 143 H GLU 143 -0.689 -7.040 -7.040 456 HA GLU 143 HA GLU 143 -3.072 -8.057 -8.057 457 1HB GLU 143 2HB GLU 143 -0.887 -9.485 -9.485 458 2HB GLU 143 1HB GLU 143 -0.371 -9.215 -9.215 459 1HG GLU 143 2HG GLU 143 -1.478 -11.226 -11.226 460 2HG GLU 143 1HG GLU 143 -2.890 -10.192 -10.192 461 H VAL 144 H VAL 144 -0.071 -6.732 -6.732 462 HA VAL 144 HA VAL 144 -0.541 -7.540 -7.540 463 HB VAL 144 HB VAL 144 1.425 -5.501 -5.501 464 1HG1 VAL 144 1HG1 VAL 144 0.896 -7.126 -7.126 465 2HG1 VAL 144 3HG1 VAL 144 2.534 -6.536 -6.536 466 3HG1 VAL 144 2HG1 VAL 144 1.189 -5.352 -5.352 467 1HG2 VAL 144 1HG2 VAL 144 0.956 -8.502 -8.502 468 2HG2 VAL 144 3HG2 VAL 144 1.561 -7.592 -7.592 469 3HG2 VAL 144 2HG2 VAL 144 2.680 -7.870 -7.870 470 H LEU 145 H LEU 145 -0.386 -4.376 -4.376 471 HA LEU 145 HA LEU 145 -1.334 -2.799 -2.799 472 1HB LEU 145 2HB LEU 145 -1.764 -2.802 -2.802 473 2HB LEU 145 1HB LEU 145 -2.267 -1.415 -1.415 474 HG LEU 145 HG LEU 145 0.535 -2.539 -2.539 475 1HD1 LEU 145 2HD1 LEU 145 -1.044 -0.110 -0.110 476 2HD1 LEU 145 1HD1 LEU 145 0.755 -0.023 -0.023 477 3HD1 LEU 145 3HD1 LEU 145 -0.049 -1.277 -1.277 478 1HD2 LEU 145 3HD2 LEU 145 -0.564 -0.648 -0.648 479 2HD2 LEU 145 2HD2 LEU 145 0.593 -1.990 -1.990 480 3HD2 LEU 145 1HD2 LEU 145 1.161 -0.455 -0.455 481 H ASN 146 H ASN 146 -3.299 -4.176 -4.176 482 HA ASN 146 HA ASN 146 -5.862 -3.351 -3.351 483 1HB ASN 146 2HB ASN 146 -4.619 -4.334 -4.334 484 2HB ASN 146 1HB ASN 146 -5.407 -5.876 -5.876 485 1HD2 ASN 146 1HD2 ASN 146 -5.777 -5.866 -5.866 486 2HD2 ASN 146 2HD2 ASN 146 -7.203 -5.217 -5.217 487 H ARG 147 H ARG 147 -3.952 -6.337 -6.337 488 HA ARG 147 HA ARG 147 -6.264 -7.160 -7.160 489 1HB ARG 147 2HB ARG 147 -5.021 -8.767 -8.767 490 2HB ARG 147 1HB ARG 147 -3.459 -8.058 -8.058 491 1HG ARG 147 2HG ARG 147 -3.592 -9.138 -9.138 492 2HG ARG 147 1HG ARG 147 -5.422 -9.074 -9.074 493 1HD ARG 147 2HD ARG 147 -4.481 -11.464 -11.464 494 2HD ARG 147 1HD ARG 147 -5.353 -10.990 -10.990 495 HE ARG 147 HE ARG 147 -2.650 -10.176 -10.176 496 1HH1 ARG 147 1HH1 ARG 147 -4.497 -13.182 -13.182 497 2HH1 ARG 147 2HH1 ARG 147 -3.351 -14.199 -14.199 498 1HH2 ARG 147 1HH2 ARG 147 -1.094 -11.566 -11.566 499 2HH2 ARG 147 2HH2 ARG 147 -1.388 -13.269 -13.269 500 H VAL 148 H VAL 148 -3.624 -4.795 -4.795 501 HA VAL 148 HA VAL 148 -3.597 -5.371 -5.371 502 HB VAL 148 HB VAL 148 -2.980 -2.715 -2.715 503 1HG1 VAL 148 1HG1 VAL 148 -3.047 -3.596 -3.596 504 2HG1 VAL 148 3HG1 VAL 148 -1.581 -4.550 -4.550 505 3HG1 VAL 148 2HG1 VAL 148 -1.556 -2.734 -2.734 506 1HG2 VAL 148 3HG2 VAL 148 -1.185 -5.142 -5.142 507 2HG2 VAL 148 2HG2 VAL 148 -1.775 -4.055 -4.055 508 3HG2 VAL 148 1HG2 VAL 148 -0.611 -3.424 -3.424 509 H LYS 149 H LYS 149 -5.184 -2.948 -2.948 510 HA LYS 149 HA LYS 149 -6.686 -1.539 -1.539 511 1HB LYS 149 2HB LYS 149 -6.603 -1.202 -1.202 512 2HB LYS 149 1HB LYS 149 -7.424 -2.806 -2.806 513 1HG LYS 149 2HG LYS 149 -9.425 -2.175 -2.175 514 2HG LYS 149 1HG LYS 149 -8.872 -0.665 -0.665 515 1HD LYS 149 2HD LYS 149 -9.214 -1.250 -1.250 516 2HD LYS 149 1HD LYS 149 -10.302 -0.248 -0.248 517 1HE LYS 149 2HE LYS 149 -8.991 1.602 1.602 518 2HE LYS 149 1HE LYS 149 -7.586 0.687 0.687 519 1HZ LYS 149 3HZ LYS 149 -10.282 1.186 1.186 520 2HZ LYS 149 2HZ LYS 149 -8.848 2.008 2.008 521 3HZ LYS 149 1HZ LYS 149 -8.999 0.355 0.355 522 H ASP 150 H ASP 150 -7.422 -4.780 -4.780 523 HA ASP 150 HA ASP 150 -10.049 -4.705 -4.705 524 1HB ASP 150 2HB ASP 150 -8.201 -6.552 -6.552 525 2HB ASP 150 1HB ASP 150 -9.613 -7.204 -7.204 526 H ASP 151 H ASP 151 -6.999 -6.315 -6.315 527 HA ASP 151 HA ASP 151 -8.700 -7.401 -7.401 528 1HB ASP 151 2HB ASP 151 -6.457 -8.324 -8.324 529 2HB ASP 151 1HB ASP 151 -5.706 -6.954 -6.954 530 H LEU 152 H LEU 152 -6.863 -4.220 -4.220 531 HA LEU 152 HA LEU 152 -7.364 -3.804 -3.804 532 1HB LEU 152 2HB LEU 152 -6.034 -2.561 -2.561 533 2HB LEU 152 1HB LEU 152 -7.141 -1.420 -1.420 534 HG LEU 152 HG LEU 152 -5.321 -3.211 -3.211 535 1HD1 LEU 152 2HD1 LEU 152 -4.133 -2.414 -2.414 536 2HD1 LEU 152 1HD1 LEU 152 -4.371 -0.683 -0.683 537 3HD1 LEU 152 3HD1 LEU 152 -3.397 -1.799 -1.799 538 1HD2 LEU 152 1HD2 LEU 152 -6.397 -0.383 -0.383 539 2HD2 LEU 152 3HD2 LEU 152 -6.945 -1.954 -1.954 540 3HD2 LEU 152 2HD2 LEU 152 -5.337 -1.303 -1.303 541 H GLN 153 H GLN 153 -9.126 -3.020 -3.020 542 HA GLN 153 HA GLN 153 -10.628 -1.224 -1.224 543 1HB GLN 153 2HB GLN 153 -10.635 -3.629 -3.629 544 2HB GLN 153 1HB GLN 153 -12.004 -3.893 -3.893 545 1HG GLN 153 2HG GLN 153 -13.092 -1.832 -1.832 546 2HG GLN 153 1HG GLN 153 -11.473 -1.689 -1.689 547 1HE2 GLN 153 1HE2 GLN 153 -11.770 -2.258 -2.258 548 2HE2 GLN 153 2HE2 GLN 153 -12.517 -3.714 -3.714 549 H GLU 154 H GLU 154 -10.852 -3.283 -3.283 550 HA GLU 154 HA GLU 154 -13.330 -2.670 -2.670 551 1HB GLU 154 2HB GLU 154 -10.904 -3.081 -3.081 552 2HB GLU 154 1HB GLU 154 -12.546 -3.732 -3.732 553 1HG GLU 154 2HG GLU 154 -11.957 -5.300 -5.300 554 2HG GLU 154 1HG GLU 154 -10.318 -4.506 -4.506 555 H LEU 155 H LEU 155 -10.148 -1.439 -1.439 556 HA LEU 155 HA LEU 155 -11.194 0.598 0.598 557 1HB LEU 155 2HB LEU 155 -9.556 -1.316 -1.316 558 2HB LEU 155 1HB LEU 155 -8.307 -0.411 -0.411 559 HG LEU 155 HG LEU 155 -9.889 1.152 1.152 560 1HD1 LEU 155 3HD1 LEU 155 -9.774 -1.014 -1.014 561 2HD1 LEU 155 2HD1 LEU 155 -7.994 -1.099 -1.099 562 3HD1 LEU 155 1HD1 LEU 155 -8.689 0.189 0.189 563 1HD2 LEU 155 2HD2 LEU 155 -7.898 2.116 2.116 564 2HD2 LEU 155 1HD2 LEU 155 -7.678 2.075 2.075 565 3HD2 LEU 155 3HD2 LEU 155 -6.849 0.852 0.852 566 H ALA 156 H ALA 156 -8.825 -0.071 -0.071 567 HA ALA 156 HA ALA 156 -8.364 2.843 2.843 568 1HB ALA 156 1HB ALA 156 -6.263 1.436 1.436 569 2HB ALA 156 3HB ALA 156 -7.140 0.628 0.628 570 3HB ALA 156 2HB ALA 156 -6.796 2.399 2.399 571 H VAL 157 H VAL 157 -9.575 3.854 3.854 572 HA VAL 157 HA VAL 157 -8.666 1.882 1.882 573 HB VAL 157 HB VAL 157 -10.106 2.675 2.675 574 1HG1 VAL 157 3HG1 VAL 157 -11.709 2.461 2.461 575 2HG1 VAL 157 2HG1 VAL 157 -12.395 2.329 2.329 576 3HG1 VAL 157 1HG1 VAL 157 -11.192 1.097 1.097 577 1HG2 VAL 157 3HG2 VAL 157 -9.953 5.268 5.268 578 2HG2 VAL 157 2HG2 VAL 157 -11.475 4.606 4.606 579 3HG2 VAL 157 1HG2 VAL 157 -11.267 4.816 4.816 580 H VAL 158 H VAL 158 -8.341 2.574 2.574 581 HA VAL 158 HA VAL 158 -6.024 4.148 4.148 582 HB VAL 158 HB VAL 158 -7.720 3.009 3.009 583 1HG1 VAL 158 3HG1 VAL 158 -5.566 3.990 3.990 584 2HG1 VAL 158 2HG1 VAL 158 -4.709 2.805 2.805 585 3HG1 VAL 158 1HG1 VAL 158 -5.711 2.223 2.223 586 1HG2 VAL 158 1HG2 VAL 158 -6.228 1.391 1.391 587 2HG2 VAL 158 3HG2 VAL 158 -7.884 1.128 1.128 588 3HG2 VAL 158 2HG2 VAL 158 -6.409 0.757 0.757 589 H GLU 159 H GLU 159 -5.747 5.847 5.847 590 HA GLU 159 HA GLU 159 -7.933 7.661 7.661 591 1HB GLU 159 2HB GLU 159 -5.629 8.300 8.300 592 2HB GLU 159 1HB GLU 159 -5.131 7.679 7.679 593 1HG GLU 159 2HG GLU 159 -6.442 9.547 9.547 594 2HG GLU 159 1HG GLU 159 -7.018 10.087 10.087 595 H SER 160 H SER 160 -5.844 5.637 5.637 596 HA SER 160 HA SER 160 -7.736 5.885 5.885 597 1HB SER 160 2HB SER 160 -5.825 7.717 7.717 598 2HB SER 160 1HB SER 160 -4.958 6.253 6.253 599 HG SER 160 HG SER 160 -6.627 6.050 6.050 600 H PHE 161 H PHE 161 -7.571 4.094 4.094 601 HA PHE 161 HA PHE 161 -5.213 2.380 2.380 602 1HB PHE 161 2HB PHE 161 -7.739 1.472 1.472 603 2HB PHE 161 1HB PHE 161 -7.393 1.415 1.415 604 HD1 PHE 161 2HD PHE 161 -5.462 0.228 0.228 605 HD2 PHE 161 1HD PHE 161 -6.724 0.032 0.032 606 HE1 PHE 161 2HE PHE 161 -3.698 -1.426 -1.426 607 HE2 PHE 161 1HE PHE 161 -5.154 -1.431 -1.431 608 HZ PHE 161 HZ PHE 161 -3.590 -2.385 -2.385 609 HA PRO 162 HA PRO 162 -5.217 5.277 5.277 610 1HB PRO 162 2HB PRO 162 -2.231 5.076 5.076 611 2HB PRO 162 1HB PRO 162 -3.233 6.462 6.462 612 1HG PRO 162 2HG PRO 162 -1.607 4.999 4.999 613 2HG PRO 162 1HG PRO 162 -3.163 5.773 5.773 614 1HD PRO 162 2HD PRO 162 -2.725 2.897 2.897 615 2HD PRO 162 1HD PRO 162 -3.543 3.426 3.426 616 H THR 163 H THR 163 -2.284 3.626 3.626 617 HA THR 163 HA THR 163 -3.796 1.986 1.986 618 HB THR 163 HB THR 163 -3.278 4.858 4.858 619 HG1 THR 163 1HG THR 163 -4.855 4.495 4.495 620 1HG2 THR 163 2HG2 THR 163 -2.426 2.807 2.807 621 2HG2 THR 163 1HG2 THR 163 -2.803 4.541 4.541 622 3HG2 THR 163 3HG2 THR 163 -1.500 4.211 4.211 623 H LYS 164 H LYS 164 -0.703 3.898 3.898 624 HA LYS 164 HA LYS 164 0.738 1.415 1.415 625 1HB LYS 164 2HB LYS 164 0.611 3.782 3.782 626 2HB LYS 164 1HB LYS 164 2.123 2.847 2.847 627 1HG LYS 164 2HG LYS 164 0.956 0.738 0.738 628 2HG LYS 164 1HG LYS 164 -0.566 1.653 1.653 629 1HD LYS 164 2HD LYS 164 0.577 3.016 3.016 630 2HD LYS 164 1HD LYS 164 2.101 2.105 2.105 631 1HE LYS 164 2HE LYS 164 0.967 1.199 1.199 632 2HE LYS 164 1HE LYS 164 0.906 -0.040 -0.040 633 1HZ LYS 164 3HZ LYS 164 -1.330 0.708 0.708 634 2HZ LYS 164 2HZ LYS 164 -1.265 1.846 1.846 635 3HZ LYS 164 1HZ LYS 164 -1.190 0.186 0.186 636 H ILE 165 H ILE 165 2.906 1.619 1.619 637 HA ILE 165 HA ILE 165 4.211 2.698 2.698 638 HB ILE 165 HB ILE 165 5.350 2.007 2.007 639 1HG1 ILE 165 2HG1 ILE 165 4.026 0.192 0.192 640 2HG1 ILE 165 1HG1 ILE 165 3.667 0.267 0.267 641 1HG2 ILE 165 3HG2 ILE 165 6.990 2.723 2.723 642 2HG2 ILE 165 2HG2 ILE 165 6.417 1.362 1.362 643 3HG2 ILE 165 1HG2 ILE 165 7.251 1.050 1.050 644 1HD1 ILE 165 2HD1 ILE 165 6.257 -0.868 -0.868 645 2HD1 ILE 165 1HD1 ILE 165 4.819 -1.789 -1.789 646 3HD1 ILE 165 3HD1 ILE 165 5.743 -0.891 -0.891 647 H GLU 166 H GLU 166 5.664 4.198 4.198 648 HA GLU 166 HA GLU 166 5.942 6.351 6.351 649 1HB GLU 166 2HB GLU 166 5.396 6.714 6.714 650 2HB GLU 166 1HB GLU 166 5.888 8.031 8.031 651 1HG GLU 166 2HG GLU 166 3.733 7.761 7.761 652 2HG GLU 166 1HG GLU 166 3.267 6.388 6.388 653 H GLY 167 H GLY 167 8.097 5.738 5.738 654 1HA GLY 167 2HA GLY 167 10.353 5.765 5.765 655 2HA GLY 167 1HA GLY 167 9.937 5.798 5.798 656 H ARG 168 H ARG 168 11.197 4.151 4.151 657 HA ARG 168 HA ARG 168 10.846 1.580 1.580 658 1HB ARG 168 2HB ARG 168 12.670 2.476 2.476 659 2HB ARG 168 1HB ARG 168 12.804 0.907 0.907 660 1HG ARG 168 2HG ARG 168 13.256 2.229 2.229 661 2HG ARG 168 1HG ARG 168 13.408 3.698 3.698 662 1HD ARG 168 2HD ARG 168 15.122 1.132 1.132 663 2HD ARG 168 1HD ARG 168 15.671 2.779 2.779 664 HE ARG 168 HE ARG 168 14.626 3.175 3.175 665 1HH1 ARG 168 1HH2 ARG 168 17.112 1.080 1.080 666 2HH1 ARG 168 2HH2 ARG 168 18.057 0.943 0.943 667 1HH2 ARG 168 1HH1 ARG 168 15.913 2.975 2.975 668 2HH2 ARG 168 2HH1 ARG 168 17.365 2.032 2.032 669 H GLN 169 H GLN 169 8.654 2.598 2.598 670 HA GLN 169 HA GLN 169 8.322 0.846 0.846 671 1HB GLN 169 2HB GLN 169 9.174 3.695 3.695 672 2HB GLN 169 1HB GLN 169 8.050 3.080 3.080 673 1HG GLN 169 2HG GLN 169 9.834 1.497 1.497 674 2HG GLN 169 1HG GLN 169 10.956 2.120 2.120 675 1HE2 GLN 169 1HE2 GLN 169 9.042 4.739 4.739 676 2HE2 GLN 169 2HE2 GLN 169 10.072 5.409 5.409 677 H MET 170 H MET 170 6.091 1.053 1.053 678 HA MET 170 HA MET 170 4.596 3.005 3.005 679 1HB MET 170 2HB MET 170 3.838 0.314 0.314 680 2HB MET 170 1HB MET 170 3.089 0.873 0.873 681 1HG MET 170 2HG MET 170 1.892 2.601 2.601 682 2HG MET 170 1HG MET 170 2.591 1.815 1.815 683 1HE MET 170 1HE MET 170 1.468 0.134 0.134 684 2HE MET 170 3HE MET 170 2.085 -1.100 -1.100 685 3HE MET 170 2HE MET 170 0.375 -1.146 -1.146 686 H ILE 171 H ILE 171 3.039 4.310 4.310 687 HA ILE 171 HA ILE 171 3.103 3.694 3.694 688 HB ILE 171 HB ILE 171 2.380 6.269 6.269 689 1HG1 ILE 171 2HG1 ILE 171 4.859 5.619 5.619 690 2HG1 ILE 171 1HG1 ILE 171 4.358 7.228 7.228 691 1HG2 ILE 171 3HG2 ILE 171 2.115 5.321 5.321 692 2HG2 ILE 171 2HG2 ILE 171 2.295 7.091 7.091 693 3HG2 ILE 171 1HG2 ILE 171 0.865 6.205 6.205 694 1HD1 ILE 171 2HD1 ILE 171 4.066 5.759 5.759 695 2HD1 ILE 171 1HD1 ILE 171 4.791 4.493 4.493 696 3HD1 ILE 171 3HD1 ILE 171 5.761 5.962 5.962 697 H MET 172 H MET 172 1.280 2.941 2.941 698 HA MET 172 HA MET 172 -1.300 3.814 3.814 699 1HB MET 172 2HB MET 172 -1.456 1.391 1.391 700 2HB MET 172 1HB MET 172 -0.579 1.406 1.406 701 1HG MET 172 2HG MET 172 -2.490 2.266 2.266 702 2HG MET 172 1HG MET 172 -3.246 2.837 2.837 703 1HE MET 172 3HE MET 172 -3.732 0.855 0.855 704 2HE MET 172 2HE MET 172 -4.305 -0.764 -0.764 705 3HE MET 172 1HE MET 172 -2.533 -0.426 -0.426 706 H VAL 173 H VAL 173 -2.209 5.338 5.338 707 HA VAL 173 HA VAL 173 -0.746 6.001 6.001 708 HB VAL 173 HB VAL 173 -3.139 7.402 7.402 709 1HG1 VAL 173 3HG1 VAL 173 -1.218 7.712 7.712 710 2HG1 VAL 173 2HG1 VAL 173 -1.792 9.251 9.251 711 3HG1 VAL 173 1HG1 VAL 173 -2.978 8.141 8.141 712 1HG2 VAL 173 1HG2 VAL 173 -0.113 7.863 7.863 713 2HG2 VAL 173 3HG2 VAL 173 -1.288 7.393 7.393 714 3HG2 VAL 173 2HG2 VAL 173 -1.400 9.012 9.012 715 H LEU 174 H LEU 174 -1.606 5.561 5.561 716 HA LEU 174 HA LEU 174 -4.284 4.495 4.495 717 1HB LEU 174 2HB LEU 174 -2.438 2.997 2.997 718 2HB LEU 174 1HB LEU 174 -1.831 3.841 3.841 719 HG LEU 174 HG LEU 174 -4.181 3.489 3.489 720 1HD1 LEU 174 2HD1 LEU 174 -4.486 1.796 1.796 721 2HD1 LEU 174 1HD1 LEU 174 -5.461 1.534 1.534 722 3HD1 LEU 174 3HD1 LEU 174 -5.492 3.144 3.144 723 1HD2 LEU 174 3HD2 LEU 174 -2.030 2.163 2.163 724 2HD2 LEU 174 2HD2 LEU 174 -3.668 1.477 1.477 725 3HD2 LEU 174 1HD2 LEU 174 -2.858 0.846 0.846 726 H ALA 175 H ALA 175 -5.779 5.305 5.305 727 HA ALA 175 HA ALA 175 -4.680 7.423 7.423 728 1HB ALA 175 3HB ALA 175 -7.190 7.120 7.120 729 2HB ALA 175 2HB ALA 175 -6.951 8.598 8.598 730 3HB ALA 175 1HB ALA 175 -5.835 8.310 8.310 731 HA PRO 176 HA PRO 176 -7.853 5.800 5.800 732 1HB PRO 176 2HB PRO 176 -8.896 8.650 8.650 733 2HB PRO 176 1HB PRO 176 -8.654 7.543 7.543 734 1HG PRO 176 2HG PRO 176 -6.844 9.540 9.540 735 2HG PRO 176 1HG PRO 176 -6.249 7.873 7.873 736 1HD PRO 176 2HD PRO 176 -6.463 9.173 9.173 737 2HD PRO 176 1HD PRO 176 -5.122 8.158 8.158 738 H LYS 177 H LYS 177 -9.888 4.863 4.863 739 HA LYS 177 HA LYS 177 -11.307 5.807 5.807 740 1HB LYS 177 2HB LYS 177 -11.520 3.424 3.424 741 2HB LYS 177 1HB LYS 177 -12.449 4.272 4.272 742 1HG LYS 177 2HG LYS 177 -14.032 5.076 5.076 743 2HG LYS 177 1HG LYS 177 -13.196 3.853 3.853 744 1HD LYS 177 2HD LYS 177 -14.663 3.344 3.344 745 2HD LYS 177 1HD LYS 177 -15.404 3.179 3.179 746 1HE LYS 177 2HE LYS 177 -13.720 1.405 1.405 747 2HE LYS 177 1HE LYS 177 -13.059 1.494 1.494 748 1HZ LYS 177 2HZ LYS 177 -15.871 0.871 0.871 749 2HZ LYS 177 1HZ LYS 177 -14.686 -0.245 -0.245 750 3HZ LYS 177 3HZ LYS 177 -15.240 0.933 0.933 751 H LYS 178 H LYS 178 -13.113 7.130 7.130 752 HA LYS 178 HA LYS 178 -13.518 8.909 8.909 753 1HB LYS 178 2HB LYS 178 -13.904 9.611 9.611 754 2HB LYS 178 1HB LYS 178 -15.203 8.385 8.385 755 1HG LYS 178 2HG LYS 178 -16.548 9.619 9.619 756 2HG LYS 178 1HG LYS 178 -15.201 10.798 10.798 757 1HD LYS 178 2HD LYS 178 -15.510 11.502 11.502 758 2HD LYS 178 1HD LYS 178 -16.801 10.262 10.262 759 1HE LYS 178 2HE LYS 178 -18.189 11.412 11.412 760 2HE LYS 178 1HE LYS 178 -16.909 12.685 12.685 761 1HZ LYS 178 1HZ LYS 178 -18.411 12.007 12.007 762 2HZ LYS 178 3HZ LYS 178 -18.680 13.347 13.347 763 3HZ LYS 178 2HZ LYS 178 -17.220 13.209 13.209 764 H LYS 179 H LYS 179 -14.314 8.020 8.020 765 HA LYS 179 HA LYS 179 -16.487 6.083 6.083 766 1HB LYS 179 2HB LYS 179 -14.734 6.885 6.885 767 2HB LYS 179 1HB LYS 179 -16.095 5.705 5.705 768 1HG LYS 179 2HG LYS 179 -14.925 4.228 4.228 769 2HG LYS 179 1HG LYS 179 -13.587 5.418 5.418 770 1HD LYS 179 2HD LYS 179 -13.080 5.153 5.153 771 2HD LYS 179 1HD LYS 179 -14.364 3.895 3.895 772 1HE LYS 179 2HE LYS 179 -13.119 2.463 2.463 773 2HE LYS 179 1HE LYS 179 -11.854 3.752 3.752 774 1HZ LYS 179 3HZ LYS 179 -11.421 3.528 3.528 775 2HZ LYS 179 2HZ LYS 179 -12.580 2.293 2.293 776 3HZ LYS 179 1HZ LYS 179 -11.193 2.061 2.061 777 H GLN 180 H GLN 180 -17.903 7.810 7.810 778 HA GLN 180 HA GLN 180 -19.320 9.432 9.432 779 1HB GLN 180 2HB GLN 180 -19.541 8.690 8.690 780 2HB GLN 180 1HB GLN 180 -20.689 9.726 9.726 781 1HG GLN 180 2HG GLN 180 -21.215 7.794 7.794 782 2HG GLN 180 1HG GLN 180 -20.095 6.743 6.743 783 1HE2 GLN 180 1HE2 GLN 180 -22.452 5.691 5.691 784 2HE2 GLN 180 2HE2 GLN 180 -23.390 6.010 6.010 Start of MODEL 19 1 HA VAL 90 HA VAL 90 -4.343 16.152 16.152 2 HB VAL 90 HB VAL 90 -2.968 17.008 17.008 3 1HG1 VAL 90 2HG1 VAL 90 -3.482 18.734 18.734 4 2HG1 VAL 90 1HG1 VAL 90 -3.241 19.290 19.290 5 3HG1 VAL 90 3HG1 VAL 90 -4.618 18.187 18.187 6 1HG2 VAL 90 1HG2 VAL 90 -0.887 17.554 17.554 7 2HG2 VAL 90 3HG2 VAL 90 -0.741 16.409 16.409 8 3HG2 VAL 90 2HG2 VAL 90 -0.884 18.175 18.175 9 H ILE 91 H ILE 91 -3.584 15.422 15.422 10 HA ILE 91 HA ILE 91 -2.833 12.621 12.621 11 HB ILE 91 HB ILE 91 -3.875 14.140 14.140 12 1HG1 ILE 91 2HG1 ILE 91 -5.615 14.128 14.128 13 2HG1 ILE 91 1HG1 ILE 91 -6.020 12.959 12.959 14 1HG2 ILE 91 2HG2 ILE 91 -3.243 11.199 11.199 15 2HG2 ILE 91 1HG2 ILE 91 -4.374 11.682 11.682 16 3HG2 ILE 91 3HG2 ILE 91 -2.653 12.191 12.191 17 1HD1 ILE 91 1HD1 ILE 91 -5.175 11.067 11.067 18 2HD1 ILE 91 3HD1 ILE 91 -4.883 12.274 12.274 19 3HD1 ILE 91 2HD1 ILE 91 -6.556 11.979 11.979 20 H GLN 92 H GLN 92 -0.663 12.043 12.043 21 HA GLN 92 HA GLN 92 1.103 13.752 13.752 22 1HB GLN 92 2HB GLN 92 1.357 11.050 11.050 23 2HB GLN 92 1HB GLN 92 2.728 11.982 11.982 24 1HG GLN 92 2HG GLN 92 2.612 12.163 12.163 25 2HG GLN 92 1HG GLN 92 2.434 13.773 13.773 26 1HE2 GLN 92 1HE2 GLN 92 0.324 11.134 11.134 27 2HE2 GLN 92 2HE2 GLN 92 -0.769 12.217 12.217 28 H VAL 93 H VAL 93 2.669 12.563 12.563 29 HA VAL 93 HA VAL 93 1.317 10.302 10.302 30 HB VAL 93 HB VAL 93 3.441 12.120 12.120 31 1HG1 VAL 93 1HG1 VAL 93 2.407 9.285 9.285 32 2HG1 VAL 93 3HG1 VAL 93 3.205 10.343 10.343 33 3HG1 VAL 93 2HG1 VAL 93 4.186 9.719 9.719 34 1HG2 VAL 93 2HG2 VAL 93 0.779 12.359 12.359 35 2HG2 VAL 93 1HG2 VAL 93 1.730 12.147 12.147 36 3HG2 VAL 93 3HG2 VAL 93 0.980 10.701 10.701 37 H LYS 94 H LYS 94 1.902 8.439 8.439 38 HA LYS 94 HA LYS 94 4.860 8.105 8.105 39 1HB LYS 94 2HB LYS 94 2.851 6.181 6.181 40 2HB LYS 94 1HB LYS 94 4.615 6.263 6.263 41 1HG LYS 94 2HG LYS 94 2.573 8.450 8.450 42 2HG LYS 94 1HG LYS 94 3.106 7.159 7.159 43 1HD LYS 94 2HD LYS 94 5.473 7.890 7.890 44 2HD LYS 94 1HD LYS 94 4.982 9.276 9.276 45 1HE LYS 94 2HE LYS 94 5.254 10.013 10.013 46 2HE LYS 94 1HE LYS 94 3.507 10.117 10.117 47 1HZ LYS 94 1HZ LYS 94 4.783 7.905 7.905 48 2HZ LYS 94 3HZ LYS 94 3.815 9.145 9.145 49 3HZ LYS 94 2HZ LYS 94 3.145 8.011 8.011 50 H GLU 95 H GLU 95 5.350 5.628 5.628 51 HA GLU 95 HA GLU 95 3.874 4.986 4.986 52 1HB GLU 95 2HB GLU 95 5.959 6.460 6.460 53 2HB GLU 95 1HB GLU 95 6.845 5.004 5.004 54 1HG GLU 95 2HG GLU 95 6.221 3.772 3.772 55 2HG GLU 95 1HG GLU 95 5.180 5.154 5.154 56 H ILE 96 H ILE 96 4.280 2.705 2.705 57 HA ILE 96 HA ILE 96 5.880 1.031 1.031 58 HB ILE 96 HB ILE 96 3.105 0.893 0.893 59 1HG1 ILE 96 2HG1 ILE 96 3.434 -1.575 -1.575 60 2HG1 ILE 96 1HG1 ILE 96 5.155 -1.415 -1.415 61 1HG2 ILE 96 2HG2 ILE 96 2.885 0.483 0.483 62 2HG2 ILE 96 1HG2 ILE 96 3.725 -1.144 -1.144 63 3HG2 ILE 96 3HG2 ILE 96 2.236 -0.841 -0.841 64 1HD1 ILE 96 1HD1 ILE 96 3.690 0.237 0.237 65 2HD1 ILE 96 3HD1 ILE 96 4.815 -1.139 -1.139 66 3HD1 ILE 96 2HD1 ILE 96 5.439 0.390 0.390 67 H LYS 97 H LYS 97 6.599 -0.949 -0.949 68 HA LYS 97 HA LYS 97 5.991 -0.389 -0.389 69 1HB LYS 97 2HB LYS 97 8.536 -1.829 -1.829 70 2HB LYS 97 1HB LYS 97 7.878 -1.488 -1.488 71 1HG LYS 97 2HG LYS 97 8.081 0.992 0.992 72 2HG LYS 97 1HG LYS 97 8.920 0.586 0.586 73 1HD LYS 97 2HD LYS 97 10.722 -0.575 -0.575 74 2HD LYS 97 1HD LYS 97 9.825 -0.288 -0.288 75 1HE LYS 97 2HE LYS 97 11.672 1.351 1.351 76 2HE LYS 97 1HE LYS 97 10.081 2.212 2.212 77 1HZ LYS 97 2HZ LYS 97 10.312 2.169 2.169 78 2HZ LYS 97 1HZ LYS 97 11.804 1.367 1.367 79 3HZ LYS 97 3HZ LYS 97 11.636 2.942 2.942 80 H PHE 98 H PHE 98 5.709 -2.169 -2.169 81 HA PHE 98 HA PHE 98 5.636 -4.790 -4.790 82 1HB PHE 98 2HB PHE 98 3.530 -3.474 -3.474 83 2HB PHE 98 1HB PHE 98 3.628 -5.246 -5.246 84 HD1 PHE 98 1HD PHE 98 3.919 -5.945 -5.945 85 HD2 PHE 98 2HD PHE 98 1.854 -2.742 -2.742 86 HE1 PHE 98 1HE PHE 98 2.683 -5.709 -5.709 87 HE2 PHE 98 2HE PHE 98 0.501 -2.475 -2.475 88 HZ PHE 98 HZ PHE 98 0.817 -4.121 -4.121 89 H ARG 99 H ARG 99 6.807 -6.216 -6.216 90 HA ARG 99 HA ARG 99 7.962 -5.016 -5.016 91 1HB ARG 99 2HB ARG 99 8.893 -7.145 -7.145 92 2HB ARG 99 1HB ARG 99 9.773 -6.593 -6.593 93 1HG ARG 99 2HG ARG 99 9.877 -4.262 -4.262 94 2HG ARG 99 1HG ARG 99 9.159 -4.929 -4.929 95 1HD ARG 99 2HD ARG 99 11.587 -4.798 -4.798 96 2HD ARG 99 1HD ARG 99 11.154 -6.558 -6.558 97 HE ARG 99 HE ARG 99 11.722 -5.435 -5.435 98 1HH1 ARG 99 1HH2 ARG 99 13.289 -6.302 -6.302 99 2HH1 ARG 99 2HH2 ARG 99 14.836 -6.633 -6.633 100 1HH2 ARG 99 1HH1 ARG 99 13.824 -5.884 -5.884 101 2HH2 ARG 99 2HH1 ARG 99 15.144 -6.391 -6.391 102 HA PRO 100 HA PRO 100 6.345 -8.827 -8.827 103 1HB PRO 100 2HB PRO 100 8.644 -9.691 -9.691 104 2HB PRO 100 1HB PRO 100 7.338 -8.630 -8.630 105 1HG PRO 100 2HG PRO 100 10.088 -7.893 -7.893 106 2HG PRO 100 1HG PRO 100 9.060 -7.035 -7.035 107 1HD PRO 100 2HD PRO 100 9.453 -6.233 -6.233 108 2HD PRO 100 1HD PRO 100 7.964 -5.773 -5.773 109 H GLY 101 H GLY 101 6.366 -10.910 -10.910 110 1HA GLY 101 2HA GLY 101 7.261 -12.748 -12.748 111 2HA GLY 101 1HA GLY 101 8.798 -11.813 -11.813 112 H THR 102 H THR 102 6.238 -10.068 -10.068 113 HA THR 102 HA THR 102 6.362 -10.661 -10.661 114 HB THR 102 HB THR 102 5.222 -8.069 -8.069 115 HG1 THR 102 1HG THR 102 7.056 -7.251 -7.251 116 1HG2 THR 102 1HG2 THR 102 5.281 -9.607 -9.607 117 2HG2 THR 102 3HG2 THR 102 5.623 -7.821 -7.821 118 3HG2 THR 102 2HG2 THR 102 4.081 -8.400 -8.400 119 H ASP 103 H ASP 103 5.215 -12.377 -12.377 120 HA ASP 103 HA ASP 103 2.403 -11.943 -11.943 121 1HB ASP 103 2HB ASP 103 3.738 -13.439 -13.439 122 2HB ASP 103 1HB ASP 103 3.746 -14.531 -14.531 123 H GLU 104 H GLU 104 1.873 -14.645 -14.645 124 HA GLU 104 HA GLU 104 0.589 -12.966 -12.966 125 1HB GLU 104 2HB GLU 104 -0.007 -15.325 -15.325 126 2HB GLU 104 1HB GLU 104 1.054 -15.875 -15.875 127 1HG GLU 104 2HG GLU 104 -0.426 -14.681 -14.681 128 2HG GLU 104 1HG GLU 104 -1.434 -14.056 -14.056 129 H GLY 105 H GLY 105 3.344 -14.946 -14.946 130 1HA GLY 105 2HA GLY 105 2.762 -13.834 -13.834 131 2HA GLY 105 1HA GLY 105 3.919 -15.199 -15.199 132 H ASP 106 H ASP 106 4.547 -12.763 -12.763 133 HA ASP 106 HA ASP 106 6.412 -11.342 -11.342 134 1HB ASP 106 2HB ASP 106 7.017 -12.343 -12.343 135 2HB ASP 106 1HB ASP 106 5.970 -11.160 -11.160 136 H TYR 107 H TYR 107 3.531 -11.359 -11.359 137 HA TYR 107 HA TYR 107 3.528 -8.543 -8.543 138 1HB TYR 107 2HB TYR 107 2.989 -10.372 -10.372 139 2HB TYR 107 1HB TYR 107 1.621 -10.916 -10.916 140 HD1 TYR 107 1HD TYR 107 1.728 -7.343 -7.343 141 HD2 TYR 107 2HD TYR 107 0.700 -11.057 -11.057 142 HE1 TYR 107 1HE TYR 107 -0.413 -6.380 -6.380 143 HE2 TYR 107 2HE TYR 107 -1.091 -9.925 -9.925 144 HH TYR 107 HH TYR 107 -2.092 -6.651 -6.651 145 H GLN 108 H GLN 108 0.648 -10.448 -10.448 146 HA GLN 108 HA GLN 108 -0.405 -8.418 -8.418 147 1HB GLN 108 2HB GLN 108 -1.293 -10.919 -10.919 148 2HB GLN 108 1HB GLN 108 -2.149 -9.607 -9.607 149 1HG GLN 108 2HG GLN 108 -0.505 -11.642 -11.642 150 2HG GLN 108 1HG GLN 108 -2.044 -12.012 -12.012 151 1HE2 GLN 108 1HE2 GLN 108 -0.950 -8.726 -8.726 152 2HE2 GLN 108 2HE2 GLN 108 -2.114 -8.607 -8.607 153 H VAL 109 H VAL 109 2.167 -10.027 -10.027 154 HA VAL 109 HA VAL 109 1.896 -9.310 -9.310 155 HB VAL 109 HB VAL 109 4.395 -9.439 -9.439 156 1HG1 VAL 109 1HG1 VAL 109 4.052 -9.197 -9.197 157 2HG1 VAL 109 3HG1 VAL 109 5.570 -9.731 -9.731 158 3HG1 VAL 109 2HG1 VAL 109 4.962 -8.076 -8.076 159 1HG2 VAL 109 3HG2 VAL 109 3.072 -11.467 -11.467 160 2HG2 VAL 109 2HG2 VAL 109 3.184 -11.600 -11.600 161 3HG2 VAL 109 1HG2 VAL 109 4.677 -11.668 -11.668 162 H LYS 110 H LYS 110 3.232 -7.604 -7.604 163 HA LYS 110 HA LYS 110 3.290 -5.125 -5.125 164 1HB LYS 110 2HB LYS 110 4.216 -5.940 -5.940 165 2HB LYS 110 1HB LYS 110 4.319 -4.280 -4.280 166 1HG LYS 110 2HG LYS 110 5.789 -6.782 -6.782 167 2HG LYS 110 1HG LYS 110 6.376 -5.101 -5.101 168 1HD LYS 110 2HD LYS 110 5.564 -4.220 -4.220 169 2HD LYS 110 1HD LYS 110 5.046 -5.865 -5.865 170 1HE LYS 110 2HE LYS 110 7.951 -5.003 -5.003 171 2HE LYS 110 1HE LYS 110 7.263 -5.258 -5.258 172 1HZ LYS 110 2HZ LYS 110 7.475 -7.314 -7.314 173 2HZ LYS 110 1HZ LYS 110 8.502 -7.150 -7.150 174 3HZ LYS 110 3HZ LYS 110 6.864 -7.548 -7.548 175 H LEU 111 H LEU 111 0.863 -6.670 -6.670 176 HA LEU 111 HA LEU 111 -0.372 -4.241 -4.241 177 1HB LEU 111 2HB LEU 111 -0.808 -6.545 -6.545 178 2HB LEU 111 1HB LEU 111 -1.695 -6.947 -6.947 179 HG LEU 111 HG LEU 111 -2.385 -4.496 -4.496 180 1HD1 LEU 111 2HD1 LEU 111 -2.191 -6.482 -6.482 181 2HD1 LEU 111 1HD1 LEU 111 -3.358 -7.380 -7.380 182 3HD1 LEU 111 3HD1 LEU 111 -3.894 -5.901 -5.901 183 1HD2 LEU 111 2HD2 LEU 111 -3.955 -6.375 -6.375 184 2HD2 LEU 111 1HD2 LEU 111 -3.650 -4.609 -4.609 185 3HD2 LEU 111 3HD2 LEU 111 -4.768 -5.192 -5.192 186 H ARG 112 H ARG 112 0.085 -6.476 -6.476 187 HA ARG 112 HA ARG 112 -1.645 -5.152 -5.152 188 1HB ARG 112 2HB ARG 112 -0.512 -7.389 -7.389 189 2HB ARG 112 1HB ARG 112 0.919 -6.427 -6.427 190 1HG ARG 112 2HG ARG 112 -0.544 -5.184 -5.184 191 2HG ARG 112 1HG ARG 112 -1.878 -6.319 -6.319 192 1HD ARG 112 2HD ARG 112 -0.527 -8.238 -8.238 193 2HD ARG 112 1HD ARG 112 0.909 -7.170 -7.170 194 HE ARG 112 HE ARG 112 -1.552 -7.308 -7.308 195 1HH1 ARG 112 1HH1 ARG 112 1.405 -5.475 -5.475 196 2HH1 ARG 112 2HH1 ARG 112 1.446 -4.602 -4.602 197 1HH2 ARG 112 1HH2 ARG 112 -1.474 -6.111 -6.111 198 2HH2 ARG 112 2HH2 ARG 112 -0.205 -4.965 -4.965 199 H SER 113 H SER 113 1.984 -4.535 -4.535 200 HA SER 113 HA SER 113 2.086 -2.502 -2.502 201 1HB SER 113 2HB SER 113 3.677 -2.804 -2.804 202 2HB SER 113 1HB SER 113 3.900 -1.531 -1.531 203 HG SER 113 HG SER 113 3.896 -4.328 -4.328 204 H LEU 114 H LEU 114 0.867 -2.480 -2.480 205 HA LEU 114 HA LEU 114 0.541 0.253 0.253 206 1HB LEU 114 2HB LEU 114 -0.731 -2.142 -2.142 207 2HB LEU 114 1HB LEU 114 -1.606 -0.585 -0.585 208 HG LEU 114 HG LEU 114 1.282 -1.010 -1.010 209 1HD1 LEU 114 1HD1 LEU 114 -0.506 -2.337 -2.337 210 2HD1 LEU 114 3HD1 LEU 114 -1.365 -0.806 -0.806 211 3HD1 LEU 114 2HD1 LEU 114 0.272 -1.148 -1.148 212 1HD2 LEU 114 3HD2 LEU 114 -0.630 1.425 1.425 213 2HD2 LEU 114 2HD2 LEU 114 1.002 1.351 1.351 214 3HD2 LEU 114 1HD2 LEU 114 0.809 1.283 1.283 215 H ILE 115 H ILE 115 -1.682 -2.163 -2.163 216 HA ILE 115 HA ILE 115 -3.847 -0.473 -0.473 217 HB ILE 115 HB ILE 115 -3.203 -1.978 -1.978 218 1HG1 ILE 115 2HG1 ILE 115 -2.784 -3.678 -3.678 219 2HG1 ILE 115 1HG1 ILE 115 -4.275 -4.003 -4.003 220 1HG2 ILE 115 2HG2 ILE 115 -5.635 -1.105 -1.105 221 2HG2 ILE 115 1HG2 ILE 115 -5.754 -2.163 -2.163 222 3HG2 ILE 115 3HG2 ILE 115 -5.079 -0.501 -0.501 223 1HD1 ILE 115 3HD1 ILE 115 -5.627 -3.126 -3.126 224 2HD1 ILE 115 2HD1 ILE 115 -4.039 -2.929 -2.929 225 3HD1 ILE 115 1HD1 ILE 115 -4.625 -4.574 -4.574 226 H ARG 116 H ARG 116 -1.180 -0.980 -0.980 227 HA ARG 116 HA ARG 116 -1.724 0.785 0.785 228 1HB ARG 116 2HB ARG 116 0.261 -0.944 -0.944 229 2HB ARG 116 1HB ARG 116 1.158 0.412 0.412 230 1HG ARG 116 2HG ARG 116 1.750 0.356 0.356 231 2HG ARG 116 1HG ARG 116 0.739 1.813 1.813 232 1HD ARG 116 2HD ARG 116 -1.263 0.497 0.497 233 2HD ARG 116 1HD ARG 116 -0.130 -0.881 -0.881 234 HE ARG 116 HE ARG 116 0.984 0.380 0.380 235 1HH1 ARG 116 1HH2 ARG 116 -1.569 2.315 2.315 236 2HH1 ARG 116 2HH2 ARG 116 -1.564 3.558 3.558 237 1HH2 ARG 116 1HH1 ARG 116 0.968 2.069 2.069 238 2HH2 ARG 116 2HH1 ARG 116 -0.108 3.418 3.418 239 H PHE 117 H PHE 117 0.036 1.536 1.536 240 HA PHE 117 HA PHE 117 0.558 4.260 4.260 241 1HB PHE 117 2HB PHE 117 0.169 2.788 2.788 242 2HB PHE 117 1HB PHE 117 0.489 4.590 4.590 243 HD1 PHE 117 2HD PHE 117 2.210 5.356 5.356 244 HD2 PHE 117 1HD PHE 117 1.826 1.325 1.325 245 HE1 PHE 117 2HE PHE 117 4.629 5.031 5.031 246 HE2 PHE 117 1HE PHE 117 4.176 0.856 0.856 247 HZ PHE 117 HZ PHE 117 5.579 2.750 2.750 248 H LEU 118 H LEU 118 -2.110 2.871 2.871 249 HA LEU 118 HA LEU 118 -3.428 5.159 5.159 250 1HB LEU 118 2HB LEU 118 -3.902 2.493 2.493 251 2HB LEU 118 1HB LEU 118 -5.288 3.155 3.155 252 HG LEU 118 HG LEU 118 -4.882 5.245 5.245 253 1HD1 LEU 118 1HD1 LEU 118 -3.878 2.658 2.658 254 2HD1 LEU 118 3HD1 LEU 118 -4.772 3.862 3.862 255 3HD1 LEU 118 2HD1 LEU 118 -3.271 4.376 4.376 256 1HD2 LEU 118 2HD2 LEU 118 -6.615 2.836 2.836 257 2HD2 LEU 118 1HD2 LEU 118 -6.840 4.580 4.580 258 3HD2 LEU 118 3HD2 LEU 118 -6.804 4.114 4.114 259 H GLU 119 H GLU 119 -3.620 3.075 3.075 260 HA GLU 119 HA GLU 119 -6.057 4.030 4.030 261 1HB GLU 119 2HB GLU 119 -5.297 1.660 1.660 262 2HB GLU 119 1HB GLU 119 -3.970 2.106 2.106 263 1HG GLU 119 2HG GLU 119 -6.927 2.615 2.615 264 2HG GLU 119 1HG GLU 119 -6.216 0.966 0.966 265 H GLU 120 H GLU 120 -2.610 4.636 4.636 266 HA GLU 120 HA GLU 120 -3.170 6.119 6.119 267 1HB GLU 120 2HB GLU 120 -0.780 6.721 6.721 268 2HB GLU 120 1HB GLU 120 -1.039 4.957 4.957 269 1HG GLU 120 2HG GLU 120 -0.476 5.201 5.201 270 2HG GLU 120 1HG GLU 120 -0.211 6.971 6.971 271 H GLY 121 H GLY 121 -4.101 6.707 6.707 272 1HA GLY 121 2HA GLY 121 -5.045 8.448 8.448 273 2HA GLY 121 1HA GLY 121 -4.406 9.463 9.463 274 H ASP 122 H ASP 122 -3.149 7.507 7.507 275 HA ASP 122 HA ASP 122 -1.862 9.930 9.930 276 1HB ASP 122 2HB ASP 122 -0.549 7.186 7.186 277 2HB ASP 122 1HB ASP 122 0.187 8.772 8.772 278 H LYS 123 H LYS 123 -1.165 9.528 9.528 279 HA LYS 123 HA LYS 123 -3.116 7.841 7.841 280 1HB LYS 123 2HB LYS 123 -3.515 10.284 10.284 281 2HB LYS 123 1HB LYS 123 -1.726 10.488 10.488 282 1HG LYS 123 2HG LYS 123 -2.556 8.565 8.565 283 2HG LYS 123 1HG LYS 123 -3.757 9.896 9.896 284 1HD LYS 123 2HD LYS 123 -2.210 11.397 11.397 285 2HD LYS 123 1HD LYS 123 -0.967 10.855 10.855 286 1HE LYS 123 2HE LYS 123 -0.124 9.151 9.151 287 2HE LYS 123 1HE LYS 123 -1.602 9.035 9.035 288 1HZ LYS 123 3HZ LYS 123 0.332 11.299 11.299 289 2HZ LYS 123 2HZ LYS 123 0.251 10.082 10.082 290 3HZ LYS 123 1HZ LYS 123 -1.039 11.170 11.170 291 H ALA 124 H ALA 124 -2.167 6.105 6.105 292 HA ALA 124 HA ALA 124 0.714 5.973 5.973 293 1HB ALA 124 2HB ALA 124 -1.631 4.037 4.037 294 2HB ALA 124 1HB ALA 124 0.107 3.538 3.538 295 3HB ALA 124 3HB ALA 124 -0.512 4.037 4.037 296 H LYS 125 H LYS 125 1.929 5.686 5.686 297 HA LYS 125 HA LYS 125 0.035 5.289 5.289 298 1HB LYS 125 2HB LYS 125 3.033 6.128 6.128 299 2HB LYS 125 1HB LYS 125 1.893 5.943 5.943 300 1HG LYS 125 2HG LYS 125 0.540 7.846 7.846 301 2HG LYS 125 1HG LYS 125 1.998 8.171 8.171 302 1HD LYS 125 2HD LYS 125 1.726 8.229 8.229 303 2HD LYS 125 1HD LYS 125 1.910 9.651 9.651 304 1HE LYS 125 2HE LYS 125 4.049 7.472 7.472 305 2HE LYS 125 1HE LYS 125 4.027 9.137 9.137 306 1HZ LYS 125 2HZ LYS 125 4.137 10.015 10.015 307 2HZ LYS 125 1HZ LYS 125 4.157 8.449 8.449 308 3HZ LYS 125 3HZ LYS 125 5.445 8.979 8.979 309 H ILE 126 H ILE 126 0.439 3.359 3.359 310 HA ILE 126 HA ILE 126 2.579 1.668 1.668 311 HB ILE 126 HB ILE 126 0.872 1.435 1.435 312 1HG1 ILE 126 2HG1 ILE 126 -0.859 1.751 1.751 313 2HG1 ILE 126 1HG1 ILE 126 -0.662 -0.020 -0.020 314 1HG2 ILE 126 1HG2 ILE 126 2.370 -0.448 -0.448 315 2HG2 ILE 126 3HG2 ILE 126 1.194 -1.013 -1.013 316 3HG2 ILE 126 2HG2 ILE 126 2.713 -0.208 -0.208 317 1HD1 ILE 126 3HD1 ILE 126 0.880 0.165 0.165 318 2HD1 ILE 126 2HD1 ILE 126 0.103 1.768 1.768 319 3HD1 ILE 126 1HD1 ILE 126 -0.919 0.281 0.281 320 H THR 127 H THR 127 4.547 1.445 1.445 321 HA THR 127 HA THR 127 4.668 2.685 2.685 322 HB THR 127 HB THR 127 6.932 2.160 2.160 323 HG1 THR 127 1HG THR 127 5.617 4.555 4.555 324 1HG2 THR 127 2HG2 THR 127 6.682 3.527 3.527 325 2HG2 THR 127 1HG2 THR 127 8.101 3.788 3.788 326 3HG2 THR 127 3HG2 THR 127 7.759 2.143 2.143 327 H LEU 128 H LEU 128 4.685 1.124 1.124 328 HA LEU 128 HA LEU 128 5.534 -1.582 -1.582 329 1HB LEU 128 2HB LEU 128 4.205 -0.298 -0.298 330 2HB LEU 128 1HB LEU 128 5.723 -0.919 -0.919 331 HG LEU 128 HG LEU 128 3.887 -2.487 -2.487 332 1HD1 LEU 128 3HD1 LEU 128 5.950 -3.716 -3.716 333 2HD1 LEU 128 2HD1 LEU 128 5.452 -3.698 -3.698 334 3HD1 LEU 128 1HD1 LEU 128 4.459 -4.583 -4.583 335 1HD2 LEU 128 1HD2 LEU 128 2.417 -1.419 -1.419 336 2HD2 LEU 128 3HD2 LEU 128 2.404 -3.216 -3.216 337 3HD2 LEU 128 2HD2 LEU 128 3.254 -2.082 -2.082 338 H ARG 129 H ARG 129 7.531 -2.489 -2.489 339 HA ARG 129 HA ARG 129 9.327 -0.593 -0.593 340 1HB ARG 129 2HB ARG 129 9.867 -0.432 -0.432 341 2HB ARG 129 1HB ARG 129 9.916 -2.227 -2.227 342 1HG ARG 129 2HG ARG 129 11.895 -2.272 -2.272 343 2HG ARG 129 1HG ARG 129 11.584 -0.584 -0.584 344 1HD ARG 129 2HD ARG 129 13.577 -0.755 -0.755 345 2HD ARG 129 1HD ARG 129 12.237 0.166 0.166 346 HE ARG 129 HE ARG 129 11.918 -2.620 -2.620 347 1HH1 ARG 129 1HH1 ARG 129 14.190 0.078 0.078 348 2HH1 ARG 129 2HH1 ARG 129 14.763 -0.518 -0.518 349 1HH2 ARG 129 1HH2 ARG 129 12.712 -3.422 -3.422 350 2HH2 ARG 129 2HH2 ARG 129 13.912 -2.531 -2.531 351 H PHE 130 H PHE 130 9.182 -1.612 -1.612 352 HA PHE 130 HA PHE 130 8.554 -4.383 -4.383 353 1HB PHE 130 2HB PHE 130 9.377 -2.125 -2.125 354 2HB PHE 130 1HB PHE 130 8.827 -3.829 -3.829 355 HD1 PHE 130 1HD PHE 130 6.771 -4.762 -4.762 356 HD2 PHE 130 2HD PHE 130 7.868 -0.604 -0.604 357 HE1 PHE 130 1HE PHE 130 4.445 -4.133 -4.133 358 HE2 PHE 130 2HE PHE 130 5.437 -0.021 -0.021 359 HZ PHE 130 HZ PHE 130 3.736 -1.833 -1.833 360 H ARG 131 H ARG 131 9.851 -5.787 -5.787 361 HA ARG 131 HA ARG 131 12.713 -5.602 -5.602 362 1HB ARG 131 2HB ARG 131 10.808 -6.884 -6.884 363 2HB ARG 131 1HB ARG 131 12.595 -7.083 -7.083 364 1HG ARG 131 2HG ARG 131 12.466 -8.239 -8.239 365 2HG ARG 131 1HG ARG 131 10.678 -8.033 -8.033 366 1HD ARG 131 2HD ARG 131 12.239 -9.630 -9.630 367 2HD ARG 131 1HD ARG 131 11.318 -10.341 -10.341 368 HE ARG 131 HE ARG 131 9.540 -8.592 -8.592 369 1HH1 ARG 131 1HH2 ARG 131 11.408 -11.574 -11.574 370 2HH1 ARG 131 2HH2 ARG 131 10.295 -12.218 -12.218 371 1HH2 ARG 131 1HH1 ARG 131 8.036 -9.475 -9.475 372 2HH2 ARG 131 2HH1 ARG 131 8.352 -11.010 -11.010 373 H GLY 132 H GLY 132 13.646 -3.765 -3.765 374 1HA GLY 132 2HA GLY 132 11.837 -1.918 -1.918 375 2HA GLY 132 1HA GLY 132 13.606 -1.690 -1.690 376 H ARG 133 H ARG 133 11.045 -1.319 -1.319 377 HA ARG 133 HA ARG 133 12.641 -1.414 -1.414 378 1HB ARG 133 2HB ARG 133 9.666 -2.019 -2.019 379 2HB ARG 133 1HB ARG 133 10.449 -1.712 -1.712 380 1HG ARG 133 2HG ARG 133 11.715 -3.772 -3.772 381 2HG ARG 133 1HG ARG 133 11.266 -4.032 -4.032 382 1HD ARG 133 2HD ARG 133 9.918 -5.501 -5.501 383 2HD ARG 133 1HD ARG 133 8.896 -4.355 -4.355 384 HE ARG 133 HE ARG 133 9.636 -3.176 -3.176 385 1HH1 ARG 133 1HH2 ARG 133 7.488 -5.531 -5.531 386 2HH1 ARG 133 2HH2 ARG 133 6.187 -5.331 -5.331 387 1HH2 ARG 133 1HH1 ARG 133 7.864 -2.910 -2.910 388 2HH2 ARG 133 2HH1 ARG 133 6.402 -3.818 -3.818 389 H GLU 134 H GLU 134 11.496 0.200 0.200 390 HA GLU 134 HA GLU 134 11.368 2.691 2.691 391 1HB GLU 134 2HB GLU 134 10.424 1.803 1.803 392 2HB GLU 134 1HB GLU 134 10.522 3.515 3.515 393 1HG GLU 134 2HG GLU 134 12.995 3.241 3.241 394 2HG GLU 134 1HG GLU 134 12.896 1.545 1.545 395 H MET 135 H MET 135 8.665 1.221 1.221 396 HA MET 135 HA MET 135 6.859 2.063 2.063 397 1HB MET 135 2HB MET 135 6.325 2.891 2.891 398 2HB MET 135 1HB MET 135 6.174 1.176 1.176 399 1HG MET 135 2HG MET 135 3.972 1.987 1.987 400 2HG MET 135 1HG MET 135 4.296 0.961 0.961 401 1HE MET 135 3HE MET 135 1.962 2.893 2.893 402 2HE MET 135 2HE MET 135 2.210 1.989 1.989 403 3HE MET 135 1HE MET 135 1.849 3.749 3.749 404 H ALA 136 H ALA 136 7.017 0.237 0.237 405 HA ALA 136 HA ALA 136 7.680 -2.201 -2.201 406 1HB ALA 136 1HB ALA 136 8.589 -1.282 -1.282 407 2HB ALA 136 3HB ALA 136 7.003 -1.733 -1.733 408 3HB ALA 136 2HB ALA 136 8.081 -2.997 -2.997 409 H HIS 137 H HIS 137 6.722 -4.086 -4.086 410 HA HIS 137 HA HIS 137 4.469 -5.281 -5.281 411 1HB HIS 137 2HB HIS 137 5.563 -5.073 -5.073 412 2HB HIS 137 1HB HIS 137 4.687 -6.470 -6.470 413 HD1 HIS 137 1HD HIS 137 6.256 -7.629 -7.629 414 HD2 HIS 137 2HD HIS 137 8.110 -4.808 -4.808 415 HE1 HIS 137 1HE HIS 137 8.783 -7.898 -7.898 416 H GLN 138 H GLN 138 2.300 -4.714 -4.714 417 HA GLN 138 HA GLN 138 1.454 -3.089 -3.089 418 1HB GLN 138 2HB GLN 138 0.751 -2.530 -2.530 419 2HB GLN 138 1HB GLN 138 -0.338 -3.956 -3.956 420 1HG GLN 138 2HG GLN 138 -1.457 -2.785 -2.785 421 2HG GLN 138 1HG GLN 138 -0.343 -1.388 -1.388 422 1HE2 GLN 138 1HE2 GLN 138 -3.089 -1.030 -1.030 423 2HE2 GLN 138 2HE2 GLN 138 -3.608 -0.693 -0.693 424 H GLN 139 H GLN 139 2.156 -6.064 -6.064 425 HA GLN 139 HA GLN 139 -0.229 -7.393 -7.393 426 1HB GLN 139 2HB GLN 139 2.509 -8.763 -8.763 427 2HB GLN 139 1HB GLN 139 0.893 -9.487 -9.487 428 1HG GLN 139 2HG GLN 139 2.270 -7.452 -7.452 429 2HG GLN 139 1HG GLN 139 2.053 -9.211 -9.211 430 1HE2 GLN 139 1HE2 GLN 139 0.895 -6.279 -6.279 431 2HE2 GLN 139 2HE2 GLN 139 -0.763 -6.643 -6.643 432 H ILE 140 H ILE 140 3.247 -7.127 -7.127 433 HA ILE 140 HA ILE 140 3.424 -8.116 -8.116 434 HB ILE 140 HB ILE 140 4.994 -6.263 -6.263 435 1HG1 ILE 140 2HG1 ILE 140 5.264 -9.154 -9.154 436 2HG1 ILE 140 1HG1 ILE 140 4.720 -8.712 -8.712 437 1HG2 ILE 140 1HG2 ILE 140 5.383 -7.367 -7.367 438 2HG2 ILE 140 3HG2 ILE 140 6.703 -6.636 -6.636 439 3HG2 ILE 140 2HG2 ILE 140 5.338 -5.621 -5.621 440 1HD1 ILE 140 3HD1 ILE 140 6.895 -7.606 -7.606 441 2HD1 ILE 140 2HD1 ILE 140 7.513 -8.141 -8.141 442 3HD1 ILE 140 1HD1 ILE 140 7.064 -9.363 -9.363 443 H GLY 141 H GLY 141 2.440 -4.880 -4.880 444 1HA GLY 141 2HA GLY 141 2.272 -3.961 -3.961 445 2HA GLY 141 1HA GLY 141 1.544 -3.213 -3.213 446 H MET 142 H MET 142 -0.359 -4.862 -4.862 447 HA MET 142 HA MET 142 -2.074 -3.995 -3.995 448 1HB MET 142 2HB MET 142 -3.664 -3.721 -3.721 449 2HB MET 142 1HB MET 142 -2.129 -3.546 -3.546 450 1HG MET 142 2HG MET 142 -2.480 -6.083 -6.083 451 2HG MET 142 1HG MET 142 -3.997 -5.893 -5.893 452 1HE MET 142 3HE MET 142 -4.775 -7.035 -7.035 453 2HE MET 142 2HE MET 142 -4.648 -6.251 -6.251 454 3HE MET 142 1HE MET 142 -3.162 -6.788 -6.788 455 H GLU 143 H GLU 143 -0.862 -7.231 -7.231 456 HA GLU 143 HA GLU 143 -3.230 -8.240 -8.240 457 1HB GLU 143 2HB GLU 143 -0.996 -9.675 -9.675 458 2HB GLU 143 1HB GLU 143 -0.552 -9.372 -9.372 459 1HG GLU 143 2HG GLU 143 -1.649 -11.372 -11.372 460 2HG GLU 143 1HG GLU 143 -3.024 -10.302 -10.302 461 H VAL 144 H VAL 144 -0.170 -7.004 -7.004 462 HA VAL 144 HA VAL 144 -0.660 -7.660 -7.660 463 HB VAL 144 HB VAL 144 1.341 -5.713 -5.713 464 1HG1 VAL 144 1HG1 VAL 144 0.773 -7.208 -7.208 465 2HG1 VAL 144 3HG1 VAL 144 2.426 -6.697 -6.697 466 3HG1 VAL 144 2HG1 VAL 144 1.128 -5.452 -5.452 467 1HG2 VAL 144 1HG2 VAL 144 0.811 -8.694 -8.694 468 2HG2 VAL 144 3HG2 VAL 144 1.426 -7.858 -7.858 469 3HG2 VAL 144 2HG2 VAL 144 2.545 -8.093 -8.093 470 H LEU 145 H LEU 145 -0.470 -4.561 -4.561 471 HA LEU 145 HA LEU 145 -1.370 -2.872 -2.872 472 1HB LEU 145 2HB LEU 145 -1.824 -3.080 -3.080 473 2HB LEU 145 1HB LEU 145 -2.388 -1.649 -1.649 474 HG LEU 145 HG LEU 145 0.456 -2.641 -2.641 475 1HD1 LEU 145 2HD1 LEU 145 -1.118 -0.171 -0.171 476 2HD1 LEU 145 1HD1 LEU 145 0.682 -0.279 -0.279 477 3HD1 LEU 145 3HD1 LEU 145 -0.358 -1.448 -1.448 478 1HD2 LEU 145 3HD2 LEU 145 -0.682 -0.658 -0.658 479 2HD2 LEU 145 2HD2 LEU 145 0.477 -1.990 -1.990 480 3HD2 LEU 145 1HD2 LEU 145 1.034 -0.497 -0.497 481 H ASN 146 H ASN 146 -3.394 -4.332 -4.332 482 HA ASN 146 HA ASN 146 -5.925 -3.434 -3.434 483 1HB ASN 146 2HB ASN 146 -4.693 -4.539 -4.539 484 2HB ASN 146 1HB ASN 146 -5.539 -6.023 -6.023 485 1HD2 ASN 146 2HD2 ASN 146 -5.990 -6.142 -6.142 486 2HD2 ASN 146 1HD2 ASN 146 -7.323 -5.374 -5.374 487 H ARG 147 H ARG 147 -4.045 -6.423 -6.423 488 HA ARG 147 HA ARG 147 -6.351 -7.183 -7.183 489 1HB ARG 147 2HB ARG 147 -5.136 -8.813 -8.813 490 2HB ARG 147 1HB ARG 147 -3.557 -8.114 -8.114 491 1HG ARG 147 2HG ARG 147 -3.673 -9.197 -9.197 492 2HG ARG 147 1HG ARG 147 -5.504 -9.101 -9.101 493 1HD ARG 147 2HD ARG 147 -4.631 -11.507 -11.507 494 2HD ARG 147 1HD ARG 147 -5.472 -11.014 -11.014 495 HE ARG 147 HE ARG 147 -2.718 -10.280 -10.280 496 1HH1 ARG 147 1HH1 ARG 147 -4.736 -13.199 -13.199 497 2HH1 ARG 147 2HH1 ARG 147 -3.615 -14.249 -14.249 498 1HH2 ARG 147 1HH2 ARG 147 -1.202 -11.713 -11.713 499 2HH2 ARG 147 2HH2 ARG 147 -1.579 -13.394 -13.394 500 H VAL 148 H VAL 148 -3.692 -4.829 -4.829 501 HA VAL 148 HA VAL 148 -3.612 -5.363 -5.363 502 HB VAL 148 HB VAL 148 -3.010 -2.723 -2.723 503 1HG1 VAL 148 3HG1 VAL 148 -3.008 -3.549 -3.549 504 2HG1 VAL 148 2HG1 VAL 148 -1.582 -4.547 -4.547 505 3HG1 VAL 148 1HG1 VAL 148 -1.501 -2.738 -2.738 506 1HG2 VAL 148 2HG2 VAL 148 -1.244 -5.169 -5.169 507 2HG2 VAL 148 1HG2 VAL 148 -1.854 -4.070 -4.070 508 3HG2 VAL 148 3HG2 VAL 148 -0.654 -3.458 -3.458 509 H LYS 149 H LYS 149 -5.230 -2.969 -2.969 510 HA LYS 149 HA LYS 149 -6.696 -1.501 -1.501 511 1HB LYS 149 2HB LYS 149 -6.588 -1.349 -1.349 512 2HB LYS 149 1HB LYS 149 -7.473 -2.917 -2.917 513 1HG LYS 149 2HG LYS 149 -9.442 -2.171 -2.171 514 2HG LYS 149 1HG LYS 149 -8.866 -0.605 -0.605 515 1HD LYS 149 2HD LYS 149 -8.982 -1.445 -1.445 516 2HD LYS 149 1HD LYS 149 -10.271 -0.474 -0.474 517 1HE LYS 149 2HE LYS 149 -8.930 1.482 1.482 518 2HE LYS 149 1HE LYS 149 -7.573 0.553 0.553 519 1HZ LYS 149 3HZ LYS 149 -9.096 0.111 0.111 520 2HZ LYS 149 2HZ LYS 149 -10.337 0.974 0.974 521 3HZ LYS 149 1HZ LYS 149 -8.932 1.781 1.781 522 H ASP 150 H ASP 150 -7.473 -4.780 -4.780 523 HA ASP 150 HA ASP 150 -10.096 -4.701 -4.701 524 1HB ASP 150 2HB ASP 150 -8.224 -6.564 -6.564 525 2HB ASP 150 1HB ASP 150 -9.639 -7.210 -7.210 526 H ASP 151 H ASP 151 -7.016 -6.287 -6.287 527 HA ASP 151 HA ASP 151 -8.668 -7.328 -7.328 528 1HB ASP 151 2HB ASP 151 -6.446 -8.286 -8.286 529 2HB ASP 151 1HB ASP 151 -5.660 -6.884 -6.884 530 H LEU 152 H LEU 152 -6.861 -4.150 -4.150 531 HA LEU 152 HA LEU 152 -7.278 -3.695 -3.695 532 1HB LEU 152 2HB LEU 152 -6.016 -2.482 -2.482 533 2HB LEU 152 1HB LEU 152 -7.098 -1.336 -1.336 534 HG LEU 152 HG LEU 152 -5.251 -3.126 -3.126 535 1HD1 LEU 152 2HD1 LEU 152 -4.096 -2.355 -2.355 536 2HD1 LEU 152 1HD1 LEU 152 -4.294 -0.623 -0.623 537 3HD1 LEU 152 3HD1 LEU 152 -3.307 -1.766 -1.766 538 1HD2 LEU 152 3HD2 LEU 152 -6.294 -0.281 -0.281 539 2HD2 LEU 152 2HD2 LEU 152 -6.810 -1.832 -1.832 540 3HD2 LEU 152 1HD2 LEU 152 -5.184 -1.165 -1.165 541 H GLN 153 H GLN 153 -9.114 -2.956 -2.956 542 HA GLN 153 HA GLN 153 -10.585 -1.144 -1.144 543 1HB GLN 153 2HB GLN 153 -10.658 -3.572 -3.572 544 2HB GLN 153 1HB GLN 153 -11.999 -3.785 -3.785 545 1HG GLN 153 2HG GLN 153 -13.113 -1.770 -1.770 546 2HG GLN 153 1HG GLN 153 -11.512 -1.640 -1.640 547 1HE2 GLN 153 1HE2 GLN 153 -11.729 -2.331 -2.331 548 2HE2 GLN 153 2HE2 GLN 153 -12.506 -3.790 -3.790 549 H GLU 154 H GLU 154 -10.823 -3.154 -3.154 550 HA GLU 154 HA GLU 154 -13.240 -2.544 -2.544 551 1HB GLU 154 2HB GLU 154 -10.676 -2.906 -2.906 552 2HB GLU 154 1HB GLU 154 -12.305 -3.536 -3.536 553 1HG GLU 154 2HG GLU 154 -11.925 -5.116 -5.116 554 2HG GLU 154 1HG GLU 154 -10.255 -4.397 -4.397 555 H LEU 155 H LEU 155 -10.062 -1.215 -1.215 556 HA LEU 155 HA LEU 155 -11.054 0.877 0.877 557 1HB LEU 155 2HB LEU 155 -9.416 -0.991 -0.991 558 2HB LEU 155 1HB LEU 155 -8.194 -0.196 -0.196 559 HG LEU 155 HG LEU 155 -9.599 1.587 1.587 560 1HD1 LEU 155 1HD1 LEU 155 -9.547 -0.500 -0.500 561 2HD1 LEU 155 3HD1 LEU 155 -7.791 -0.709 -0.709 562 3HD1 LEU 155 2HD1 LEU 155 -8.354 0.683 0.683 563 1HD2 LEU 155 3HD2 LEU 155 -6.610 1.074 1.074 564 2HD2 LEU 155 2HD2 LEU 155 -7.631 2.410 2.410 565 3HD2 LEU 155 1HD2 LEU 155 -7.261 2.351 2.351 566 H ALA 156 H ALA 156 -8.788 0.068 0.068 567 HA ALA 156 HA ALA 156 -8.423 2.971 2.971 568 1HB ALA 156 3HB ALA 156 -6.127 1.728 1.728 569 2HB ALA 156 2HB ALA 156 -6.764 0.689 0.689 570 3HB ALA 156 1HB ALA 156 -6.532 2.451 2.451 571 H VAL 157 H VAL 157 -9.299 3.779 3.779 572 HA VAL 157 HA VAL 157 -8.414 1.765 1.765 573 HB VAL 157 HB VAL 157 -9.922 2.559 2.559 574 1HG1 VAL 157 1HG1 VAL 157 -11.399 2.262 2.262 575 2HG1 VAL 157 3HG1 VAL 157 -12.172 2.151 2.151 576 3HG1 VAL 157 2HG1 VAL 157 -10.926 0.930 0.930 577 1HG2 VAL 157 2HG2 VAL 157 -9.776 5.151 5.151 578 2HG2 VAL 157 1HG2 VAL 157 -11.262 4.482 4.482 579 3HG2 VAL 157 3HG2 VAL 157 -11.131 4.641 4.641 580 H VAL 158 H VAL 158 -8.163 2.401 2.401 581 HA VAL 158 HA VAL 158 -5.862 4.006 4.006 582 HB VAL 158 HB VAL 158 -7.560 2.846 2.846 583 1HG1 VAL 158 1HG1 VAL 158 -5.396 3.880 3.880 584 2HG1 VAL 158 3HG1 VAL 158 -4.559 2.671 2.671 585 3HG1 VAL 158 2HG1 VAL 158 -5.519 2.110 2.110 586 1HG2 VAL 158 3HG2 VAL 158 -5.982 1.239 1.239 587 2HG2 VAL 158 2HG2 VAL 158 -7.689 1.002 1.002 588 3HG2 VAL 158 1HG2 VAL 158 -6.308 0.601 0.601 589 H GLU 159 H GLU 159 -5.669 5.737 5.737 590 HA GLU 159 HA GLU 159 -7.929 7.459 7.459 591 1HB GLU 159 2HB GLU 159 -5.587 8.095 8.095 592 2HB GLU 159 1HB GLU 159 -5.190 7.665 7.665 593 1HG GLU 159 2HG GLU 159 -5.377 10.165 10.165 594 2HG GLU 159 1HG GLU 159 -6.657 9.605 9.605 595 H SER 160 H SER 160 -5.853 5.559 5.559 596 HA SER 160 HA SER 160 -7.739 5.857 5.857 597 1HB SER 160 2HB SER 160 -5.798 7.671 7.671 598 2HB SER 160 1HB SER 160 -4.955 6.207 6.207 599 HG SER 160 HG SER 160 -5.962 7.502 7.502 600 H PHE 161 H PHE 161 -7.540 4.046 4.046 601 HA PHE 161 HA PHE 161 -5.226 2.310 2.310 602 1HB PHE 161 2HB PHE 161 -7.662 1.318 1.318 603 2HB PHE 161 1HB PHE 161 -7.503 1.228 1.228 604 HD1 PHE 161 2HD PHE 161 -5.549 0.153 0.153 605 HD2 PHE 161 1HD PHE 161 -6.586 -0.204 -0.204 606 HE1 PHE 161 2HE PHE 161 -3.748 -1.535 -1.535 607 HE2 PHE 161 1HE PHE 161 -4.987 -1.624 -1.624 608 HZ PHE 161 HZ PHE 161 -3.548 -2.583 -2.583 609 HA PRO 162 HA PRO 162 -5.234 4.315 4.315 610 1HB PRO 162 2HB PRO 162 -2.622 5.288 5.288 611 2HB PRO 162 1HB PRO 162 -3.933 6.046 6.046 612 1HG PRO 162 2HG PRO 162 -1.572 4.610 4.610 613 2HG PRO 162 1HG PRO 162 -2.808 5.632 5.632 614 1HD PRO 162 2HD PRO 162 -2.678 2.679 2.679 615 2HD PRO 162 1HD PRO 162 -3.591 3.560 3.560 616 H THR 163 H THR 163 -1.924 3.585 3.585 617 HA THR 163 HA THR 163 -2.043 1.264 1.264 618 HB THR 163 HB THR 163 -3.094 3.965 3.965 619 HG1 THR 163 1HG THR 163 -3.258 1.354 1.354 620 1HG2 THR 163 1HG2 THR 163 -1.054 2.403 2.403 621 2HG2 THR 163 3HG2 THR 163 -2.192 3.602 3.602 622 3HG2 THR 163 2HG2 THR 163 -1.081 4.175 4.175 623 H LYS 164 H LYS 164 -0.917 4.661 4.661 624 HA LYS 164 HA LYS 164 1.150 4.276 4.276 625 1HB LYS 164 2HB LYS 164 -0.143 6.387 6.387 626 2HB LYS 164 1HB LYS 164 0.618 6.588 6.588 627 1HG LYS 164 2HG LYS 164 2.855 6.853 6.853 628 2HG LYS 164 1HG LYS 164 2.156 6.436 6.436 629 1HD LYS 164 2HD LYS 164 0.774 8.504 8.504 630 2HD LYS 164 1HD LYS 164 1.356 8.866 8.866 631 1HE LYS 164 2HE LYS 164 2.580 10.253 10.253 632 2HE LYS 164 1HE LYS 164 3.716 9.084 9.084 633 1HZ LYS 164 3HZ LYS 164 3.445 7.637 7.637 634 2HZ LYS 164 2HZ LYS 164 2.413 8.760 8.760 635 3HZ LYS 164 1HZ LYS 164 4.036 9.164 9.164 636 H ILE 165 H ILE 165 2.940 3.266 3.266 637 HA ILE 165 HA ILE 165 4.276 3.103 3.103 638 HB ILE 165 HB ILE 165 5.457 2.769 2.769 639 1HG1 ILE 165 2HG1 ILE 165 3.106 1.404 1.404 640 2HG1 ILE 165 1HG1 ILE 165 4.501 0.863 0.863 641 1HG2 ILE 165 3HG2 ILE 165 7.026 2.616 2.616 642 2HG2 ILE 165 2HG2 ILE 165 6.070 1.344 1.344 643 3HG2 ILE 165 1HG2 ILE 165 6.885 1.006 1.006 644 1HD1 ILE 165 1HD1 ILE 165 3.891 -0.032 -0.032 645 2HD1 ILE 165 3HD1 ILE 165 3.499 -0.938 -0.938 646 3HD1 ILE 165 2HD1 ILE 165 5.215 -0.676 -0.676 647 H GLU 166 H GLU 166 5.766 4.486 4.486 648 HA GLU 166 HA GLU 166 6.386 6.818 6.818 649 1HB GLU 166 2HB GLU 166 5.842 6.720 6.720 650 2HB GLU 166 1HB GLU 166 6.541 8.142 8.142 651 1HG GLU 166 2HG GLU 166 4.447 8.431 8.431 652 2HG GLU 166 1HG GLU 166 3.759 6.920 6.920 653 H GLY 167 H GLY 167 8.474 6.238 6.238 654 1HA GLY 167 2HA GLY 167 10.701 5.790 5.790 655 2HA GLY 167 1HA GLY 167 10.331 5.633 5.633 656 H ARG 168 H ARG 168 11.298 3.712 3.712 657 HA ARG 168 HA ARG 168 10.454 1.482 1.482 658 1HB ARG 168 2HB ARG 168 12.663 1.638 1.638 659 2HB ARG 168 1HB ARG 168 12.366 0.265 0.265 660 1HG ARG 168 2HG ARG 168 12.801 1.853 1.853 661 2HG ARG 168 1HG ARG 168 13.291 3.105 3.105 662 1HD ARG 168 2HD ARG 168 15.130 1.617 1.617 663 2HD ARG 168 1HD ARG 168 14.664 0.349 0.349 664 HE ARG 168 HE ARG 168 15.956 2.986 2.986 665 1HH1 ARG 168 1HH1 ARG 168 14.320 0.096 0.096 666 2HH1 ARG 168 2HH1 ARG 168 14.924 0.335 0.335 667 1HH2 ARG 168 1HH2 ARG 168 16.750 3.283 3.283 668 2HH2 ARG 168 2HH2 ARG 168 16.319 2.164 2.164 669 H GLN 169 H GLN 169 8.504 2.455 2.455 670 HA GLN 169 HA GLN 169 8.108 0.608 0.608 671 1HB GLN 169 2HB GLN 169 9.097 3.446 3.446 672 2HB GLN 169 1HB GLN 169 7.994 2.839 2.839 673 1HG GLN 169 2HG GLN 169 9.701 1.420 1.420 674 2HG GLN 169 1HG GLN 169 10.702 1.491 1.491 675 1HE2 GLN 169 1HE2 GLN 169 9.088 3.908 3.908 676 2HE2 GLN 169 2HE2 GLN 169 10.477 4.925 4.925 677 H MET 170 H MET 170 5.851 0.893 0.893 678 HA MET 170 HA MET 170 4.407 2.984 2.984 679 1HB MET 170 2HB MET 170 3.598 0.793 0.793 680 2HB MET 170 1HB MET 170 3.217 0.232 0.232 681 1HG MET 170 2HG MET 170 1.531 2.034 2.034 682 2HG MET 170 1HG MET 170 1.984 2.594 2.594 683 1HE MET 170 2HE MET 170 1.769 -0.167 -0.167 684 2HE MET 170 1HE MET 170 1.822 -1.231 -1.231 685 3HE MET 170 3HE MET 170 0.387 -1.236 -1.236 686 H ILE 171 H ILE 171 3.897 4.637 4.637 687 HA ILE 171 HA ILE 171 3.191 3.845 3.845 688 HB ILE 171 HB ILE 171 2.676 6.458 6.458 689 1HG1 ILE 171 2HG1 ILE 171 5.119 5.589 5.589 690 2HG1 ILE 171 1HG1 ILE 171 4.679 7.273 7.273 691 1HG2 ILE 171 1HG2 ILE 171 2.265 5.409 5.409 692 2HG2 ILE 171 3HG2 ILE 171 2.492 7.194 7.194 693 3HG2 ILE 171 2HG2 ILE 171 1.073 6.368 6.368 694 1HD1 ILE 171 3HD1 ILE 171 4.652 4.713 4.713 695 2HD1 ILE 171 2HD1 ILE 171 5.944 5.973 5.973 696 3HD1 ILE 171 1HD1 ILE 171 4.263 6.316 6.316 697 H MET 172 H MET 172 1.335 3.070 3.070 698 HA MET 172 HA MET 172 -1.212 3.996 3.996 699 1HB MET 172 2HB MET 172 -1.367 1.598 1.598 700 2HB MET 172 1HB MET 172 -0.397 1.443 1.443 701 1HG MET 172 2HG MET 172 -2.254 2.143 2.143 702 2HG MET 172 1HG MET 172 -3.149 2.762 2.762 703 1HE MET 172 2HE MET 172 -3.688 0.881 0.881 704 2HE MET 172 1HE MET 172 -4.302 -0.730 -0.730 705 3HE MET 172 3HE MET 172 -2.539 -0.476 -0.476 706 H VAL 173 H VAL 173 -2.288 5.316 5.316 707 HA VAL 173 HA VAL 173 -0.753 6.071 6.071 708 HB VAL 173 HB VAL 173 -3.193 7.388 7.388 709 1HG1 VAL 173 3HG1 VAL 173 -1.229 7.875 7.875 710 2HG1 VAL 173 2HG1 VAL 173 -1.944 9.321 9.321 711 3HG1 VAL 173 1HG1 VAL 173 -3.017 8.167 8.167 712 1HG2 VAL 173 2HG2 VAL 173 -0.153 7.809 7.809 713 2HG2 VAL 173 1HG2 VAL 173 -1.314 7.342 7.342 714 3HG2 VAL 173 3HG2 VAL 173 -1.402 8.977 8.977 715 H LEU 174 H LEU 174 -1.736 5.924 5.924 716 HA LEU 174 HA LEU 174 -4.201 4.404 4.404 717 1HB LEU 174 2HB LEU 174 -1.740 3.353 3.353 718 2HB LEU 174 1HB LEU 174 -1.841 3.793 3.793 719 HG LEU 174 HG LEU 174 -2.633 1.437 1.437 720 1HD1 LEU 174 3HD1 LEU 174 -2.111 1.968 1.968 721 2HD1 LEU 174 2HD1 LEU 174 -3.928 2.004 2.004 722 3HD1 LEU 174 1HD1 LEU 174 -3.088 0.536 0.536 723 1HD2 LEU 174 3HD2 LEU 174 -5.054 2.995 2.995 724 2HD2 LEU 174 2HD2 LEU 174 -4.620 2.509 2.509 725 3HD2 LEU 174 1HD2 LEU 174 -5.087 1.230 1.230 726 H ALA 175 H ALA 175 -5.538 6.197 6.197 727 HA ALA 175 HA ALA 175 -4.694 7.563 7.563 728 1HB ALA 175 1HB ALA 175 -6.004 8.516 8.516 729 2HB ALA 175 3HB ALA 175 -7.377 7.420 7.420 730 3HB ALA 175 2HB ALA 175 -6.921 8.846 8.846 731 HA PRO 176 HA PRO 176 -7.813 5.950 5.950 732 1HB PRO 176 2HB PRO 176 -8.838 8.818 8.818 733 2HB PRO 176 1HB PRO 176 -8.653 7.701 7.701 734 1HG PRO 176 2HG PRO 176 -6.783 9.652 9.652 735 2HG PRO 176 1HG PRO 176 -6.247 7.970 7.970 736 1HD PRO 176 2HD PRO 176 -6.285 9.299 9.299 737 2HD PRO 176 1HD PRO 176 -5.069 8.171 8.171 738 H LYS 177 H LYS 177 -9.855 5.015 5.015 739 HA LYS 177 HA LYS 177 -11.117 5.715 5.715 740 1HB LYS 177 2HB LYS 177 -11.223 3.384 3.384 741 2HB LYS 177 1HB LYS 177 -12.167 4.090 4.090 742 1HG LYS 177 2HG LYS 177 -14.051 4.589 4.589 743 2HG LYS 177 1HG LYS 177 -13.048 4.123 4.123 744 1HD LYS 177 2HD LYS 177 -14.744 2.430 2.430 745 2HD LYS 177 1HD LYS 177 -13.074 1.766 1.766 746 1HE LYS 177 2HE LYS 177 -13.065 1.779 1.779 747 2HE LYS 177 1HE LYS 177 -14.528 2.862 2.862 748 1HZ LYS 177 3HZ LYS 177 -14.469 0.090 0.090 749 2HZ LYS 177 2HZ LYS 177 -15.076 0.581 0.581 750 3HZ LYS 177 1HZ LYS 177 -15.824 1.112 1.112 751 H LYS 178 H LYS 178 -12.724 7.111 7.111 752 HA LYS 178 HA LYS 178 -13.777 8.717 8.717 753 1HB LYS 178 2HB LYS 178 -13.398 9.633 9.633 754 2HB LYS 178 1HB LYS 178 -14.587 8.457 8.457 755 1HG LYS 178 2HG LYS 178 -16.404 9.570 9.570 756 2HG LYS 178 1HG LYS 178 -15.179 10.689 10.689 757 1HD LYS 178 2HD LYS 178 -14.678 11.539 11.539 758 2HD LYS 178 1HD LYS 178 -15.961 10.463 10.463 759 1HE LYS 178 2HE LYS 178 -16.404 12.742 12.742 760 2HE LYS 178 1HE LYS 178 -16.794 12.809 12.809 761 1HZ LYS 178 1HZ LYS 178 -18.325 10.990 10.990 762 2HZ LYS 178 3HZ LYS 178 -17.959 10.924 10.924 763 3HZ LYS 178 2HZ LYS 178 -18.709 12.302 12.302 764 H LYS 179 H LYS 179 -15.095 7.619 7.619 765 HA LYS 179 HA LYS 179 -16.672 5.465 5.465 766 1HB LYS 179 2HB LYS 179 -15.654 5.542 5.542 767 2HB LYS 179 1HB LYS 179 -16.812 6.859 6.859 768 1HG LYS 179 2HG LYS 179 -17.612 4.727 4.727 769 2HG LYS 179 1HG LYS 179 -18.726 5.258 5.258 770 1HD LYS 179 2HD LYS 179 -17.607 3.643 3.643 771 2HD LYS 179 1HD LYS 179 -16.457 3.180 3.180 772 1HE LYS 179 2HE LYS 179 -18.251 1.479 1.479 773 2HE LYS 179 1HE LYS 179 -18.418 2.318 2.318 774 1HZ LYS 179 1HZ LYS 179 -19.941 2.953 2.953 775 2HZ LYS 179 3HZ LYS 179 -20.512 2.067 2.067 776 3HZ LYS 179 2HZ LYS 179 -20.112 3.708 3.708 777 H GLN 180 H GLN 180 -18.636 5.640 5.640 778 HA GLN 180 HA GLN 180 -20.312 7.885 7.885 779 1HB GLN 180 2HB GLN 180 -20.857 8.353 8.353 780 2HB GLN 180 1HB GLN 180 -19.148 8.746 8.746 781 1HG GLN 180 2HG GLN 180 -18.404 6.564 6.564 782 2HG GLN 180 1HG GLN 180 -20.122 6.180 6.180 783 1HE2 GLN 180 1HE2 GLN 180 -17.484 8.615 8.615 784 2HE2 GLN 180 2HE2 GLN 180 -18.008 9.205 9.205 Start of MODEL 20 1 HA VAL 90 HA VAL 90 -2.327 17.130 17.130 2 HB VAL 90 HB VAL 90 -4.017 17.370 17.370 3 1HG1 VAL 90 1HG1 VAL 90 -4.772 18.832 18.832 4 2HG1 VAL 90 3HG1 VAL 90 -5.767 17.435 17.435 5 3HG1 VAL 90 2HG1 VAL 90 -6.154 18.201 18.201 6 1HG2 VAL 90 1HG2 VAL 90 -5.580 15.116 15.116 7 2HG2 VAL 90 3HG2 VAL 90 -4.639 14.962 14.962 8 3HG2 VAL 90 2HG2 VAL 90 -6.110 15.973 15.973 9 H ILE 91 H ILE 91 -3.536 15.480 15.480 10 HA ILE 91 HA ILE 91 -3.025 12.747 12.747 11 HB ILE 91 HB ILE 91 -3.874 13.857 13.857 12 1HG1 ILE 91 2HG1 ILE 91 -5.611 14.251 14.251 13 2HG1 ILE 91 1HG1 ILE 91 -6.111 12.907 12.907 14 1HG2 ILE 91 3HG2 ILE 91 -3.617 10.960 10.960 15 2HG2 ILE 91 2HG2 ILE 91 -4.536 11.427 11.427 16 3HG2 ILE 91 1HG2 ILE 91 -2.766 11.693 11.693 17 1HD1 ILE 91 2HD1 ILE 91 -5.370 11.245 11.245 18 2HD1 ILE 91 1HD1 ILE 91 -4.974 12.620 12.620 19 3HD1 ILE 91 3HD1 ILE 91 -6.677 12.355 12.355 20 H GLN 92 H GLN 92 -1.253 11.654 11.654 21 HA GLN 92 HA GLN 92 1.018 13.203 13.203 22 1HB GLN 92 2HB GLN 92 0.875 10.610 10.610 23 2HB GLN 92 1HB GLN 92 2.288 11.704 11.704 24 1HG GLN 92 2HG GLN 92 1.188 13.398 13.398 25 2HG GLN 92 1HG GLN 92 -0.427 12.657 12.657 26 1HE2 GLN 92 1HE2 GLN 92 -1.238 11.707 11.707 27 2HE2 GLN 92 2HE2 GLN 92 -0.396 10.843 10.843 28 H VAL 93 H VAL 93 2.822 11.848 11.848 29 HA VAL 93 HA VAL 93 1.524 9.778 9.778 30 HB VAL 93 HB VAL 93 4.150 11.195 11.195 31 1HG1 VAL 93 1HG1 VAL 93 2.556 8.835 8.835 32 2HG1 VAL 93 3HG1 VAL 93 3.780 9.722 9.722 33 3HG1 VAL 93 2HG1 VAL 93 4.339 8.782 8.782 34 1HG2 VAL 93 2HG2 VAL 93 1.720 12.201 12.201 35 2HG2 VAL 93 1HG2 VAL 93 2.977 12.014 12.014 36 3HG2 VAL 93 3HG2 VAL 93 1.755 10.715 10.715 37 H LYS 94 H LYS 94 1.740 7.691 7.691 38 HA LYS 94 HA LYS 94 4.602 7.226 7.226 39 1HB LYS 94 2HB LYS 94 2.440 5.167 5.167 40 2HB LYS 94 1HB LYS 94 4.044 5.136 5.136 41 1HG LYS 94 2HG LYS 94 1.814 7.141 7.141 42 2HG LYS 94 1HG LYS 94 2.122 5.645 5.645 43 1HD LYS 94 2HD LYS 94 4.402 6.424 6.424 44 2HD LYS 94 1HD LYS 94 4.181 7.915 7.915 45 1HE LYS 94 2HE LYS 94 2.315 8.650 8.650 46 2HE LYS 94 1HE LYS 94 2.579 7.176 7.176 47 1HZ LYS 94 1HZ LYS 94 4.587 9.288 9.288 48 2HZ LYS 94 3HZ LYS 94 3.708 9.107 9.107 49 3HZ LYS 94 2HZ LYS 94 4.827 7.918 7.918 50 H GLU 95 H GLU 95 5.325 4.987 4.987 51 HA GLU 95 HA GLU 95 4.154 4.767 4.767 52 1HB GLU 95 2HB GLU 95 6.144 6.383 6.383 53 2HB GLU 95 1HB GLU 95 7.053 4.908 4.908 54 1HG GLU 95 2HG GLU 95 6.675 3.904 3.904 55 2HG GLU 95 1HG GLU 95 5.638 5.320 5.320 56 H ILE 96 H ILE 96 4.672 2.677 2.677 57 HA ILE 96 HA ILE 96 6.334 0.891 0.891 58 HB ILE 96 HB ILE 96 3.624 0.680 0.680 59 1HG1 ILE 96 2HG1 ILE 96 3.918 -1.819 -1.819 60 2HG1 ILE 96 1HG1 ILE 96 5.611 -1.668 -1.668 61 1HG2 ILE 96 2HG2 ILE 96 3.273 0.506 0.506 62 2HG2 ILE 96 1HG2 ILE 96 4.072 -1.142 -1.142 63 3HG2 ILE 96 3HG2 ILE 96 2.628 -0.870 -0.870 64 1HD1 ILE 96 3HD1 ILE 96 4.342 -0.227 -0.227 65 2HD1 ILE 96 2HD1 ILE 96 5.445 -1.645 -1.645 66 3HD1 ILE 96 1HD1 ILE 96 6.065 -0.058 -0.058 67 H LYS 97 H LYS 97 7.064 -0.978 -0.978 68 HA LYS 97 HA LYS 97 6.445 -0.205 -0.205 69 1HB LYS 97 2HB LYS 97 8.949 -1.761 -1.761 70 2HB LYS 97 1HB LYS 97 8.295 -1.347 -1.347 71 1HG LYS 97 2HG LYS 97 8.568 1.094 1.094 72 2HG LYS 97 1HG LYS 97 9.384 0.652 0.652 73 1HD LYS 97 2HD LYS 97 11.145 -0.576 -0.576 74 2HD LYS 97 1HD LYS 97 10.328 -0.158 -0.158 75 1HE LYS 97 2HE LYS 97 11.461 1.923 1.923 76 2HE LYS 97 1HE LYS 97 12.304 1.336 1.336 77 1HZ LYS 97 3HZ LYS 97 10.458 2.141 2.141 78 2HZ LYS 97 2HZ LYS 97 9.666 2.698 2.698 79 3HZ LYS 97 1HZ LYS 97 11.146 3.387 3.387 80 H PHE 98 H PHE 98 6.112 -1.937 -1.937 81 HA PHE 98 HA PHE 98 5.925 -4.547 -4.547 82 1HB PHE 98 2HB PHE 98 3.796 -3.205 -3.205 83 2HB PHE 98 1HB PHE 98 3.891 -4.973 -4.973 84 HD1 PHE 98 2HD PHE 98 4.345 -5.578 -5.578 85 HD2 PHE 98 1HD PHE 98 2.032 -2.581 -2.581 86 HE1 PHE 98 2HE PHE 98 3.232 -5.261 -5.261 87 HE2 PHE 98 1HE PHE 98 0.763 -2.293 -2.293 88 HZ PHE 98 HZ PHE 98 1.246 -3.846 -3.846 89 H ARG 99 H ARG 99 6.439 -6.216 -6.216 90 HA ARG 99 HA ARG 99 8.191 -5.528 -5.528 91 1HB ARG 99 2HB ARG 99 9.022 -6.653 -6.653 92 2HB ARG 99 1HB ARG 99 7.819 -7.977 -7.977 93 1HG ARG 99 2HG ARG 99 9.897 -8.905 -8.905 94 2HG ARG 99 1HG ARG 99 9.105 -8.561 -8.561 95 1HD ARG 99 2HD ARG 99 10.501 -6.268 -6.268 96 2HD ARG 99 1HD ARG 99 11.508 -7.158 -7.158 97 HE ARG 99 HE ARG 99 11.195 -7.724 -7.724 98 1HH1 ARG 99 1HH2 ARG 99 12.331 -8.932 -8.932 99 2HH1 ARG 99 2HH2 ARG 99 13.356 -10.149 -10.149 100 1HH2 ARG 99 1HH1 ARG 99 12.578 -9.373 -9.373 101 2HH2 ARG 99 2HH1 ARG 99 13.499 -10.402 -10.402 102 HA PRO 100 HA PRO 100 5.547 -7.709 -7.709 103 1HB PRO 100 2HB PRO 100 7.970 -9.531 -9.531 104 2HB PRO 100 1HB PRO 100 6.974 -8.721 -8.721 105 1HG PRO 100 2HG PRO 100 9.481 -7.810 -7.810 106 2HG PRO 100 1HG PRO 100 8.312 -6.793 -6.793 107 1HD PRO 100 2HD PRO 100 9.032 -6.460 -6.460 108 2HD PRO 100 1HD PRO 100 7.662 -5.636 -5.636 109 H GLY 101 H GLY 101 4.227 -9.299 -9.299 110 1HA GLY 101 2HA GLY 101 2.903 -10.449 -10.449 111 2HA GLY 101 1HA GLY 101 3.586 -11.612 -11.612 112 H THR 102 H THR 102 3.035 -10.726 -10.726 113 HA THR 102 HA THR 102 5.468 -11.744 -11.744 114 HB THR 102 HB THR 102 3.567 -10.189 -10.189 115 HG1 THR 102 1HG THR 102 4.745 -9.176 -9.176 116 1HG2 THR 102 3HG2 THR 102 6.528 -9.850 -9.850 117 2HG2 THR 102 2HG2 THR 102 5.695 -8.882 -8.882 118 3HG2 THR 102 1HG2 THR 102 6.009 -10.633 -10.633 119 H ASP 103 H ASP 103 4.308 -11.648 -11.648 120 HA ASP 103 HA ASP 103 4.166 -14.546 -14.546 121 1HB ASP 103 2HB ASP 103 5.798 -12.509 -12.509 122 2HB ASP 103 1HB ASP 103 4.931 -12.765 -12.765 123 H GLU 104 H GLU 104 3.555 -15.282 -15.282 124 HA GLU 104 HA GLU 104 1.050 -14.098 -14.098 125 1HB GLU 104 2HB GLU 104 1.355 -16.568 -16.568 126 2HB GLU 104 1HB GLU 104 2.582 -16.333 -16.333 127 1HG GLU 104 2HG GLU 104 0.812 -15.342 -15.342 128 2HG GLU 104 1HG GLU 104 -0.401 -15.522 -15.522 129 H GLY 105 H GLY 105 3.882 -14.945 -14.945 130 1HA GLY 105 2HA GLY 105 3.370 -12.360 -12.360 131 2HA GLY 105 1HA GLY 105 4.059 -13.828 -13.828 132 H ASP 106 H ASP 106 4.793 -12.393 -12.393 133 HA ASP 106 HA ASP 106 6.889 -10.855 -10.855 134 1HB ASP 106 2HB ASP 106 7.498 -12.108 -12.108 135 2HB ASP 106 1HB ASP 106 6.447 -10.975 -10.975 136 H TYR 107 H TYR 107 3.987 -11.062 -11.062 137 HA TYR 107 HA TYR 107 4.177 -8.201 -8.201 138 1HB TYR 107 2HB TYR 107 3.535 -10.132 -10.132 139 2HB TYR 107 1HB TYR 107 2.079 -10.319 -10.319 140 HD1 TYR 107 2HD TYR 107 2.196 -6.907 -6.907 141 HD2 TYR 107 1HD TYR 107 1.500 -10.600 -10.600 142 HE1 TYR 107 2HE TYR 107 0.043 -6.034 -6.034 143 HE2 TYR 107 1HE TYR 107 -0.449 -9.619 -9.619 144 HH TYR 107 HH TYR 107 -1.918 -7.888 -7.888 145 H GLN 108 H GLN 108 1.341 -10.242 -10.242 146 HA GLN 108 HA GLN 108 0.155 -8.249 -8.249 147 1HB GLN 108 2HB GLN 108 -0.599 -10.821 -10.821 148 2HB GLN 108 1HB GLN 108 -1.531 -9.536 -9.536 149 1HG GLN 108 2HG GLN 108 0.219 -11.410 -11.410 150 2HG GLN 108 1HG GLN 108 -1.267 -11.916 -11.916 151 1HE2 GLN 108 1HE2 GLN 108 -0.223 -8.617 -8.617 152 2HE2 GLN 108 2HE2 GLN 108 -1.468 -8.463 -8.463 153 H VAL 109 H VAL 109 2.769 -9.647 -9.647 154 HA VAL 109 HA VAL 109 2.321 -8.895 -8.895 155 HB VAL 109 HB VAL 109 4.898 -8.905 -8.905 156 1HG1 VAL 109 1HG1 VAL 109 4.433 -8.385 -8.385 157 2HG1 VAL 109 3HG1 VAL 109 6.010 -8.900 -8.900 158 3HG1 VAL 109 2HG1 VAL 109 5.325 -7.322 -7.322 159 1HG2 VAL 109 2HG2 VAL 109 3.702 -11.113 -11.113 160 2HG2 VAL 109 1HG2 VAL 109 5.342 -10.998 -10.998 161 3HG2 VAL 109 3HG2 VAL 109 3.865 -10.800 -10.800 162 H LYS 110 H LYS 110 3.594 -7.160 -7.160 163 HA LYS 110 HA LYS 110 3.489 -4.656 -4.656 164 1HB LYS 110 2HB LYS 110 4.523 -5.516 -5.516 165 2HB LYS 110 1HB LYS 110 4.492 -3.830 -3.830 166 1HG LYS 110 2HG LYS 110 6.106 -6.173 -6.173 167 2HG LYS 110 1HG LYS 110 6.579 -4.473 -4.473 168 1HD LYS 110 2HD LYS 110 5.723 -3.552 -3.552 169 2HD LYS 110 1HD LYS 110 5.191 -5.183 -5.183 170 1HE LYS 110 2HE LYS 110 7.328 -4.550 -4.550 171 2HE LYS 110 1HE LYS 110 7.580 -5.970 -5.970 172 1HZ LYS 110 1HZ LYS 110 8.418 -4.457 -4.457 173 2HZ LYS 110 3HZ LYS 110 8.188 -3.128 -3.128 174 3HZ LYS 110 2HZ LYS 110 9.307 -4.337 -4.337 175 H LEU 111 H LEU 111 1.293 -6.383 -6.383 176 HA LEU 111 HA LEU 111 -0.118 -4.046 -4.046 177 1HB LEU 111 2HB LEU 111 -0.339 -6.413 -6.413 178 2HB LEU 111 1HB LEU 111 -1.275 -6.829 -6.829 179 HG LEU 111 HG LEU 111 -2.015 -4.461 -4.461 180 1HD1 LEU 111 3HD1 LEU 111 -1.696 -6.446 -6.446 181 2HD1 LEU 111 2HD1 LEU 111 -2.820 -7.401 -7.401 182 3HD1 LEU 111 1HD1 LEU 111 -3.436 -5.987 -5.987 183 1HD2 LEU 111 1HD2 LEU 111 -3.568 -6.326 -6.326 184 2HD2 LEU 111 3HD2 LEU 111 -3.325 -4.540 -4.540 185 3HD2 LEU 111 2HD2 LEU 111 -4.387 -5.217 -5.217 186 H ARG 112 H ARG 112 0.361 -6.247 -6.247 187 HA ARG 112 HA ARG 112 -1.557 -5.076 -5.076 188 1HB ARG 112 2HB ARG 112 -0.234 -7.238 -7.238 189 2HB ARG 112 1HB ARG 112 0.972 -6.129 -6.129 190 1HG ARG 112 2HG ARG 112 -0.848 -5.165 -5.165 191 2HG ARG 112 1HG ARG 112 -1.993 -6.372 -6.372 192 1HD ARG 112 2HD ARG 112 -0.610 -8.233 -8.233 193 2HD ARG 112 1HD ARG 112 0.610 -7.052 -7.052 194 HE ARG 112 HE ARG 112 -2.114 -7.577 -7.577 195 1HH1 ARG 112 1HH2 ARG 112 0.723 -5.398 -5.398 196 2HH1 ARG 112 2HH2 ARG 112 0.345 -4.654 -4.654 197 1HH2 ARG 112 1HH1 ARG 112 -2.599 -6.559 -6.559 198 2HH2 ARG 112 2HH1 ARG 112 -1.561 -5.320 -5.320 199 H SER 113 H SER 113 2.027 -4.118 -4.118 200 HA SER 113 HA SER 113 1.971 -2.169 -2.169 201 1HB SER 113 2HB SER 113 3.516 -2.217 -2.217 202 2HB SER 113 1HB SER 113 3.635 -0.958 -0.958 203 HG SER 113 HG SER 113 4.024 -2.613 -2.613 204 H LEU 114 H LEU 114 0.783 -2.013 -2.013 205 HA LEU 114 HA LEU 114 0.175 0.752 0.752 206 1HB LEU 114 2HB LEU 114 -1.114 -1.698 -1.698 207 2HB LEU 114 1HB LEU 114 -1.554 -0.003 -0.003 208 HG LEU 114 HG LEU 114 1.298 -1.129 -1.129 209 1HD1 LEU 114 3HD1 LEU 114 -0.357 -2.308 -2.308 210 2HD1 LEU 114 2HD1 LEU 114 -0.965 -0.730 -0.730 211 3HD1 LEU 114 1HD1 LEU 114 0.708 -1.266 -1.266 212 1HD2 LEU 114 1HD2 LEU 114 -0.118 1.453 1.453 213 2HD2 LEU 114 3HD2 LEU 114 1.117 1.309 1.309 214 3HD2 LEU 114 2HD2 LEU 114 1.582 1.043 1.043 215 H ILE 115 H ILE 115 -1.882 -2.098 -2.098 216 HA ILE 115 HA ILE 115 -4.202 -0.643 -0.643 217 HB ILE 115 HB ILE 115 -3.608 -2.349 -2.349 218 1HG1 ILE 115 2HG1 ILE 115 -2.889 -3.814 -3.814 219 2HG1 ILE 115 1HG1 ILE 115 -4.392 -4.373 -4.373 220 1HG2 ILE 115 1HG2 ILE 115 -5.941 -1.529 -1.529 221 2HG2 ILE 115 3HG2 ILE 115 -6.116 -2.749 -2.749 222 3HG2 ILE 115 2HG2 ILE 115 -5.629 -1.065 -1.065 223 1HD1 ILE 115 3HD1 ILE 115 -5.715 -3.387 -3.387 224 2HD1 ILE 115 2HD1 ILE 115 -4.097 -2.981 -2.981 225 3HD1 ILE 115 1HD1 ILE 115 -4.586 -4.710 -4.710 226 H ARG 116 H ARG 116 -1.661 -1.093 -1.093 227 HA ARG 116 HA ARG 116 -2.589 0.349 0.349 228 1HB ARG 116 2HB ARG 116 -0.454 -1.216 -1.216 229 2HB ARG 116 1HB ARG 116 0.391 0.325 0.325 230 1HG ARG 116 2HG ARG 116 0.684 -0.193 -0.193 231 2HG ARG 116 1HG ARG 116 -0.412 1.228 1.228 232 1HD ARG 116 2HD ARG 116 -2.382 -0.218 -0.218 233 2HD ARG 116 1HD ARG 116 -1.363 -1.706 -1.706 234 HE ARG 116 HE ARG 116 -1.425 0.348 0.348 235 1HH1 ARG 116 1HH1 ARG 116 0.133 -2.565 -2.565 236 2HH1 ARG 116 2HH1 ARG 116 0.853 -3.047 -3.047 237 1HH2 ARG 116 1HH2 ARG 116 -0.446 -0.331 -0.331 238 2HH2 ARG 116 2HH2 ARG 116 0.520 -1.767 -1.767 239 H PHE 117 H PHE 117 -0.633 1.538 1.538 240 HA PHE 117 HA PHE 117 -0.266 4.062 4.062 241 1HB PHE 117 2HB PHE 117 -0.727 2.941 2.941 242 2HB PHE 117 1HB PHE 117 0.026 4.531 4.531 243 HD1 PHE 117 2HD PHE 117 1.348 2.471 2.471 244 HD2 PHE 117 1HD PHE 117 1.175 3.042 3.042 245 HE1 PHE 117 2HE PHE 117 3.666 1.663 1.663 246 HE2 PHE 117 1HE PHE 117 3.509 2.109 2.109 247 HZ PHE 117 HZ PHE 117 4.757 1.462 1.462 248 H LEU 118 H LEU 118 -2.935 2.795 2.795 249 HA LEU 118 HA LEU 118 -4.463 5.150 5.150 250 1HB LEU 118 2HB LEU 118 -4.818 2.229 2.229 251 2HB LEU 118 1HB LEU 118 -6.233 3.358 3.358 252 HG LEU 118 HG LEU 118 -3.736 4.519 4.519 253 1HD1 LEU 118 2HD1 LEU 118 -4.168 1.823 1.823 254 2HD1 LEU 118 1HD1 LEU 118 -4.566 2.957 2.957 255 3HD1 LEU 118 3HD1 LEU 118 -2.957 3.100 3.100 256 1HD2 LEU 118 1HD2 LEU 118 -6.115 5.359 5.359 257 2HD2 LEU 118 3HD2 LEU 118 -5.130 5.332 5.332 258 3HD2 LEU 118 2HD2 LEU 118 -6.442 4.120 4.120 259 H GLU 119 H GLU 119 -4.253 2.771 2.771 260 HA GLU 119 HA GLU 119 -6.697 3.341 3.341 261 1HB GLU 119 2HB GLU 119 -4.102 2.018 2.018 262 2HB GLU 119 1HB GLU 119 -5.317 2.489 2.489 263 1HG GLU 119 2HG GLU 119 -6.992 0.977 0.977 264 2HG GLU 119 1HG GLU 119 -5.861 0.565 0.565 265 H GLU 120 H GLU 120 -3.300 4.527 4.527 266 HA GLU 120 HA GLU 120 -3.815 6.284 6.284 267 1HB GLU 120 2HB GLU 120 -1.847 6.882 6.882 268 2HB GLU 120 1HB GLU 120 -1.843 7.559 7.559 269 1HG GLU 120 2HG GLU 120 -1.322 5.168 5.168 270 2HG GLU 120 1HG GLU 120 -1.086 4.715 4.715 271 H GLY 121 H GLY 121 -4.570 6.309 6.309 272 1HA GLY 121 2HA GLY 121 -5.785 7.692 7.692 273 2HA GLY 121 1HA GLY 121 -5.721 8.913 8.913 274 H ASP 122 H ASP 122 -3.559 7.063 7.063 275 HA ASP 122 HA ASP 122 -2.261 9.595 9.595 276 1HB ASP 122 2HB ASP 122 -0.891 6.890 6.890 277 2HB ASP 122 1HB ASP 122 -0.146 8.509 8.509 278 H LYS 123 H LYS 123 -1.426 9.304 9.304 279 HA LYS 123 HA LYS 123 -3.176 7.534 7.534 280 1HB LYS 123 2HB LYS 123 -3.450 9.941 9.941 281 2HB LYS 123 1HB LYS 123 -1.665 10.119 10.119 282 1HG LYS 123 2HG LYS 123 -2.719 7.997 7.997 283 2HG LYS 123 1HG LYS 123 -3.256 9.670 9.670 284 1HD LYS 123 2HD LYS 123 -0.326 8.719 8.719 285 2HD LYS 123 1HD LYS 123 -1.270 9.245 9.245 286 1HE LYS 123 2HE LYS 123 -1.680 11.447 11.447 287 2HE LYS 123 1HE LYS 123 -0.215 10.843 10.843 288 1HZ LYS 123 2HZ LYS 123 0.980 10.757 10.757 289 2HZ LYS 123 1HZ LYS 123 -0.382 11.291 11.291 290 3HZ LYS 123 3HZ LYS 123 0.381 12.325 12.325 291 H ALA 124 H ALA 124 -2.074 5.742 5.742 292 HA ALA 124 HA ALA 124 0.817 5.972 5.972 293 1HB ALA 124 3HB ALA 124 -0.382 3.910 3.910 294 2HB ALA 124 2HB ALA 124 -0.896 3.584 3.584 295 3HB ALA 124 1HB ALA 124 0.864 3.565 3.565 296 H LYS 125 H LYS 125 2.178 5.665 5.665 297 HA LYS 125 HA LYS 125 0.413 5.311 5.311 298 1HB LYS 125 2HB LYS 125 1.418 7.637 7.637 299 2HB LYS 125 1HB LYS 125 2.994 6.916 6.916 300 1HG LYS 125 2HG LYS 125 3.466 6.213 6.213 301 2HG LYS 125 1HG LYS 125 1.820 6.693 6.693 302 1HD LYS 125 2HD LYS 125 3.798 8.661 8.661 303 2HD LYS 125 1HD LYS 125 3.826 8.305 8.305 304 1HE LYS 125 2HE LYS 125 1.513 9.107 9.107 305 2HE LYS 125 1HE LYS 125 1.375 9.436 9.436 306 1HZ LYS 125 2HZ LYS 125 3.314 10.688 10.688 307 2HZ LYS 125 1HZ LYS 125 1.908 11.401 11.401 308 3HZ LYS 125 3HZ LYS 125 3.189 10.994 10.994 309 H ILE 126 H ILE 126 0.912 3.481 3.481 310 HA ILE 126 HA ILE 126 3.130 1.871 1.871 311 HB ILE 126 HB ILE 126 1.347 1.652 1.652 312 1HG1 ILE 126 2HG1 ILE 126 -0.290 1.931 1.931 313 2HG1 ILE 126 1HG1 ILE 126 -0.109 0.175 0.175 314 1HG2 ILE 126 2HG2 ILE 126 2.922 -0.267 -0.267 315 2HG2 ILE 126 1HG2 ILE 126 1.812 -0.745 -0.745 316 3HG2 ILE 126 3HG2 ILE 126 3.326 0.137 0.137 317 1HD1 ILE 126 1HD1 ILE 126 1.343 0.029 0.029 318 2HD1 ILE 126 3HD1 ILE 126 0.957 1.758 1.758 319 3HD1 ILE 126 2HD1 ILE 126 -0.354 0.523 0.523 320 H THR 127 H THR 127 5.103 1.767 1.767 321 HA THR 127 HA THR 127 5.170 3.058 3.058 322 HB THR 127 HB THR 127 7.539 2.447 2.447 323 HG1 THR 127 1HG THR 127 6.263 4.049 4.049 324 1HG2 THR 127 1HG2 THR 127 7.056 3.988 3.988 325 2HG2 THR 127 3HG2 THR 127 8.597 4.095 4.095 326 3HG2 THR 127 2HG2 THR 127 8.089 2.520 2.520 327 H LEU 128 H LEU 128 4.992 1.555 1.555 328 HA LEU 128 HA LEU 128 5.986 -1.124 -1.124 329 1HB LEU 128 2HB LEU 128 4.097 -0.106 -0.106 330 2HB LEU 128 1HB LEU 128 5.461 -0.505 -0.505 331 HG LEU 128 HG LEU 128 4.318 -2.393 -2.393 332 1HD1 LEU 128 2HD1 LEU 128 2.582 -1.324 -1.324 333 2HD1 LEU 128 1HD1 LEU 128 3.266 -2.292 -2.292 334 3HD1 LEU 128 3HD1 LEU 128 2.621 -3.133 -3.133 335 1HD2 LEU 128 3HD2 LEU 128 5.866 -3.099 -3.099 336 2HD2 LEU 128 2HD2 LEU 128 6.349 -3.375 -3.375 337 3HD2 LEU 128 1HD2 LEU 128 4.952 -4.282 -4.282 338 H ARG 129 H ARG 129 7.644 -2.080 -2.080 339 HA ARG 129 HA ARG 129 9.470 -0.409 -0.409 340 1HB ARG 129 2HB ARG 129 10.202 -0.152 -0.152 341 2HB ARG 129 1HB ARG 129 10.144 -1.938 -1.938 342 1HG ARG 129 2HG ARG 129 11.967 -2.199 -2.199 343 2HG ARG 129 1HG ARG 129 11.848 -0.472 -0.472 344 1HD ARG 129 2HD ARG 129 12.743 -1.503 -1.503 345 2HD ARG 129 1HD ARG 129 13.871 -1.009 -1.009 346 HE ARG 129 HE ARG 129 11.862 0.802 0.802 347 1HH1 ARG 129 1HH1 ARG 129 14.908 0.374 0.374 348 2HH1 ARG 129 2HH1 ARG 129 15.369 2.038 2.038 349 1HH2 ARG 129 1HH2 ARG 129 12.511 3.019 3.019 350 2HH2 ARG 129 2HH2 ARG 129 13.996 3.554 3.554 351 H PHE 130 H PHE 130 9.291 -1.514 -1.514 352 HA PHE 130 HA PHE 130 8.252 -4.191 -4.191 353 1HB PHE 130 2HB PHE 130 9.321 -2.075 -2.075 354 2HB PHE 130 1HB PHE 130 8.752 -3.764 -3.764 355 HD1 PHE 130 2HD PHE 130 6.602 -4.583 -4.583 356 HD2 PHE 130 1HD PHE 130 7.783 -0.529 -0.529 357 HE1 PHE 130 2HE PHE 130 4.321 -3.894 -3.894 358 HE2 PHE 130 1HE PHE 130 5.398 0.151 0.151 359 HZ PHE 130 HZ PHE 130 3.675 -1.636 -1.636 360 H ARG 131 H ARG 131 9.519 -5.706 -5.706 361 HA ARG 131 HA ARG 131 11.666 -6.421 -6.421 362 1HB ARG 131 2HB ARG 131 9.891 -7.930 -7.930 363 2HB ARG 131 1HB ARG 131 11.086 -7.867 -7.867 364 1HG ARG 131 2HG ARG 131 12.793 -8.939 -8.939 365 2HG ARG 131 1HG ARG 131 11.678 -8.794 -8.794 366 1HD ARG 131 2HD ARG 131 10.073 -10.381 -10.381 367 2HD ARG 131 1HD ARG 131 11.181 -10.536 -10.536 368 HE ARG 131 HE ARG 131 12.707 -11.046 -11.046 369 1HH1 ARG 131 1HH2 ARG 131 9.999 -12.394 -12.394 370 2HH1 ARG 131 2HH2 ARG 131 10.319 -14.041 -14.041 371 1HH2 ARG 131 1HH1 ARG 131 13.139 -13.285 -13.285 372 2HH2 ARG 131 2HH1 ARG 131 12.132 -14.554 -14.554 373 H GLY 132 H GLY 132 11.500 -4.633 -4.633 374 1HA GLY 132 2HA GLY 132 13.893 -3.590 -3.590 375 2HA GLY 132 1HA GLY 132 14.156 -4.851 -4.851 376 H ARG 133 H ARG 133 11.124 -4.095 -4.095 377 HA ARG 133 HA ARG 133 9.925 -3.786 -3.786 378 1HB ARG 133 2HB ARG 133 10.390 -1.298 -1.298 379 2HB ARG 133 1HB ARG 133 11.776 -1.495 -1.495 380 1HG ARG 133 2HG ARG 133 10.054 -2.293 -2.293 381 2HG ARG 133 1HG ARG 133 8.777 -1.921 -1.921 382 1HD ARG 133 2HD ARG 133 9.041 -0.011 -0.011 383 2HD ARG 133 1HD ARG 133 9.672 0.488 0.488 384 HE ARG 133 HE ARG 133 11.592 -0.675 -0.675 385 1HH1 ARG 133 1HH2 ARG 133 10.348 2.198 2.198 386 2HH1 ARG 133 2HH2 ARG 133 11.722 3.181 3.181 387 1HH2 ARG 133 1HH1 ARG 133 13.421 0.672 0.672 388 2HH2 ARG 133 2HH1 ARG 133 13.487 2.307 2.307 389 H GLU 134 H GLU 134 11.581 -5.848 -5.848 390 HA GLU 134 HA GLU 134 13.027 -5.858 -5.858 391 1HB GLU 134 2HB GLU 134 13.493 -8.287 -8.287 392 2HB GLU 134 1HB GLU 134 14.263 -7.042 -7.042 393 1HG GLU 134 2HG GLU 134 12.534 -7.417 -7.417 394 2HG GLU 134 1HG GLU 134 11.793 -8.727 -8.727 395 H MET 135 H MET 135 10.297 -7.448 -7.448 396 HA MET 135 HA MET 135 9.101 -8.056 -8.056 397 1HB MET 135 2HB MET 135 9.000 -9.775 -9.775 398 2HB MET 135 1HB MET 135 8.068 -8.627 -8.627 399 1HG MET 135 2HG MET 135 6.262 -8.594 -8.594 400 2HG MET 135 1HG MET 135 7.216 -9.783 -9.783 401 1HE MET 135 3HE MET 135 7.474 -12.184 -12.184 402 2HE MET 135 2HE MET 135 8.327 -11.892 -11.892 403 3HE MET 135 1HE MET 135 6.974 -13.069 -13.069 404 H ALA 136 H ALA 136 8.204 -6.416 -6.416 405 HA ALA 136 HA ALA 136 6.578 -4.467 -4.467 406 1HB ALA 136 1HB ALA 136 5.268 -6.660 -6.660 407 2HB ALA 136 3HB ALA 136 5.342 -6.666 -6.666 408 3HB ALA 136 2HB ALA 136 4.425 -5.374 -5.374 409 H HIS 137 H HIS 137 4.830 -5.325 -5.325 410 HA HIS 137 HA HIS 137 4.908 -2.672 -2.672 411 1HB HIS 137 2HB HIS 137 4.697 -3.554 -3.554 412 2HB HIS 137 1HB HIS 137 3.646 -2.228 -2.228 413 HD1 HIS 137 1HD HIS 137 5.444 -0.758 -0.758 414 HD2 HIS 137 2HD HIS 137 6.708 -1.815 -1.815 415 HE1 HIS 137 1HE HIS 137 7.260 0.893 0.893 416 H GLN 138 H GLN 138 2.738 -4.502 -4.502 417 HA GLN 138 HA GLN 138 0.685 -3.379 -3.379 418 1HB GLN 138 2HB GLN 138 0.440 -4.746 -4.746 419 2HB GLN 138 1HB GLN 138 -0.864 -3.836 -3.836 420 1HG GLN 138 2HG GLN 138 0.588 -1.741 -1.741 421 2HG GLN 138 1HG GLN 138 1.771 -2.676 -2.676 422 1HE2 GLN 138 1HE2 GLN 138 1.461 -2.720 -2.720 423 2HE2 GLN 138 2HE2 GLN 138 -0.013 -2.350 -2.350 424 H GLN 139 H GLN 139 2.022 -6.236 -6.236 425 HA GLN 139 HA GLN 139 -0.196 -7.950 -7.950 426 1HB GLN 139 2HB GLN 139 2.760 -8.830 -8.830 427 2HB GLN 139 1HB GLN 139 1.300 -9.844 -9.844 428 1HG GLN 139 2HG GLN 139 2.278 -7.671 -7.671 429 2HG GLN 139 1HG GLN 139 2.451 -9.452 -9.452 430 1HE2 GLN 139 1HE2 GLN 139 0.584 -6.801 -6.801 431 2HE2 GLN 139 2HE2 GLN 139 -0.909 -7.588 -7.588 432 H ILE 140 H ILE 140 3.056 -6.991 -6.991 433 HA ILE 140 HA ILE 140 3.565 -8.108 -8.108 434 HB ILE 140 HB ILE 140 4.500 -5.562 -5.562 435 1HG1 ILE 140 2HG1 ILE 140 5.009 -8.545 -8.545 436 2HG1 ILE 140 1HG1 ILE 140 4.717 -7.169 -7.169 437 1HG2 ILE 140 3HG2 ILE 140 5.396 -7.401 -7.401 438 2HG2 ILE 140 2HG2 ILE 140 6.548 -6.251 -6.251 439 3HG2 ILE 140 1HG2 ILE 140 5.169 -5.598 -5.598 440 1HD1 ILE 140 1HD1 ILE 140 6.982 -6.267 -6.267 441 2HD1 ILE 140 3HD1 ILE 140 7.313 -7.924 -7.924 442 3HD1 ILE 140 2HD1 ILE 140 6.929 -7.665 -7.665 443 H GLY 141 H GLY 141 2.209 -4.936 -4.936 444 1HA GLY 141 2HA GLY 141 2.341 -4.313 -4.313 445 2HA GLY 141 1HA GLY 141 1.674 -3.280 -3.280 446 H MET 142 H MET 142 -0.278 -4.847 -4.847 447 HA MET 142 HA MET 142 -2.157 -4.123 -4.123 448 1HB MET 142 2HB MET 142 -2.506 -5.239 -5.239 449 2HB MET 142 1HB MET 142 -3.898 -4.638 -4.638 450 1HG MET 142 2HG MET 142 -2.679 -2.359 -2.359 451 2HG MET 142 1HG MET 142 -1.746 -2.900 -2.900 452 1HE MET 142 3HE MET 142 -2.606 -3.484 -3.484 453 2HE MET 142 2HE MET 142 -3.659 -4.784 -4.784 454 3HE MET 142 1HE MET 142 -4.330 -3.579 -3.579 455 H GLU 143 H GLU 143 -0.660 -7.256 -7.256 456 HA GLU 143 HA GLU 143 -2.882 -8.288 -8.288 457 1HB GLU 143 2HB GLU 143 -0.697 -9.689 -9.689 458 2HB GLU 143 1HB GLU 143 -0.092 -9.216 -9.216 459 1HG GLU 143 2HG GLU 143 -1.118 -11.220 -11.220 460 2HG GLU 143 1HG GLU 143 -2.505 -10.162 -10.162 461 H VAL 144 H VAL 144 0.209 -6.971 -6.971 462 HA VAL 144 HA VAL 144 -0.287 -7.554 -7.554 463 HB VAL 144 HB VAL 144 1.658 -5.539 -5.539 464 1HG1 VAL 144 2HG1 VAL 144 1.228 -7.202 -7.202 465 2HG1 VAL 144 1HG1 VAL 144 2.821 -6.522 -6.522 466 3HG1 VAL 144 3HG1 VAL 144 1.433 -5.412 -5.412 467 1HG2 VAL 144 2HG2 VAL 144 1.242 -8.545 -8.545 468 2HG2 VAL 144 1HG2 VAL 144 1.770 -7.620 -7.620 469 3HG2 VAL 144 3HG2 VAL 144 2.947 -7.855 -7.855 470 H LEU 145 H LEU 145 -0.177 -4.456 -4.456 471 HA LEU 145 HA LEU 145 -1.059 -2.707 -2.707 472 1HB LEU 145 2HB LEU 145 -1.601 -2.966 -2.966 473 2HB LEU 145 1HB LEU 145 -2.100 -1.539 -1.539 474 HG LEU 145 HG LEU 145 0.689 -2.565 -2.565 475 1HD1 LEU 145 2HD1 LEU 145 -0.932 -0.019 -0.019 476 2HD1 LEU 145 1HD1 LEU 145 0.841 -0.151 -0.151 477 3HD1 LEU 145 3HD1 LEU 145 -0.330 -1.259 -1.259 478 1HD2 LEU 145 3HD2 LEU 145 -0.099 -0.639 -0.639 479 2HD2 LEU 145 2HD2 LEU 145 0.911 -2.100 -2.100 480 3HD2 LEU 145 1HD2 LEU 145 1.554 -0.634 -0.634 481 H ASN 146 H ASN 146 -3.036 -4.289 -4.289 482 HA ASN 146 HA ASN 146 -5.603 -3.472 -3.472 483 1HB ASN 146 2HB ASN 146 -4.414 -4.684 -4.684 484 2HB ASN 146 1HB ASN 146 -5.196 -6.109 -6.109 485 1HD2 ASN 146 1HD2 ASN 146 -5.830 -6.405 -6.405 486 2HD2 ASN 146 2HD2 ASN 146 -7.211 -5.687 -5.687 487 H ARG 147 H ARG 147 -3.664 -6.383 -6.383 488 HA ARG 147 HA ARG 147 -5.872 -7.185 -7.185 489 1HB ARG 147 2HB ARG 147 -4.567 -8.755 -8.755 490 2HB ARG 147 1HB ARG 147 -3.027 -7.934 -7.934 491 1HG ARG 147 2HG ARG 147 -3.015 -8.996 -8.996 492 2HG ARG 147 1HG ARG 147 -4.847 -9.051 -9.051 493 1HD ARG 147 2HD ARG 147 -3.771 -11.364 -11.364 494 2HD ARG 147 1HD ARG 147 -4.641 -10.975 -10.975 495 HE ARG 147 HE ARG 147 -2.053 -9.957 -9.957 496 1HH1 ARG 147 1HH2 ARG 147 -3.414 -13.129 -13.129 497 2HH1 ARG 147 2HH2 ARG 147 -2.055 -14.033 -14.033 498 1HH2 ARG 147 1HH1 ARG 147 -0.231 -11.192 -11.192 499 2HH2 ARG 147 2HH1 ARG 147 -0.222 -12.918 -12.918 500 H VAL 148 H VAL 148 -3.303 -4.693 -4.693 501 HA VAL 148 HA VAL 148 -3.183 -5.138 -5.138 502 HB VAL 148 HB VAL 148 -2.681 -2.522 -2.522 503 1HG1 VAL 148 2HG1 VAL 148 -2.670 -3.267 -3.267 504 2HG1 VAL 148 1HG1 VAL 148 -1.189 -4.196 -4.196 505 3HG1 VAL 148 3HG1 VAL 148 -1.215 -2.385 -2.385 506 1HG2 VAL 148 3HG2 VAL 148 -0.762 -4.861 -4.861 507 2HG2 VAL 148 2HG2 VAL 148 -1.498 -3.951 -3.951 508 3HG2 VAL 148 1HG2 VAL 148 -0.341 -3.123 -3.123 509 H LYS 149 H LYS 149 -4.907 -2.866 -2.866 510 HA LYS 149 HA LYS 149 -6.382 -1.386 -1.386 511 1HB LYS 149 2HB LYS 149 -6.256 -1.326 -1.326 512 2HB LYS 149 1HB LYS 149 -7.182 -2.865 -2.865 513 1HG LYS 149 2HG LYS 149 -9.102 -2.079 -2.079 514 2HG LYS 149 1HG LYS 149 -8.518 -0.485 -0.485 515 1HD LYS 149 2HD LYS 149 -8.370 -1.328 -1.328 516 2HD LYS 149 1HD LYS 149 -9.914 -0.569 -0.569 517 1HE LYS 149 2HE LYS 149 -8.518 1.530 1.530 518 2HE LYS 149 1HE LYS 149 -7.259 0.638 0.638 519 1HZ LYS 149 2HZ LYS 149 -8.871 0.375 0.375 520 2HZ LYS 149 1HZ LYS 149 -10.066 1.172 1.172 521 3HZ LYS 149 3HZ LYS 149 -8.686 2.017 2.017 522 H ASP 150 H ASP 150 -7.115 -4.692 -4.692 523 HA ASP 150 HA ASP 150 -9.733 -4.684 -4.684 524 1HB ASP 150 2HB ASP 150 -7.788 -6.529 -6.529 525 2HB ASP 150 1HB ASP 150 -9.186 -7.191 -7.191 526 H ASP 151 H ASP 151 -6.586 -6.173 -6.173 527 HA ASP 151 HA ASP 151 -8.186 -7.083 -7.083 528 1HB ASP 151 2HB ASP 151 -5.992 -8.049 -8.049 529 2HB ASP 151 1HB ASP 151 -5.202 -6.724 -6.724 530 H LEU 152 H LEU 152 -6.808 -3.848 -3.848 531 HA LEU 152 HA LEU 152 -6.739 -3.205 -3.205 532 1HB LEU 152 2HB LEU 152 -5.938 -1.888 -1.888 533 2HB LEU 152 1HB LEU 152 -7.167 -0.930 -0.930 534 HG LEU 152 HG LEU 152 -5.044 -0.084 -0.084 535 1HD1 LEU 152 1HD1 LEU 152 -6.543 -0.212 -0.212 536 2HD1 LEU 152 3HD1 LEU 152 -5.875 -1.779 -1.779 537 3HD1 LEU 152 2HD1 LEU 152 -4.814 -0.347 -0.347 538 1HD2 LEU 152 1HD2 LEU 152 -4.271 -2.998 -2.998 539 2HD2 LEU 152 3HD2 LEU 152 -3.624 -1.643 -1.643 540 3HD2 LEU 152 2HD2 LEU 152 -3.243 -1.708 -1.708 541 H GLN 153 H GLN 153 -8.957 -2.862 -2.862 542 HA GLN 153 HA GLN 153 -10.469 -1.058 -1.058 543 1HB GLN 153 2HB GLN 153 -10.439 -3.501 -3.501 544 2HB GLN 153 1HB GLN 153 -11.874 -3.682 -3.682 545 1HG GLN 153 2HG GLN 153 -12.891 -1.708 -1.708 546 2HG GLN 153 1HG GLN 153 -11.259 -1.545 -1.545 547 1HE2 GLN 153 1HE2 GLN 153 -13.514 -4.314 -4.314 548 2HE2 GLN 153 2HE2 GLN 153 -13.469 -5.031 -5.031 549 H GLU 154 H GLU 154 -10.536 -3.032 -3.032 550 HA GLU 154 HA GLU 154 -12.972 -2.637 -2.637 551 1HB GLU 154 2HB GLU 154 -10.360 -2.681 -2.681 552 2HB GLU 154 1HB GLU 154 -11.906 -3.474 -3.474 553 1HG GLU 154 2HG GLU 154 -11.391 -5.084 -5.084 554 2HG GLU 154 1HG GLU 154 -9.819 -4.189 -4.189 555 H LEU 155 H LEU 155 -9.934 -1.003 -1.003 556 HA LEU 155 HA LEU 155 -11.080 1.088 1.088 557 1HB LEU 155 2HB LEU 155 -8.411 -0.310 -0.310 558 2HB LEU 155 1HB LEU 155 -8.307 1.473 1.473 559 HG LEU 155 HG LEU 155 -9.989 1.175 1.175 560 1HD1 LEU 155 1HD1 LEU 155 -8.349 -1.450 -1.450 561 2HD1 LEU 155 3HD1 LEU 155 -9.297 -0.824 -0.824 562 3HD1 LEU 155 2HD1 LEU 155 -10.142 -1.308 -1.308 563 1HD2 LEU 155 2HD2 LEU 155 -7.815 2.361 2.361 564 2HD2 LEU 155 1HD2 LEU 155 -8.011 1.384 1.384 565 3HD2 LEU 155 3HD2 LEU 155 -6.937 0.794 0.794 566 H ALA 156 H ALA 156 -8.851 0.384 0.384 567 HA ALA 156 HA ALA 156 -8.440 3.308 3.308 568 1HB ALA 156 3HB ALA 156 -6.366 1.847 1.847 569 2HB ALA 156 2HB ALA 156 -6.869 1.027 1.027 570 3HB ALA 156 1HB ALA 156 -6.476 2.762 2.762 571 H VAL 157 H VAL 157 -9.085 4.053 4.053 572 HA VAL 157 HA VAL 157 -8.225 1.780 1.780 573 HB VAL 157 HB VAL 157 -9.495 2.743 2.743 574 1HG1 VAL 157 2HG1 VAL 157 -11.173 2.476 2.476 575 2HG1 VAL 157 1HG1 VAL 157 -11.824 2.492 2.492 576 3HG1 VAL 157 3HG1 VAL 157 -10.715 1.159 1.159 577 1HG2 VAL 157 3HG2 VAL 157 -9.137 5.274 5.274 578 2HG2 VAL 157 2HG2 VAL 157 -10.726 4.844 4.844 579 3HG2 VAL 157 1HG2 VAL 157 -10.508 4.887 4.887 580 H VAL 158 H VAL 158 -7.770 2.264 2.264 581 HA VAL 158 HA VAL 158 -5.461 3.939 3.939 582 HB VAL 158 HB VAL 158 -6.835 2.720 2.720 583 1HG1 VAL 158 2HG1 VAL 158 -4.744 4.094 4.094 584 2HG1 VAL 158 1HG1 VAL 158 -3.883 2.954 2.954 585 3HG1 VAL 158 3HG1 VAL 158 -4.560 2.379 2.379 586 1HG2 VAL 158 3HG2 VAL 158 -5.123 1.122 1.122 587 2HG2 VAL 158 2HG2 VAL 158 -6.861 0.845 0.845 588 3HG2 VAL 158 1HG2 VAL 158 -5.619 0.554 0.554 589 H GLU 159 H GLU 159 -5.352 5.746 5.746 590 HA GLU 159 HA GLU 159 -7.704 7.324 7.324 591 1HB GLU 159 2HB GLU 159 -5.445 8.109 8.109 592 2HB GLU 159 1HB GLU 159 -4.902 7.593 7.593 593 1HG GLU 159 2HG GLU 159 -6.399 9.404 9.404 594 2HG GLU 159 1HG GLU 159 -6.885 9.887 9.887 595 H SER 160 H SER 160 -5.498 5.507 5.507 596 HA SER 160 HA SER 160 -7.198 6.084 6.084 597 1HB SER 160 2HB SER 160 -5.058 7.317 7.317 598 2HB SER 160 1HB SER 160 -4.215 5.717 5.717 599 HG SER 160 HG SER 160 -5.481 5.447 5.447 600 H PHE 161 H PHE 161 -6.654 4.172 4.172 601 HA PHE 161 HA PHE 161 -5.086 2.316 2.316 602 1HB PHE 161 2HB PHE 161 -7.463 1.424 1.424 603 2HB PHE 161 1HB PHE 161 -7.111 1.169 1.169 604 HD1 PHE 161 2HD PHE 161 -5.863 0.603 0.603 605 HD2 PHE 161 1HD PHE 161 -6.323 -1.061 -1.061 606 HE1 PHE 161 2HE PHE 161 -4.330 -1.146 -1.146 607 HE2 PHE 161 1HE PHE 161 -4.776 -2.792 -2.792 608 HZ PHE 161 HZ PHE 161 -3.544 -2.725 -2.725 609 HA PRO 162 HA PRO 162 -3.852 4.956 4.956 610 1HB PRO 162 2HB PRO 162 -0.932 4.252 4.252 611 2HB PRO 162 1HB PRO 162 -1.734 5.772 5.772 612 1HG PRO 162 2HG PRO 162 -0.738 3.731 3.731 613 2HG PRO 162 1HG PRO 162 -2.041 4.911 4.911 614 1HD PRO 162 2HD PRO 162 -2.248 2.006 2.006 615 2HD PRO 162 1HD PRO 162 -3.329 3.032 3.032 616 H THR 163 H THR 163 -1.995 1.878 1.878 617 HA THR 163 HA THR 163 -0.296 1.744 1.744 618 HB THR 163 HB THR 163 -2.791 1.038 1.038 619 HG1 THR 163 1HG THR 163 -3.015 -0.516 -0.516 620 1HG2 THR 163 3HG2 THR 163 -0.497 -0.111 -0.111 621 2HG2 THR 163 2HG2 THR 163 -0.275 -0.487 -0.487 622 3HG2 THR 163 1HG2 THR 163 -1.557 -1.339 -1.339 623 H LYS 164 H LYS 164 -0.728 4.113 4.113 624 HA LYS 164 HA LYS 164 0.360 4.323 4.323 625 1HB LYS 164 2HB LYS 164 -1.486 6.019 6.019 626 2HB LYS 164 1HB LYS 164 -0.527 6.659 6.659 627 1HG LYS 164 2HG LYS 164 1.280 7.352 7.352 628 2HG LYS 164 1HG LYS 164 0.337 6.638 6.638 629 1HD LYS 164 2HD LYS 164 -1.524 8.230 8.230 630 2HD LYS 164 1HD LYS 164 -0.633 8.928 8.928 631 1HE LYS 164 2HE LYS 164 0.377 8.987 8.987 632 2HE LYS 164 1HE LYS 164 -0.446 10.355 10.355 633 1HZ LYS 164 3HZ LYS 164 2.089 9.053 9.053 634 2HZ LYS 164 2HZ LYS 164 1.942 10.545 10.545 635 3HZ LYS 164 1HZ LYS 164 1.318 10.356 10.356 636 H ILE 165 H ILE 165 2.100 2.980 2.980 637 HA ILE 165 HA ILE 165 3.481 3.935 3.935 638 HB ILE 165 HB ILE 165 4.553 2.185 2.185 639 1HG1 ILE 165 2HG1 ILE 165 2.604 1.406 1.406 640 2HG1 ILE 165 1HG1 ILE 165 2.232 1.390 1.390 641 1HG2 ILE 165 1HG2 ILE 165 5.106 2.417 2.417 642 2HG2 ILE 165 3HG2 ILE 165 5.741 1.067 1.067 643 3HG2 ILE 165 2HG2 ILE 165 6.244 2.737 2.737 644 1HD1 ILE 165 3HD1 ILE 165 4.324 -0.446 -0.446 645 2HD1 ILE 165 2HD1 ILE 165 2.696 -0.926 -0.926 646 3HD1 ILE 165 1HD1 ILE 165 3.900 -0.366 -0.366 647 H GLU 166 H GLU 166 5.318 4.920 4.920 648 HA GLU 166 HA GLU 166 6.240 6.549 6.549 649 1HB GLU 166 2HB GLU 166 6.217 7.283 7.283 650 2HB GLU 166 1HB GLU 166 7.074 8.197 8.197 651 1HG GLU 166 2HG GLU 166 4.022 7.707 7.707 652 2HG GLU 166 1HG GLU 166 4.932 9.237 9.237 653 H GLY 167 H GLY 167 8.060 5.424 5.424 654 1HA GLY 167 2HA GLY 167 10.200 4.671 4.671 655 2HA GLY 167 1HA GLY 167 10.153 5.043 5.043 656 H ARG 168 H ARG 168 11.030 3.163 3.163 657 HA ARG 168 HA ARG 168 9.689 0.698 0.698 658 1HB ARG 168 2HB ARG 168 11.732 -0.413 -0.413 659 2HB ARG 168 1HB ARG 168 12.067 0.591 0.591 660 1HG ARG 168 2HG ARG 168 13.014 2.392 2.392 661 2HG ARG 168 1HG ARG 168 12.476 1.718 1.718 662 1HD ARG 168 2HD ARG 168 14.568 0.420 0.420 663 2HD ARG 168 1HD ARG 168 14.915 1.327 1.327 664 HE ARG 168 HE ARG 168 13.858 -1.419 -1.419 665 1HH1 ARG 168 1HH1 ARG 168 14.137 1.431 1.431 666 2HH1 ARG 168 2HH1 ARG 168 13.957 0.509 0.509 667 1HH2 ARG 168 1HH2 ARG 168 13.619 -2.628 -2.628 668 2HH2 ARG 168 2HH2 ARG 168 13.659 -1.819 -1.819 669 H GLN 169 H GLN 169 8.279 2.365 2.365 670 HA GLN 169 HA GLN 169 8.208 0.913 0.913 671 1HB GLN 169 2HB GLN 169 9.506 3.589 3.589 672 2HB GLN 169 1HB GLN 169 8.488 3.238 3.238 673 1HG GLN 169 2HG GLN 169 10.131 1.489 1.489 674 2HG GLN 169 1HG GLN 169 11.147 1.840 1.840 675 1HE2 GLN 169 1HE2 GLN 169 9.471 3.479 3.479 676 2HE2 GLN 169 2HE2 GLN 169 10.665 4.695 4.695 677 H MET 170 H MET 170 6.123 1.304 1.304 678 HA MET 170 HA MET 170 4.658 3.497 3.497 679 1HB MET 170 2HB MET 170 3.735 1.379 1.379 680 2HB MET 170 1HB MET 170 3.552 0.707 0.707 681 1HG MET 170 2HG MET 170 1.846 2.497 2.497 682 2HG MET 170 1HG MET 170 2.178 3.141 3.141 683 1HE MET 170 2HE MET 170 1.819 -0.826 -0.826 684 2HE MET 170 1HE MET 170 0.555 -1.117 -1.117 685 3HE MET 170 3HE MET 170 2.128 -0.412 -0.412 686 H ILE 171 H ILE 171 4.278 5.082 5.082 687 HA ILE 171 HA ILE 171 3.721 4.187 4.187 688 HB ILE 171 HB ILE 171 3.205 6.824 6.824 689 1HG1 ILE 171 2HG1 ILE 171 5.614 6.014 6.014 690 2HG1 ILE 171 1HG1 ILE 171 5.128 7.667 7.667 691 1HG2 ILE 171 3HG2 ILE 171 2.616 5.832 5.832 692 2HG2 ILE 171 2HG2 ILE 171 2.897 7.604 7.604 693 3HG2 ILE 171 1HG2 ILE 171 1.502 6.802 6.802 694 1HD1 ILE 171 1HD1 ILE 171 4.578 6.570 6.570 695 2HD1 ILE 171 3HD1 ILE 171 5.075 5.034 5.034 696 3HD1 ILE 171 2HD1 ILE 171 6.313 6.321 6.321 697 H MET 172 H MET 172 1.912 3.404 3.404 698 HA MET 172 HA MET 172 -0.688 4.168 4.168 699 1HB MET 172 2HB MET 172 -0.656 1.785 1.785 700 2HB MET 172 1HB MET 172 0.409 1.650 1.650 701 1HG MET 172 2HG MET 172 -1.395 2.122 2.122 702 2HG MET 172 1HG MET 172 -2.356 2.830 2.830 703 1HE MET 172 2HE MET 172 -2.857 0.901 0.901 704 2HE MET 172 1HE MET 172 -3.628 -0.627 -0.627 705 3HE MET 172 3HE MET 172 -1.843 -0.557 -0.557 706 H VAL 173 H VAL 173 -2.038 5.282 5.282 707 HA VAL 173 HA VAL 173 -0.437 6.142 6.142 708 HB VAL 173 HB VAL 173 -2.901 7.434 7.434 709 1HG1 VAL 173 3HG1 VAL 173 -0.861 7.880 7.880 710 2HG1 VAL 173 2HG1 VAL 173 -1.510 9.363 9.363 711 3HG1 VAL 173 1HG1 VAL 173 -2.627 8.251 8.251 712 1HG2 VAL 173 1HG2 VAL 173 0.098 7.873 7.873 713 2HG2 VAL 173 3HG2 VAL 173 -1.156 7.361 7.361 714 3HG2 VAL 173 2HG2 VAL 173 -1.200 9.022 9.022 715 H LEU 174 H LEU 174 -1.487 5.859 5.859 716 HA LEU 174 HA LEU 174 -3.954 4.337 4.337 717 1HB LEU 174 2HB LEU 174 -1.549 3.298 3.298 718 2HB LEU 174 1HB LEU 174 -1.553 3.653 3.653 719 HG LEU 174 HG LEU 174 -2.187 1.304 1.304 720 1HD1 LEU 174 3HD1 LEU 174 -2.162 1.956 1.956 721 2HD1 LEU 174 2HD1 LEU 174 -3.961 1.827 1.827 722 3HD1 LEU 174 1HD1 LEU 174 -2.901 0.429 0.429 723 1HD2 LEU 174 2HD2 LEU 174 -4.119 2.363 2.363 724 2HD2 LEU 174 1HD2 LEU 174 -4.630 0.954 0.954 725 3HD2 LEU 174 3HD2 LEU 174 -4.799 2.691 2.691 726 H ALA 175 H ALA 175 -5.117 6.353 6.353 727 HA ALA 175 HA ALA 175 -4.715 7.305 7.305 728 1HB ALA 175 1HB ALA 175 -5.319 8.681 8.681 729 2HB ALA 175 3HB ALA 175 -6.895 7.714 7.714 730 3HB ALA 175 2HB ALA 175 -6.551 8.980 8.980 731 HA PRO 176 HA PRO 176 -8.209 5.832 5.832 732 1HB PRO 176 2HB PRO 176 -9.062 8.701 8.701 733 2HB PRO 176 1HB PRO 176 -8.895 7.337 7.337 734 1HG PRO 176 2HG PRO 176 -6.966 9.287 9.287 735 2HG PRO 176 1HG PRO 176 -6.486 7.545 7.545 736 1HD PRO 176 2HD PRO 176 -6.521 9.284 9.284 737 2HD PRO 176 1HD PRO 176 -5.317 8.031 8.031 738 H LYS 177 H LYS 177 -10.270 5.153 5.153 739 HA LYS 177 HA LYS 177 -11.269 6.486 6.486 740 1HB LYS 177 2HB LYS 177 -12.820 4.677 4.677 741 2HB LYS 177 1HB LYS 177 -11.307 4.007 4.007 742 1HG LYS 177 2HG LYS 177 -12.357 4.146 4.146 743 2HG LYS 177 1HG LYS 177 -13.918 4.605 4.605 744 1HD LYS 177 2HD LYS 177 -13.934 2.508 2.508 745 2HD LYS 177 1HD LYS 177 -12.335 2.046 2.046 746 1HE LYS 177 2HE LYS 177 -14.171 0.853 0.853 747 2HE LYS 177 1HE LYS 177 -13.328 2.000 2.000 748 1HZ LYS 177 3HZ LYS 177 -15.103 3.580 3.580 749 2HZ LYS 177 2HZ LYS 177 -15.888 2.502 2.502 750 3HZ LYS 177 1HZ LYS 177 -15.712 2.107 2.107 751 H LYS 178 H LYS 178 -13.677 6.893 6.893 752 HA LYS 178 HA LYS 178 -14.476 8.979 8.979 753 1HB LYS 178 2HB LYS 178 -15.916 7.227 7.227 754 2HB LYS 178 1HB LYS 178 -16.667 8.693 8.693 755 1HG LYS 178 2HG LYS 178 -14.842 10.102 10.102 756 2HG LYS 178 1HG LYS 178 -14.098 8.632 8.632 757 1HD LYS 178 2HD LYS 178 -16.205 8.218 8.218 758 2HD LYS 178 1HD LYS 178 -16.905 9.735 9.735 759 1HE LYS 178 2HE LYS 178 -15.067 11.064 11.064 760 2HE LYS 178 1HE LYS 178 -14.355 9.529 9.529 761 1HZ LYS 178 3HZ LYS 178 -16.418 9.146 9.146 762 2HZ LYS 178 2HZ LYS 178 -17.073 10.592 10.592 763 3HZ LYS 178 1HZ LYS 178 -15.727 10.636 10.636 764 H LYS 179 H LYS 179 -15.129 8.713 8.713 765 HA LYS 179 HA LYS 179 -16.548 6.383 6.383 766 1HB LYS 179 2HB LYS 179 -16.181 9.137 9.137 767 2HB LYS 179 1HB LYS 179 -16.919 7.702 7.702 768 1HG LYS 179 2HG LYS 179 -14.772 6.448 6.448 769 2HG LYS 179 1HG LYS 179 -14.008 7.884 7.884 770 1HD LYS 179 2HD LYS 179 -15.154 7.813 7.813 771 2HD LYS 179 1HD LYS 179 -13.425 7.576 7.576 772 1HE LYS 179 2HE LYS 179 -13.346 9.886 9.886 773 2HE LYS 179 1HE LYS 179 -15.062 10.156 10.156 774 1HZ LYS 179 1HZ LYS 179 -12.779 9.503 9.503 775 2HZ LYS 179 3HZ LYS 179 -13.495 11.029 11.029 776 3HZ LYS 179 2HZ LYS 179 -14.388 9.760 9.760 777 H GLN 180 H GLN 180 -18.624 6.044 6.044 778 HA GLN 180 HA GLN 180 -20.588 6.292 6.292 779 1HB GLN 180 2HB GLN 180 -21.086 7.509 7.509 780 2HB GLN 180 1HB GLN 180 -20.705 9.059 9.059 781 1HG GLN 180 2HG GLN 180 -23.150 8.703 8.703 782 2HG GLN 180 1HG GLN 180 -22.630 8.693 8.693 783 1HE2 GLN 180 1HE2 GLN 180 -23.476 7.112 7.112 784 2HE2 GLN 180 2HE2 GLN 180 -23.981 5.548 5.548 Start of MODEL 21 1 HA VAL 90 HA VAL 90 -1.785 17.050 17.050 2 HB VAL 90 HB VAL 90 -3.513 17.421 17.421 3 1HG1 VAL 90 2HG1 VAL 90 -3.897 19.136 19.136 4 2HG1 VAL 90 1HG1 VAL 90 -5.066 17.974 17.974 5 3HG1 VAL 90 3HG1 VAL 90 -5.418 18.673 18.673 6 1HG2 VAL 90 1HG2 VAL 90 -5.334 15.588 15.588 7 2HG2 VAL 90 3HG2 VAL 90 -4.519 15.144 15.144 8 3HG2 VAL 90 2HG2 VAL 90 -5.796 16.390 16.390 9 H ILE 91 H ILE 91 -3.112 15.756 15.756 10 HA ILE 91 HA ILE 91 -2.758 12.904 12.904 11 HB ILE 91 HB ILE 91 -3.901 14.275 14.275 12 1HG1 ILE 91 2HG1 ILE 91 -5.444 14.568 14.568 13 2HG1 ILE 91 1HG1 ILE 91 -6.070 13.236 13.236 14 1HG2 ILE 91 2HG2 ILE 91 -3.629 11.288 11.288 15 2HG2 ILE 91 1HG2 ILE 91 -4.691 11.921 11.921 16 3HG2 ILE 91 3HG2 ILE 91 -2.918 12.129 12.129 17 1HD1 ILE 91 2HD1 ILE 91 -5.003 11.570 11.570 18 2HD1 ILE 91 1HD1 ILE 91 -4.567 12.964 12.964 19 3HD1 ILE 91 3HD1 ILE 91 -6.305 12.593 12.593 20 H GLN 92 H GLN 92 -0.951 11.782 11.782 21 HA GLN 92 HA GLN 92 1.067 13.382 13.382 22 1HB GLN 92 2HB GLN 92 1.297 10.624 10.624 23 2HB GLN 92 1HB GLN 92 2.642 11.781 11.781 24 1HG GLN 92 2HG GLN 92 0.349 12.102 12.102 25 2HG GLN 92 1HG GLN 92 2.030 11.614 11.614 26 1HE2 GLN 92 1HE2 GLN 92 -0.192 14.181 14.181 27 2HE2 GLN 92 2HE2 GLN 92 0.907 15.522 15.522 28 H VAL 93 H VAL 93 2.510 12.078 12.078 29 HA VAL 93 HA VAL 93 0.927 9.966 9.966 30 HB VAL 93 HB VAL 93 3.314 11.451 11.451 31 1HG1 VAL 93 2HG1 VAL 93 1.958 8.760 8.760 32 2HG1 VAL 93 1HG1 VAL 93 2.933 9.663 9.663 33 3HG1 VAL 93 3HG1 VAL 93 3.765 8.995 8.995 34 1HG2 VAL 93 2HG2 VAL 93 0.728 12.070 12.070 35 2HG2 VAL 93 1HG2 VAL 93 1.688 11.716 11.716 36 3HG2 VAL 93 3HG2 VAL 93 0.694 10.408 10.408 37 H LYS 94 H LYS 94 1.335 7.821 7.821 38 HA LYS 94 HA LYS 94 4.237 7.598 7.598 39 1HB LYS 94 2HB LYS 94 2.221 5.413 5.413 40 2HB LYS 94 1HB LYS 94 3.830 5.521 5.521 41 1HG LYS 94 2HG LYS 94 1.488 7.405 7.405 42 2HG LYS 94 1HG LYS 94 1.877 5.998 5.998 43 1HD LYS 94 2HD LYS 94 3.795 8.371 8.371 44 2HD LYS 94 1HD LYS 94 2.686 8.203 8.203 45 1HE LYS 94 2HE LYS 94 3.822 6.070 6.070 46 2HE LYS 94 1HE LYS 94 4.999 6.274 6.274 47 1HZ LYS 94 3HZ LYS 94 4.539 8.187 8.187 48 2HZ LYS 94 2HZ LYS 94 5.851 7.122 7.122 49 3HZ LYS 94 1HZ LYS 94 5.639 8.385 8.385 50 H GLU 95 H GLU 95 5.126 5.366 5.366 51 HA GLU 95 HA GLU 95 3.887 4.818 4.818 52 1HB GLU 95 2HB GLU 95 5.735 6.593 6.593 53 2HB GLU 95 1HB GLU 95 6.770 5.248 5.248 54 1HG GLU 95 2HG GLU 95 6.374 3.982 3.982 55 2HG GLU 95 1HG GLU 95 5.289 5.313 5.313 56 H ILE 96 H ILE 96 4.380 2.777 2.777 57 HA ILE 96 HA ILE 96 6.189 1.118 1.118 58 HB ILE 96 HB ILE 96 3.482 0.803 0.803 59 1HG1 ILE 96 2HG1 ILE 96 3.840 -1.629 -1.629 60 2HG1 ILE 96 1HG1 ILE 96 5.449 -1.558 -1.558 61 1HG2 ILE 96 1HG2 ILE 96 3.076 0.551 0.551 62 2HG2 ILE 96 3HG2 ILE 96 3.969 -1.046 -1.046 63 3HG2 ILE 96 2HG2 ILE 96 2.532 -0.837 -0.837 64 1HD1 ILE 96 3HD1 ILE 96 4.555 0.001 0.001 65 2HD1 ILE 96 2HD1 ILE 96 5.590 -1.470 -1.470 66 3HD1 ILE 96 1HD1 ILE 96 6.210 0.067 0.067 67 H LYS 97 H LYS 97 7.066 -0.661 -0.661 68 HA LYS 97 HA LYS 97 6.311 0.032 0.032 69 1HB LYS 97 2HB LYS 97 8.908 -1.358 -1.358 70 2HB LYS 97 1HB LYS 97 8.194 -1.016 -1.016 71 1HG LYS 97 2HG LYS 97 8.313 1.446 1.446 72 2HG LYS 97 1HG LYS 97 9.114 1.100 1.100 73 1HD LYS 97 2HD LYS 97 11.015 0.012 0.012 74 2HD LYS 97 1HD LYS 97 10.222 0.322 0.322 75 1HE LYS 97 2HE LYS 97 11.101 2.531 2.531 76 2HE LYS 97 1HE LYS 97 12.030 2.005 2.005 77 1HZ LYS 97 2HZ LYS 97 9.274 3.118 3.118 78 2HZ LYS 97 1HZ LYS 97 10.696 3.942 3.942 79 3HZ LYS 97 3HZ LYS 97 10.157 2.632 2.632 80 H PHE 98 H PHE 98 6.012 -1.767 -1.767 81 HA PHE 98 HA PHE 98 5.872 -4.355 -4.355 82 1HB PHE 98 2HB PHE 98 3.621 -2.890 -2.890 83 2HB PHE 98 1HB PHE 98 3.645 -4.619 -4.619 84 HD1 PHE 98 1HD PHE 98 4.511 -5.176 -5.176 85 HD2 PHE 98 2HD PHE 98 1.827 -2.834 -2.834 86 HE1 PHE 98 1HE PHE 98 3.208 -4.909 -4.909 87 HE2 PHE 98 2HE PHE 98 0.504 -2.385 -2.385 88 HZ PHE 98 HZ PHE 98 1.078 -3.681 -3.681 89 H ARG 99 H ARG 99 6.884 -5.826 -5.826 90 HA ARG 99 HA ARG 99 7.789 -5.065 -5.065 91 1HB ARG 99 2HB ARG 99 9.150 -7.129 -7.129 92 2HB ARG 99 1HB ARG 99 9.114 -6.148 -6.148 93 1HG ARG 99 2HG ARG 99 7.852 -7.631 -7.631 94 2HG ARG 99 1HG ARG 99 7.121 -8.440 -8.440 95 1HD ARG 99 2HD ARG 99 10.098 -8.728 -8.728 96 2HD ARG 99 1HD ARG 99 8.780 -9.910 -9.910 97 HE ARG 99 HE ARG 99 8.683 -9.220 -9.220 98 1HH1 ARG 99 1HH2 ARG 99 10.487 -11.124 -11.124 99 2HH1 ARG 99 2HH2 ARG 99 11.002 -12.334 -12.334 100 1HH2 ARG 99 1HH1 ARG 99 9.383 -10.861 -10.861 101 2HH2 ARG 99 2HH1 ARG 99 10.364 -12.183 -12.183 102 HA PRO 100 HA PRO 100 5.293 -7.583 -7.583 103 1HB PRO 100 2HB PRO 100 7.706 -9.497 -9.497 104 2HB PRO 100 1HB PRO 100 6.741 -8.967 -8.967 105 1HG PRO 100 2HG PRO 100 9.185 -7.860 -7.860 106 2HG PRO 100 1HG PRO 100 8.002 -6.949 -6.949 107 1HD PRO 100 2HD PRO 100 8.746 -6.299 -6.299 108 2HD PRO 100 1HD PRO 100 7.372 -5.601 -5.601 109 H GLY 101 H GLY 101 3.967 -9.288 -9.288 110 1HA GLY 101 2HA GLY 101 2.610 -10.245 -10.245 111 2HA GLY 101 1HA GLY 101 3.086 -11.390 -11.390 112 H THR 102 H THR 102 2.766 -10.742 -10.742 113 HA THR 102 HA THR 102 5.221 -11.945 -11.945 114 HB THR 102 HB THR 102 3.519 -10.223 -10.223 115 HG1 THR 102 1HG THR 102 4.909 -9.322 -9.322 116 1HG2 THR 102 1HG2 THR 102 6.522 -10.399 -10.399 117 2HG2 THR 102 3HG2 THR 102 5.830 -9.202 -9.202 118 3HG2 THR 102 2HG2 THR 102 5.801 -10.951 -10.951 119 H ASP 103 H ASP 103 4.177 -11.779 -11.779 120 HA ASP 103 HA ASP 103 3.684 -14.636 -14.636 121 1HB ASP 103 2HB ASP 103 5.577 -12.843 -12.843 122 2HB ASP 103 1HB ASP 103 4.697 -12.941 -12.941 123 H GLU 104 H GLU 104 3.013 -15.265 -15.265 124 HA GLU 104 HA GLU 104 0.675 -13.788 -13.788 125 1HB GLU 104 2HB GLU 104 1.994 -16.192 -16.192 126 2HB GLU 104 1HB GLU 104 0.454 -15.440 -15.440 127 1HG GLU 104 2HG GLU 104 -0.615 -16.034 -16.034 128 2HG GLU 104 1HG GLU 104 0.945 -16.746 -16.746 129 H GLY 105 H GLY 105 3.430 -14.933 -14.933 130 1HA GLY 105 2HA GLY 105 3.172 -12.322 -12.322 131 2HA GLY 105 1HA GLY 105 3.778 -13.845 -13.845 132 H ASP 106 H ASP 106 4.511 -12.410 -12.410 133 HA ASP 106 HA ASP 106 6.759 -11.055 -11.055 134 1HB ASP 106 2HB ASP 106 7.225 -12.381 -12.381 135 2HB ASP 106 1HB ASP 106 6.257 -11.192 -11.192 136 H TYR 107 H TYR 107 3.825 -11.011 -11.011 137 HA TYR 107 HA TYR 107 4.229 -8.152 -8.152 138 1HB TYR 107 2HB TYR 107 3.517 -10.052 -10.052 139 2HB TYR 107 1HB TYR 107 2.044 -10.161 -10.161 140 HD1 TYR 107 2HD TYR 107 2.245 -6.722 -6.722 141 HD2 TYR 107 1HD TYR 107 1.548 -10.443 -10.443 142 HE1 TYR 107 2HE TYR 107 0.070 -5.894 -5.894 143 HE2 TYR 107 1HE TYR 107 -0.354 -9.436 -9.436 144 HH TYR 107 HH TYR 107 -1.569 -6.249 -6.249 145 H GLN 108 H GLN 108 1.286 -10.083 -10.083 146 HA GLN 108 HA GLN 108 0.189 -8.073 -8.073 147 1HB GLN 108 2HB GLN 108 -0.666 -10.623 -10.623 148 2HB GLN 108 1HB GLN 108 -1.546 -9.282 -9.282 149 1HG GLN 108 2HG GLN 108 0.087 -11.152 -11.152 150 2HG GLN 108 1HG GLN 108 -1.366 -11.684 -11.684 151 1HE2 GLN 108 1HE2 GLN 108 -0.239 -8.465 -8.465 152 2HE2 GLN 108 2HE2 GLN 108 -1.585 -8.209 -8.209 153 H VAL 109 H VAL 109 2.767 -9.602 -9.602 154 HA VAL 109 HA VAL 109 2.399 -8.840 -8.840 155 HB VAL 109 HB VAL 109 4.931 -9.004 -9.004 156 1HG1 VAL 109 3HG1 VAL 109 4.594 -8.379 -8.379 157 2HG1 VAL 109 2HG1 VAL 109 6.114 -9.001 -9.001 158 3HG1 VAL 109 1HG1 VAL 109 5.504 -7.398 -7.398 159 1HG2 VAL 109 2HG2 VAL 109 3.601 -11.128 -11.128 160 2HG2 VAL 109 1HG2 VAL 109 5.287 -11.093 -11.093 161 3HG2 VAL 109 3HG2 VAL 109 3.892 -10.770 -10.770 162 H LYS 110 H LYS 110 3.702 -7.130 -7.130 163 HA LYS 110 HA LYS 110 3.631 -4.644 -4.644 164 1HB LYS 110 2HB LYS 110 4.683 -5.442 -5.442 165 2HB LYS 110 1HB LYS 110 4.637 -3.765 -3.765 166 1HG LYS 110 2HG LYS 110 6.266 -6.119 -6.119 167 2HG LYS 110 1HG LYS 110 6.741 -4.406 -4.406 168 1HD LYS 110 2HD LYS 110 5.899 -3.567 -3.567 169 2HD LYS 110 1HD LYS 110 5.320 -5.207 -5.207 170 1HE LYS 110 2HE LYS 110 7.441 -4.750 -4.750 171 2HE LYS 110 1HE LYS 110 7.716 -6.043 -6.043 172 1HZ LYS 110 1HZ LYS 110 8.562 -4.339 -4.339 173 2HZ LYS 110 3HZ LYS 110 8.325 -3.147 -3.147 174 3HZ LYS 110 2HZ LYS 110 9.442 -4.400 -4.400 175 H LEU 111 H LEU 111 1.336 -6.303 -6.303 176 HA LEU 111 HA LEU 111 -0.049 -3.932 -3.932 177 1HB LEU 111 2HB LEU 111 -0.350 -6.229 -6.229 178 2HB LEU 111 1HB LEU 111 -1.185 -6.725 -6.725 179 HG LEU 111 HG LEU 111 -2.108 -4.274 -4.274 180 1HD1 LEU 111 2HD1 LEU 111 -1.712 -6.109 -6.109 181 2HD1 LEU 111 1HD1 LEU 111 -2.812 -7.177 -7.177 182 3HD1 LEU 111 3HD1 LEU 111 -3.458 -5.678 -5.678 183 1HD2 LEU 111 3HD2 LEU 111 -3.458 -6.504 -6.504 184 2HD2 LEU 111 2HD2 LEU 111 -3.331 -4.750 -4.750 185 3HD2 LEU 111 1HD2 LEU 111 -4.401 -5.299 -5.299 186 H ARG 112 H ARG 112 0.499 -6.131 -6.131 187 HA ARG 112 HA ARG 112 -1.295 -4.855 -4.855 188 1HB ARG 112 2HB ARG 112 -0.065 -7.025 -7.025 189 2HB ARG 112 1HB ARG 112 1.315 -5.990 -5.990 190 1HG ARG 112 2HG ARG 112 -0.180 -4.807 -4.807 191 2HG ARG 112 1HG ARG 112 -1.504 -5.943 -5.943 192 1HD ARG 112 2HD ARG 112 -0.159 -7.863 -7.863 193 2HD ARG 112 1HD ARG 112 1.262 -6.786 -6.786 194 HE ARG 112 HE ARG 112 -1.244 -6.952 -6.952 195 1HH1 ARG 112 1HH1 ARG 112 1.727 -5.098 -5.098 196 2HH1 ARG 112 2HH1 ARG 112 1.755 -4.284 -4.284 197 1HH2 ARG 112 1HH2 ARG 112 -1.178 -5.844 -5.844 198 2HH2 ARG 112 2HH2 ARG 112 0.087 -4.711 -4.711 199 H SER 113 H SER 113 2.264 -4.055 -4.055 200 HA SER 113 HA SER 113 2.444 -2.067 -2.067 201 1HB SER 113 2HB SER 113 4.300 -2.881 -2.881 202 2HB SER 113 1HB SER 113 3.678 -2.094 -2.094 203 HG SER 113 HG SER 113 3.799 -0.123 -0.123 204 H LEU 114 H LEU 114 1.034 -1.969 -1.969 205 HA LEU 114 HA LEU 114 0.496 0.818 0.818 206 1HB LEU 114 2HB LEU 114 -0.772 -1.755 -1.755 207 2HB LEU 114 1HB LEU 114 -1.467 -0.146 -0.146 208 HG LEU 114 HG LEU 114 1.428 -0.951 -0.951 209 1HD1 LEU 114 3HD1 LEU 114 -0.398 -2.236 -2.236 210 2HD1 LEU 114 2HD1 LEU 114 -1.086 -0.675 -0.675 211 3HD1 LEU 114 1HD1 LEU 114 0.560 -1.204 -1.204 212 1HD2 LEU 114 3HD2 LEU 114 -0.362 1.517 1.517 213 2HD2 LEU 114 2HD2 LEU 114 1.230 1.427 1.427 214 3HD2 LEU 114 1HD2 LEU 114 1.155 1.272 1.272 215 H ILE 115 H ILE 115 -1.551 -1.942 -1.942 216 HA ILE 115 HA ILE 115 -3.821 -0.393 -0.393 217 HB ILE 115 HB ILE 115 -3.224 -1.935 -1.935 218 1HG1 ILE 115 2HG1 ILE 115 -2.610 -3.560 -3.560 219 2HG1 ILE 115 1HG1 ILE 115 -4.107 -4.001 -4.001 220 1HG2 ILE 115 3HG2 ILE 115 -5.574 -1.131 -1.131 221 2HG2 ILE 115 2HG2 ILE 115 -5.750 -2.273 -2.273 222 3HG2 ILE 115 1HG2 ILE 115 -5.182 -0.591 -0.591 223 1HD1 ILE 115 3HD1 ILE 115 -5.449 -3.119 -3.119 224 2HD1 ILE 115 2HD1 ILE 115 -3.849 -2.824 -2.824 225 3HD1 ILE 115 1HD1 ILE 115 -4.390 -4.511 -4.511 226 H ARG 116 H ARG 116 -1.203 -0.805 -0.805 227 HA ARG 116 HA ARG 116 -2.020 0.772 0.772 228 1HB ARG 116 2HB ARG 116 0.005 -0.868 -0.868 229 2HB ARG 116 1HB ARG 116 0.913 0.468 0.468 230 1HG ARG 116 2HG ARG 116 1.414 0.303 0.303 231 2HG ARG 116 1HG ARG 116 0.659 1.883 1.883 232 1HD ARG 116 2HD ARG 116 -0.182 0.846 0.846 233 2HD ARG 116 1HD ARG 116 -1.511 1.114 1.114 234 HE ARG 116 HE ARG 116 -0.339 -1.550 -1.550 235 1HH1 ARG 116 1HH2 ARG 116 -2.542 0.470 0.470 236 2HH1 ARG 116 2HH2 ARG 116 -3.593 -0.838 -0.838 237 1HH2 ARG 116 1HH1 ARG 116 -1.768 -3.322 -3.322 238 2HH2 ARG 116 2HH1 ARG 116 -3.145 -3.021 -3.021 239 H PHE 117 H PHE 117 -0.111 1.728 1.728 240 HA PHE 117 HA PHE 117 0.209 4.334 4.334 241 1HB PHE 117 2HB PHE 117 -0.345 3.007 3.007 242 2HB PHE 117 1HB PHE 117 0.328 4.646 4.646 243 HD1 PHE 117 2HD PHE 117 1.889 2.759 2.759 244 HD2 PHE 117 1HD PHE 117 1.389 3.157 3.157 245 HE1 PHE 117 2HE PHE 117 4.227 2.050 2.050 246 HE2 PHE 117 1HE PHE 117 3.737 2.271 2.271 247 HZ PHE 117 HZ PHE 117 5.166 1.807 1.807 248 H LEU 118 H LEU 118 -2.417 2.753 2.753 249 HA LEU 118 HA LEU 118 -3.760 4.927 4.927 250 1HB LEU 118 2HB LEU 118 -4.107 2.222 2.222 251 2HB LEU 118 1HB LEU 118 -5.584 2.894 2.894 252 HG LEU 118 HG LEU 118 -5.038 4.860 4.860 253 1HD1 LEU 118 2HD1 LEU 118 -4.019 2.154 2.154 254 2HD1 LEU 118 1HD1 LEU 118 -4.780 3.379 3.379 255 3HD1 LEU 118 3HD1 LEU 118 -3.341 3.847 3.847 256 1HD2 LEU 118 3HD2 LEU 118 -6.858 2.506 2.506 257 2HD2 LEU 118 2HD2 LEU 118 -7.058 4.265 4.265 258 3HD2 LEU 118 1HD2 LEU 118 -6.925 3.778 3.778 259 H GLU 119 H GLU 119 -4.169 2.872 2.872 260 HA GLU 119 HA GLU 119 -6.563 4.085 4.085 261 1HB GLU 119 2HB GLU 119 -6.840 2.249 2.249 262 2HB GLU 119 1HB GLU 119 -5.954 1.612 1.612 263 1HG GLU 119 2HG GLU 119 -3.809 1.744 1.744 264 2HG GLU 119 1HG GLU 119 -4.778 2.155 2.155 265 H GLU 120 H GLU 120 -3.180 4.553 4.553 266 HA GLU 120 HA GLU 120 -3.839 5.989 5.989 267 1HB GLU 120 2HB GLU 120 -1.494 6.645 6.645 268 2HB GLU 120 1HB GLU 120 -1.650 4.879 4.879 269 1HG GLU 120 2HG GLU 120 -1.014 5.271 5.271 270 2HG GLU 120 1HG GLU 120 -0.861 7.040 7.040 271 H GLY 121 H GLY 121 -4.454 6.457 6.457 272 1HA GLY 121 2HA GLY 121 -5.554 8.109 8.109 273 2HA GLY 121 1HA GLY 121 -5.056 9.182 9.182 274 H ASP 122 H ASP 122 -3.574 7.342 7.342 275 HA ASP 122 HA ASP 122 -2.396 9.829 9.829 276 1HB ASP 122 2HB ASP 122 -0.884 7.215 7.215 277 2HB ASP 122 1HB ASP 122 -0.274 8.841 8.841 278 H LYS 123 H LYS 123 -1.629 9.443 9.443 279 HA LYS 123 HA LYS 123 -3.626 7.823 7.823 280 1HB LYS 123 2HB LYS 123 -3.716 10.386 10.386 281 2HB LYS 123 1HB LYS 123 -2.042 10.335 10.335 282 1HG LYS 123 2HG LYS 123 -4.615 9.070 9.070 283 2HG LYS 123 1HG LYS 123 -3.988 10.653 10.653 284 1HD LYS 123 2HD LYS 123 -2.237 8.147 8.147 285 2HD LYS 123 1HD LYS 123 -3.420 8.566 8.566 286 1HE LYS 123 2HE LYS 123 -1.208 10.316 10.316 287 2HE LYS 123 1HE LYS 123 -1.019 9.322 9.322 288 1HZ LYS 123 1HZ LYS 123 -2.968 11.543 11.543 289 2HZ LYS 123 3HZ LYS 123 -1.510 11.644 11.644 290 3HZ LYS 123 2HZ LYS 123 -2.753 10.622 10.622 291 H ALA 124 H ALA 124 -2.577 5.920 5.920 292 HA ALA 124 HA ALA 124 0.317 6.008 6.008 293 1HB ALA 124 2HB ALA 124 -1.743 3.778 3.778 294 2HB ALA 124 1HB ALA 124 0.056 3.534 3.534 295 3HB ALA 124 3HB ALA 124 -0.940 4.132 4.132 296 H LYS 125 H LYS 125 1.717 5.459 5.459 297 HA LYS 125 HA LYS 125 -0.014 5.080 5.080 298 1HB LYS 125 2HB LYS 125 0.870 7.471 7.471 299 2HB LYS 125 1HB LYS 125 2.486 6.847 6.847 300 1HG LYS 125 2HG LYS 125 2.863 5.983 5.983 301 2HG LYS 125 1HG LYS 125 1.240 6.578 6.578 302 1HD LYS 125 2HD LYS 125 3.439 8.361 8.361 303 2HD LYS 125 1HD LYS 125 3.317 8.033 8.033 304 1HE LYS 125 2HE LYS 125 1.079 9.041 9.041 305 2HE LYS 125 1HE LYS 125 1.095 9.379 9.379 306 1HZ LYS 125 1HZ LYS 125 3.014 10.434 10.434 307 2HZ LYS 125 3HZ LYS 125 1.738 11.287 11.287 308 3HZ LYS 125 2HZ LYS 125 3.041 10.742 10.742 309 H ILE 126 H ILE 126 0.598 3.230 3.230 310 HA ILE 126 HA ILE 126 2.994 1.883 1.883 311 HB ILE 126 HB ILE 126 1.273 1.453 1.453 312 1HG1 ILE 126 2HG1 ILE 126 -0.395 1.685 1.685 313 2HG1 ILE 126 1HG1 ILE 126 -0.159 -0.064 -0.064 314 1HG2 ILE 126 1HG2 ILE 126 2.925 -0.301 -0.301 315 2HG2 ILE 126 3HG2 ILE 126 1.925 -0.935 -0.935 316 3HG2 ILE 126 2HG2 ILE 126 3.361 0.070 0.070 317 1HD1 ILE 126 2HD1 ILE 126 1.218 -0.202 -0.202 318 2HD1 ILE 126 1HD1 ILE 126 0.815 1.521 1.521 319 3HD1 ILE 126 3HD1 ILE 126 -0.494 0.277 0.277 320 H THR 127 H THR 127 4.935 1.978 1.978 321 HA THR 127 HA THR 127 4.780 3.118 3.118 322 HB THR 127 HB THR 127 7.259 2.674 2.674 323 HG1 THR 127 1HG THR 127 5.957 4.296 4.296 324 1HG2 THR 127 3HG2 THR 127 6.599 4.073 4.073 325 2HG2 THR 127 2HG2 THR 127 8.197 4.233 4.233 326 3HG2 THR 127 1HG2 THR 127 7.668 2.624 2.624 327 H LEU 128 H LEU 128 4.619 1.532 1.532 328 HA LEU 128 HA LEU 128 5.410 -1.179 -1.179 329 1HB LEU 128 2HB LEU 128 4.154 0.481 0.481 330 2HB LEU 128 1HB LEU 128 5.504 -0.384 -0.384 331 HG LEU 128 HG LEU 128 3.348 -1.680 -1.680 332 1HD1 LEU 128 2HD1 LEU 128 2.427 -0.263 -0.263 333 2HD1 LEU 128 1HD1 LEU 128 3.186 -1.269 -1.269 334 3HD1 LEU 128 3HD1 LEU 128 1.957 -1.985 -1.985 335 1HD2 LEU 128 1HD2 LEU 128 5.359 -3.146 -3.146 336 2HD2 LEU 128 3HD2 LEU 128 3.857 -3.844 -3.844 337 3HD2 LEU 128 2HD2 LEU 128 5.100 -3.107 -3.107 338 H ARG 129 H ARG 129 7.366 -2.182 -2.182 339 HA ARG 129 HA ARG 129 9.231 -0.526 -0.526 340 1HB ARG 129 2HB ARG 129 9.860 -0.159 -0.159 341 2HB ARG 129 1HB ARG 129 9.861 -1.940 -1.940 342 1HG ARG 129 2HG ARG 129 11.751 -2.220 -2.220 343 2HG ARG 129 1HG ARG 129 11.516 -0.576 -0.576 344 1HD ARG 129 2HD ARG 129 12.523 -1.236 -1.236 345 2HD ARG 129 1HD ARG 129 13.577 -0.741 -0.741 346 HE ARG 129 HE ARG 129 11.800 0.985 0.985 347 1HH1 ARG 129 1HH1 ARG 129 13.547 0.630 0.630 348 2HH1 ARG 129 2HH1 ARG 129 13.676 2.336 2.336 349 1HH2 ARG 129 1HH2 ARG 129 11.990 3.267 3.267 350 2HH2 ARG 129 2HH2 ARG 129 12.780 3.852 3.852 351 H PHE 130 H PHE 130 9.016 -1.689 -1.689 352 HA PHE 130 HA PHE 130 8.190 -4.419 -4.419 353 1HB PHE 130 2HB PHE 130 9.327 -2.258 -2.258 354 2HB PHE 130 1HB PHE 130 8.833 -3.943 -3.943 355 HD1 PHE 130 1HD PHE 130 6.659 -4.781 -4.781 356 HD2 PHE 130 2HD PHE 130 7.724 -0.675 -0.675 357 HE1 PHE 130 1HE PHE 130 4.342 -4.118 -4.118 358 HE2 PHE 130 2HE PHE 130 5.310 -0.081 -0.081 359 HZ PHE 130 HZ PHE 130 3.651 -1.814 -1.814 360 H ARG 131 H ARG 131 9.502 -6.134 -6.134 361 HA ARG 131 HA ARG 131 12.342 -5.700 -5.700 362 1HB ARG 131 2HB ARG 131 11.136 -8.269 -8.269 363 2HB ARG 131 1HB ARG 131 12.880 -7.937 -7.937 364 1HG ARG 131 2HG ARG 131 12.807 -6.140 -6.140 365 2HG ARG 131 1HG ARG 131 11.060 -6.476 -6.476 366 1HD ARG 131 2HD ARG 131 11.616 -8.834 -8.834 367 2HD ARG 131 1HD ARG 131 13.386 -8.427 -8.427 368 HE ARG 131 HE ARG 131 11.993 -6.446 -6.446 369 1HH1 ARG 131 1HH2 ARG 131 13.266 -9.778 -9.778 370 2HH1 ARG 131 2HH2 ARG 131 13.544 -9.823 -9.823 371 1HH2 ARG 131 1HH1 ARG 131 12.371 -6.518 -6.518 372 2HH2 ARG 131 2HH1 ARG 131 13.030 -7.942 -7.942 373 H GLY 132 H GLY 132 9.898 -5.537 -5.537 374 1HA GLY 132 2HA GLY 132 9.543 -7.830 -7.830 375 2HA GLY 132 1HA GLY 132 8.872 -6.176 -6.176 376 H ARG 133 H ARG 133 9.401 -5.166 -5.166 377 HA ARG 133 HA ARG 133 12.085 -5.569 -5.569 378 1HB ARG 133 2HB ARG 133 11.412 -5.089 -5.089 379 2HB ARG 133 1HB ARG 133 10.476 -6.466 -6.466 380 1HG ARG 133 2HG ARG 133 8.520 -4.921 -4.921 381 2HG ARG 133 1HG ARG 133 9.470 -3.589 -3.589 382 1HD ARG 133 2HD ARG 133 9.660 -4.957 -4.957 383 2HD ARG 133 1HD ARG 133 8.536 -6.180 -6.180 384 HE ARG 133 HE ARG 133 7.906 -3.378 -3.378 385 1HH1 ARG 133 1HH1 ARG 133 6.791 -6.350 -6.350 386 2HH1 ARG 133 2HH1 ARG 133 5.113 -5.927 -5.927 387 1HH2 ARG 133 1HH2 ARG 133 5.647 -2.834 -2.834 388 2HH2 ARG 133 2HH2 ARG 133 4.456 -3.909 -3.909 389 H GLU 134 H GLU 134 12.098 -3.340 -3.340 390 HA GLU 134 HA GLU 134 13.042 -1.392 -1.392 391 1HB GLU 134 2HB GLU 134 12.195 -1.192 -1.192 392 2HB GLU 134 1HB GLU 134 13.050 0.111 0.111 393 1HG GLU 134 2HG GLU 134 14.979 -1.443 -1.443 394 2HG GLU 134 1HG GLU 134 14.119 -2.748 -2.748 395 H MET 135 H MET 135 10.564 -0.337 -0.337 396 HA MET 135 HA MET 135 9.023 0.877 0.877 397 1HB MET 135 2HB MET 135 9.046 2.042 2.042 398 2HB MET 135 1HB MET 135 8.434 0.557 0.557 399 1HG MET 135 2HG MET 135 6.281 0.733 0.733 400 2HG MET 135 1HG MET 135 6.919 2.019 2.019 401 1HE MET 135 3HE MET 135 4.565 3.038 3.038 402 2HE MET 135 2HE MET 135 4.045 3.500 3.500 403 3HE MET 135 1HE MET 135 4.247 1.767 1.767 404 H ALA 136 H ALA 136 8.014 -0.622 -0.622 405 HA ALA 136 HA ALA 136 8.168 -3.235 -3.235 406 1HB ALA 136 1HB ALA 136 8.802 -2.440 -2.440 407 2HB ALA 136 3HB ALA 136 7.052 -2.249 -2.249 408 3HB ALA 136 2HB ALA 136 7.745 -3.887 -3.887 409 H HIS 137 H HIS 137 6.180 -4.418 -4.418 410 HA HIS 137 HA HIS 137 4.166 -4.455 -4.455 411 1HB HIS 137 2HB HIS 137 4.328 -6.412 -6.412 412 2HB HIS 137 1HB HIS 137 3.486 -6.546 -6.546 413 HD1 HIS 137 1HD HIS 137 4.696 -8.542 -8.542 414 HD2 HIS 137 2HD HIS 137 7.395 -5.673 -5.673 415 HE1 HIS 137 1HE HIS 137 7.056 -9.295 -9.295 416 H GLN 138 H GLN 138 1.951 -4.089 -4.089 417 HA GLN 138 HA GLN 138 1.321 -2.921 -2.921 418 1HB GLN 138 2HB GLN 138 -0.422 -3.193 -3.193 419 2HB GLN 138 1HB GLN 138 -0.877 -2.310 -2.310 420 1HG GLN 138 2HG GLN 138 1.060 -0.734 -0.734 421 2HG GLN 138 1HG GLN 138 1.477 -1.592 -1.592 422 1HE2 GLN 138 1HE2 GLN 138 -1.174 0.171 0.171 423 2HE2 GLN 138 2HE2 GLN 138 -1.962 0.778 0.778 424 H GLN 139 H GLN 139 1.619 -5.835 -5.835 425 HA GLN 139 HA GLN 139 -0.723 -7.101 -7.101 426 1HB GLN 139 2HB GLN 139 1.975 -8.466 -8.466 427 2HB GLN 139 1HB GLN 139 0.361 -9.200 -9.200 428 1HG GLN 139 2HG GLN 139 -0.164 -7.723 -7.723 429 2HG GLN 139 1HG GLN 139 1.545 -7.114 -7.114 430 1HE2 GLN 139 1HE2 GLN 139 -0.441 -10.118 -10.118 431 2HE2 GLN 139 2HE2 GLN 139 0.768 -11.026 -11.026 432 H ILE 140 H ILE 140 2.842 -6.827 -6.827 433 HA ILE 140 HA ILE 140 3.221 -8.065 -8.065 434 HB ILE 140 HB ILE 140 4.685 -6.056 -6.056 435 1HG1 ILE 140 2HG1 ILE 140 4.892 -9.090 -9.090 436 2HG1 ILE 140 1HG1 ILE 140 4.270 -8.395 -8.395 437 1HG2 ILE 140 1HG2 ILE 140 5.217 -7.642 -7.642 438 2HG2 ILE 140 3HG2 ILE 140 6.526 -6.838 -6.838 439 3HG2 ILE 140 2HG2 ILE 140 5.274 -5.845 -5.845 440 1HD1 ILE 140 2HD1 ILE 140 6.518 -7.199 -7.199 441 2HD1 ILE 140 1HD1 ILE 140 7.148 -8.260 -8.260 442 3HD1 ILE 140 3HD1 ILE 140 6.535 -8.995 -8.995 443 H GLY 141 H GLY 141 2.259 -4.743 -4.743 444 1HA GLY 141 2HA GLY 141 2.424 -4.066 -4.066 445 2HA GLY 141 1HA GLY 141 1.655 -3.126 -3.126 446 H MET 142 H MET 142 -0.483 -4.663 -4.663 447 HA MET 142 HA MET 142 -2.008 -3.909 -3.909 448 1HB MET 142 2HB MET 142 -3.697 -3.531 -3.531 449 2HB MET 142 1HB MET 142 -2.253 -3.342 -3.342 450 1HG MET 142 2HG MET 142 -2.703 -5.837 -5.837 451 2HG MET 142 1HG MET 142 -4.129 -5.653 -5.653 452 1HE MET 142 1HE MET 142 -5.314 -6.645 -6.645 453 2HE MET 142 3HE MET 142 -5.364 -5.846 -5.846 454 3HE MET 142 2HE MET 142 -3.817 -6.519 -6.519 455 H GLU 143 H GLU 143 -0.712 -7.071 -7.071 456 HA GLU 143 HA GLU 143 -2.900 -8.119 -8.119 457 1HB GLU 143 2HB GLU 143 -0.689 -9.508 -9.508 458 2HB GLU 143 1HB GLU 143 -0.104 -9.053 -9.053 459 1HG GLU 143 2HG GLU 143 -1.082 -11.069 -11.069 460 2HG GLU 143 1HG GLU 143 -2.486 -10.044 -10.044 461 H VAL 144 H VAL 144 0.177 -6.674 -6.674 462 HA VAL 144 HA VAL 144 -0.247 -7.393 -7.393 463 HB VAL 144 HB VAL 144 1.681 -5.328 -5.328 464 1HG1 VAL 144 3HG1 VAL 144 1.340 -7.053 -7.053 465 2HG1 VAL 144 2HG1 VAL 144 2.904 -6.311 -6.311 466 3HG1 VAL 144 1HG1 VAL 144 1.488 -5.257 -5.257 467 1HG2 VAL 144 1HG2 VAL 144 1.256 -8.340 -8.340 468 2HG2 VAL 144 3HG2 VAL 144 1.799 -7.394 -7.394 469 3HG2 VAL 144 2HG2 VAL 144 2.959 -7.679 -7.679 470 H LEU 145 H LEU 145 -0.236 -4.222 -4.222 471 HA LEU 145 HA LEU 145 -1.083 -2.652 -2.652 472 1HB LEU 145 2HB LEU 145 -1.698 -2.746 -2.746 473 2HB LEU 145 1HB LEU 145 -2.137 -1.306 -1.306 474 HG LEU 145 HG LEU 145 0.640 -2.392 -2.392 475 1HD1 LEU 145 3HD1 LEU 145 -1.179 -0.058 -0.058 476 2HD1 LEU 145 2HD1 LEU 145 0.601 0.156 0.156 477 3HD1 LEU 145 1HD1 LEU 145 -0.230 -1.165 -1.165 478 1HD2 LEU 145 2HD2 LEU 145 -0.210 -0.439 -0.439 479 2HD2 LEU 145 1HD2 LEU 145 0.831 -1.865 -1.865 480 3HD2 LEU 145 3HD2 LEU 145 1.462 -0.404 -0.404 481 H ASN 146 H ASN 146 -3.114 -4.098 -4.098 482 HA ASN 146 HA ASN 146 -5.654 -3.321 -3.321 483 1HB ASN 146 2HB ASN 146 -4.344 -4.457 -4.457 484 2HB ASN 146 1HB ASN 146 -5.234 -5.898 -5.898 485 1HD2 ASN 146 1HD2 ASN 146 -6.064 -6.313 -6.313 486 2HD2 ASN 146 2HD2 ASN 146 -7.054 -5.325 -5.325 487 H ARG 147 H ARG 147 -3.605 -6.256 -6.256 488 HA ARG 147 HA ARG 147 -5.813 -7.220 -7.220 489 1HB ARG 147 2HB ARG 147 -4.420 -8.719 -8.719 490 2HB ARG 147 1HB ARG 147 -2.926 -7.854 -7.854 491 1HG ARG 147 2HG ARG 147 -2.945 -8.923 -8.923 492 2HG ARG 147 1HG ARG 147 -4.766 -9.105 -9.105 493 1HD ARG 147 2HD ARG 147 -3.497 -11.334 -11.334 494 2HD ARG 147 1HD ARG 147 -4.381 -10.980 -10.980 495 HE ARG 147 HE ARG 147 -1.889 -9.761 -9.761 496 1HH1 ARG 147 1HH1 ARG 147 -2.966 -13.053 -13.053 497 2HH1 ARG 147 2HH1 ARG 147 -1.504 -13.818 -13.818 498 1HH2 ARG 147 1HH2 ARG 147 0.072 -10.805 -10.805 499 2HH2 ARG 147 2HH2 ARG 147 0.246 -12.524 -12.524 500 H VAL 148 H VAL 148 -3.306 -4.696 -4.696 501 HA VAL 148 HA VAL 148 -3.216 -5.208 -5.208 502 HB VAL 148 HB VAL 148 -2.868 -2.530 -2.530 503 1HG1 VAL 148 3HG1 VAL 148 -2.793 -3.356 -3.356 504 2HG1 VAL 148 2HG1 VAL 148 -1.236 -4.126 -4.126 505 3HG1 VAL 148 1HG1 VAL 148 -1.438 -2.321 -2.321 506 1HG2 VAL 148 2HG2 VAL 148 -1.645 -3.939 -3.939 507 2HG2 VAL 148 1HG2 VAL 148 -0.546 -2.952 -2.952 508 3HG2 VAL 148 3HG2 VAL 148 -0.775 -4.709 -4.709 509 H LYS 149 H LYS 149 -5.056 -3.001 -3.001 510 HA LYS 149 HA LYS 149 -6.571 -1.565 -1.565 511 1HB LYS 149 2HB LYS 149 -6.396 -1.735 -1.735 512 2HB LYS 149 1HB LYS 149 -7.442 -3.168 -3.168 513 1HG LYS 149 2HG LYS 149 -9.268 -2.181 -2.181 514 2HG LYS 149 1HG LYS 149 -8.556 -0.540 -0.540 515 1HD LYS 149 2HD LYS 149 -8.252 -1.783 -1.783 516 2HD LYS 149 1HD LYS 149 -9.981 -1.193 -1.193 517 1HE LYS 149 2HE LYS 149 -8.989 1.116 1.116 518 2HE LYS 149 1HE LYS 149 -7.438 0.367 0.367 519 1HZ LYS 149 3HZ LYS 149 -8.653 -0.457 -0.457 520 2HZ LYS 149 2HZ LYS 149 -10.094 0.244 0.244 521 3HZ LYS 149 1HZ LYS 149 -8.784 1.232 1.232 522 H ASP 150 H ASP 150 -7.244 -4.858 -4.858 523 HA ASP 150 HA ASP 150 -9.799 -5.056 -5.056 524 1HB ASP 150 2HB ASP 150 -7.644 -6.905 -6.905 525 2HB ASP 150 1HB ASP 150 -9.249 -7.467 -7.467 526 H ASP 151 H ASP 151 -6.536 -6.399 -6.399 527 HA ASP 151 HA ASP 151 -8.007 -7.495 -7.495 528 1HB ASP 151 2HB ASP 151 -5.837 -8.355 -8.355 529 2HB ASP 151 1HB ASP 151 -5.022 -6.994 -6.994 530 H LEU 152 H LEU 152 -6.747 -4.170 -4.170 531 HA LEU 152 HA LEU 152 -6.731 -3.665 -3.665 532 1HB LEU 152 2HB LEU 152 -5.968 -2.146 -2.146 533 2HB LEU 152 1HB LEU 152 -7.289 -1.337 -1.337 534 HG LEU 152 HG LEU 152 -5.210 -0.369 -0.369 535 1HD1 LEU 152 1HD1 LEU 152 -6.174 -2.290 -2.290 536 2HD1 LEU 152 3HD1 LEU 152 -5.078 -0.915 -0.915 537 3HD1 LEU 152 2HD1 LEU 152 -6.734 -0.628 -0.628 538 1HD2 LEU 152 3HD2 LEU 152 -4.269 -3.213 -3.213 539 2HD2 LEU 152 2HD2 LEU 152 -3.699 -1.786 -1.786 540 3HD2 LEU 152 1HD2 LEU 152 -3.342 -1.865 -1.865 541 H GLN 153 H GLN 153 -8.984 -3.329 -3.329 542 HA GLN 153 HA GLN 153 -10.572 -1.606 -1.606 543 1HB GLN 153 2HB GLN 153 -10.479 -3.976 -3.976 544 2HB GLN 153 1HB GLN 153 -11.840 -4.305 -4.305 545 1HG GLN 153 2HG GLN 153 -13.007 -2.262 -2.262 546 2HG GLN 153 1HG GLN 153 -11.426 -2.033 -2.033 547 1HE2 GLN 153 1HE2 GLN 153 -11.657 -2.630 -2.630 548 2HE2 GLN 153 2HE2 GLN 153 -12.405 -4.082 -4.082 549 H GLU 154 H GLU 154 -10.544 -3.641 -3.641 550 HA GLU 154 HA GLU 154 -12.928 -3.350 -3.350 551 1HB GLU 154 2HB GLU 154 -10.207 -3.286 -3.286 552 2HB GLU 154 1HB GLU 154 -11.701 -4.094 -4.094 553 1HG GLU 154 2HG GLU 154 -11.318 -5.740 -5.740 554 2HG GLU 154 1HG GLU 154 -9.775 -4.830 -4.830 555 H LEU 155 H LEU 155 -9.989 -1.536 -1.536 556 HA LEU 155 HA LEU 155 -11.152 0.455 0.455 557 1HB LEU 155 2HB LEU 155 -9.380 -1.321 -1.321 558 2HB LEU 155 1HB LEU 155 -8.224 -0.395 -0.395 559 HG LEU 155 HG LEU 155 -9.821 1.199 1.199 560 1HD1 LEU 155 1HD1 LEU 155 -7.814 -0.943 -0.943 561 2HD1 LEU 155 3HD1 LEU 155 -8.481 0.384 0.384 562 3HD1 LEU 155 2HD1 LEU 155 -9.579 -0.880 -0.880 563 1HD2 LEU 155 3HD2 LEU 155 -7.898 2.166 2.166 564 2HD2 LEU 155 2HD2 LEU 155 -7.634 2.239 2.239 565 3HD2 LEU 155 1HD2 LEU 155 -6.780 0.981 0.981 566 H ALA 156 H ALA 156 -8.840 -0.237 -0.237 567 HA ALA 156 HA ALA 156 -8.613 2.696 2.696 568 1HB ALA 156 2HB ALA 156 -6.310 1.392 1.392 569 2HB ALA 156 1HB ALA 156 -6.882 0.647 0.647 570 3HB ALA 156 3HB ALA 156 -6.634 2.389 2.389 571 H VAL 157 H VAL 157 -9.427 3.400 3.400 572 HA VAL 157 HA VAL 157 -8.331 1.261 1.261 573 HB VAL 157 HB VAL 157 -9.684 2.087 2.087 574 1HG1 VAL 157 3HG1 VAL 157 -11.324 1.606 1.606 575 2HG1 VAL 157 2HG1 VAL 157 -11.977 1.586 1.586 576 3HG1 VAL 157 1HG1 VAL 157 -10.731 0.368 0.368 577 1HG2 VAL 157 2HG2 VAL 157 -9.668 4.657 4.657 578 2HG2 VAL 157 1HG2 VAL 157 -11.013 4.028 4.028 579 3HG2 VAL 157 3HG2 VAL 157 -11.162 4.024 4.024 580 H VAL 158 H VAL 158 -7.906 1.775 1.775 581 HA VAL 158 HA VAL 158 -5.719 3.554 3.554 582 HB VAL 158 HB VAL 158 -7.620 2.167 2.167 583 1HG1 VAL 158 3HG1 VAL 158 -5.040 3.392 3.392 584 2HG1 VAL 158 2HG1 VAL 158 -5.498 1.828 1.828 585 3HG1 VAL 158 1HG1 VAL 158 -6.617 3.217 3.217 586 1HG2 VAL 158 3HG2 VAL 158 -6.732 0.440 0.440 587 2HG2 VAL 158 2HG2 VAL 158 -6.055 0.157 0.157 588 3HG2 VAL 158 1HG2 VAL 158 -5.059 0.939 0.939 589 H GLU 159 H GLU 159 -5.779 5.296 5.296 590 HA GLU 159 HA GLU 159 -8.159 6.891 6.891 591 1HB GLU 159 2HB GLU 159 -5.900 7.663 7.663 592 2HB GLU 159 1HB GLU 159 -5.404 7.395 7.395 593 1HG GLU 159 2HG GLU 159 -6.996 9.276 9.276 594 2HG GLU 159 1HG GLU 159 -7.516 9.426 9.426 595 H SER 160 H SER 160 -5.927 5.353 5.353 596 HA SER 160 HA SER 160 -7.690 5.726 5.726 597 1HB SER 160 2HB SER 160 -6.086 7.763 7.763 598 2HB SER 160 1HB SER 160 -4.912 6.554 6.554 599 HG SER 160 HG SER 160 -6.357 6.313 6.313 600 H PHE 161 H PHE 161 -7.113 4.201 4.201 601 HA PHE 161 HA PHE 161 -4.774 2.519 2.519 602 1HB PHE 161 2HB PHE 161 -7.154 1.437 1.437 603 2HB PHE 161 1HB PHE 161 -6.812 1.500 1.500 604 HD1 PHE 161 1HD PHE 161 -4.696 0.656 0.656 605 HD2 PHE 161 2HD PHE 161 -6.258 -0.286 -0.286 606 HE1 PHE 161 1HE PHE 161 -2.862 -1.030 -1.030 607 HE2 PHE 161 2HE PHE 161 -4.472 -1.584 -1.584 608 HZ PHE 161 HZ PHE 161 -2.796 -2.172 -2.172 609 HA PRO 162 HA PRO 162 -4.764 5.728 5.728 610 1HB PRO 162 2HB PRO 162 -2.390 7.013 7.013 611 2HB PRO 162 1HB PRO 162 -3.803 6.879 6.879 612 1HG PRO 162 2HG PRO 162 -1.211 5.435 5.435 613 2HG PRO 162 1HG PRO 162 -2.528 5.683 5.683 614 1HD PRO 162 2HD PRO 162 -2.041 3.338 3.338 615 2HD PRO 162 1HD PRO 162 -3.128 3.463 3.463 616 H THR 163 H THR 163 -1.006 5.295 5.295 617 HA THR 163 HA THR 163 -1.569 6.409 6.409 618 HB THR 163 HB THR 163 1.177 6.070 6.070 619 HG1 THR 163 1HG THR 163 -0.027 5.690 5.690 620 1HG2 THR 163 3HG2 THR 163 -0.883 8.351 8.351 621 2HG2 THR 163 2HG2 THR 163 0.893 8.589 8.589 622 3HG2 THR 163 1HG2 THR 163 0.285 7.988 7.988 623 H LYS 164 H LYS 164 0.859 6.054 6.054 624 HA LYS 164 HA LYS 164 1.200 3.502 3.502 625 1HB LYS 164 2HB LYS 164 2.292 6.290 6.290 626 2HB LYS 164 1HB LYS 164 2.742 4.763 4.763 627 1HG LYS 164 2HG LYS 164 0.434 4.486 4.486 628 2HG LYS 164 1HG LYS 164 -0.129 5.877 5.877 629 1HD LYS 164 2HD LYS 164 0.090 6.610 6.610 630 2HD LYS 164 1HD LYS 164 1.315 7.435 7.435 631 1HE LYS 164 2HE LYS 164 2.297 6.798 6.798 632 2HE LYS 164 1HE LYS 164 3.084 5.819 5.819 633 1HZ LYS 164 2HZ LYS 164 0.844 4.936 4.936 634 2HZ LYS 164 1HZ LYS 164 2.480 4.511 4.511 635 3HZ LYS 164 3HZ LYS 164 1.606 4.008 4.008 636 H ILE 165 H ILE 165 3.286 2.542 2.542 637 HA ILE 165 HA ILE 165 4.678 3.443 3.443 638 HB ILE 165 HB ILE 165 5.648 1.543 1.543 639 1HG1 ILE 165 2HG1 ILE 165 3.668 0.889 0.889 640 2HG1 ILE 165 1HG1 ILE 165 3.201 0.948 0.948 641 1HG2 ILE 165 3HG2 ILE 165 7.170 2.189 2.189 642 2HG2 ILE 165 2HG2 ILE 165 5.949 1.419 1.419 643 3HG2 ILE 165 1HG2 ILE 165 6.844 0.437 0.437 644 1HD1 ILE 165 1HD1 ILE 165 5.338 -1.007 -1.007 645 2HD1 ILE 165 3HD1 ILE 165 3.574 -1.358 -1.358 646 3HD1 ILE 165 2HD1 ILE 165 4.475 -0.964 -0.964 647 H GLU 166 H GLU 166 6.519 4.443 4.443 648 HA GLU 166 HA GLU 166 7.715 5.558 5.558 649 1HB GLU 166 2HB GLU 166 7.177 7.017 7.017 650 2HB GLU 166 1HB GLU 166 8.662 7.343 7.343 651 1HG GLU 166 2HG GLU 166 7.104 8.967 8.967 652 2HG GLU 166 1HG GLU 166 7.228 7.755 7.755 653 H GLY 167 H GLY 167 9.576 4.392 4.392 654 1HA GLY 167 2HA GLY 167 11.527 3.419 3.419 655 2HA GLY 167 1HA GLY 167 11.282 4.088 4.088 656 H ARG 168 H ARG 168 11.802 2.203 2.203 657 HA ARG 168 HA ARG 168 10.217 -0.140 -0.140 658 1HB ARG 168 2HB ARG 168 11.918 -1.326 -1.326 659 2HB ARG 168 1HB ARG 168 12.612 -0.580 -0.580 660 1HG ARG 168 2HG ARG 168 13.482 1.341 1.341 661 2HG ARG 168 1HG ARG 168 12.698 0.767 0.767 662 1HD ARG 168 2HD ARG 168 14.100 -1.330 -1.330 663 2HD ARG 168 1HD ARG 168 15.014 -0.611 -0.611 664 HE ARG 168 HE ARG 168 14.855 1.337 1.337 665 1HH1 ARG 168 1HH1 ARG 168 16.301 -1.840 -1.840 666 2HH1 ARG 168 2HH1 ARG 168 17.640 -1.640 -1.640 667 1HH2 ARG 168 1HH2 ARG 168 16.673 1.603 1.603 668 2HH2 ARG 168 2HH2 ARG 168 17.857 0.348 0.348 669 H GLN 169 H GLN 169 8.807 1.963 1.963 670 HA GLN 169 HA GLN 169 7.957 0.768 0.768 671 1HB GLN 169 2HB GLN 169 8.370 2.935 2.935 672 2HB GLN 169 1HB GLN 169 9.648 1.669 1.669 673 1HG GLN 169 2HG GLN 169 10.897 2.642 2.642 674 2HG GLN 169 1HG GLN 169 9.648 3.874 3.874 675 1HE2 GLN 169 1HE2 GLN 169 8.851 4.738 4.738 676 2HE2 GLN 169 2HE2 GLN 169 10.140 5.578 5.578 677 H MET 170 H MET 170 6.020 1.519 1.519 678 HA MET 170 HA MET 170 4.934 3.832 3.832 679 1HB MET 170 2HB MET 170 4.015 1.464 1.464 680 2HB MET 170 1HB MET 170 3.287 1.387 1.387 681 1HG MET 170 2HG MET 170 2.282 3.789 3.789 682 2HG MET 170 1HG MET 170 2.608 2.964 2.964 683 1HE MET 170 3HE MET 170 2.007 -0.055 -0.055 684 2HE MET 170 2HE MET 170 0.243 -0.158 -0.158 685 3HE MET 170 1HE MET 170 1.271 0.914 0.914 686 H ILE 171 H ILE 171 3.151 4.850 4.850 687 HA ILE 171 HA ILE 171 3.225 3.968 3.968 688 HB ILE 171 HB ILE 171 2.297 6.502 6.502 689 1HG1 ILE 171 2HG1 ILE 171 4.818 6.026 6.026 690 2HG1 ILE 171 1HG1 ILE 171 4.174 7.617 7.617 691 1HG2 ILE 171 2HG2 ILE 171 2.036 5.617 5.617 692 2HG2 ILE 171 1HG2 ILE 171 2.078 7.377 7.377 693 3HG2 ILE 171 3HG2 ILE 171 0.743 6.353 6.353 694 1HD1 ILE 171 2HD1 ILE 171 3.957 6.363 6.363 695 2HD1 ILE 171 1HD1 ILE 171 4.651 4.976 4.976 696 3HD1 ILE 171 3HD1 ILE 171 5.661 6.446 6.446 697 H MET 172 H MET 172 1.341 3.235 3.235 698 HA MET 172 HA MET 172 -1.224 4.029 4.029 699 1HB MET 172 2HB MET 172 -1.385 1.575 1.575 700 2HB MET 172 1HB MET 172 -0.583 1.517 1.517 701 1HG MET 172 2HG MET 172 -3.146 3.083 3.083 702 2HG MET 172 1HG MET 172 -3.331 1.354 1.354 703 1HE MET 172 3HE MET 172 -3.478 -0.334 -0.334 704 2HE MET 172 2HE MET 172 -1.758 -0.441 -0.441 705 3HE MET 172 1HE MET 172 -3.030 -0.411 -0.411 706 H VAL 173 H VAL 173 -2.249 5.447 5.447 707 HA VAL 173 HA VAL 173 -0.829 6.021 6.021 708 HB VAL 173 HB VAL 173 -3.350 7.313 7.313 709 1HG1 VAL 173 1HG1 VAL 173 -1.331 7.672 7.672 710 2HG1 VAL 173 3HG1 VAL 173 -2.019 9.184 9.184 711 3HG1 VAL 173 2HG1 VAL 173 -3.115 7.972 7.972 712 1HG2 VAL 173 1HG2 VAL 173 -0.372 7.863 7.863 713 2HG2 VAL 173 3HG2 VAL 173 -1.667 7.486 7.486 714 3HG2 VAL 173 2HG2 VAL 173 -1.694 9.049 9.049 715 H LEU 174 H LEU 174 -1.769 5.530 5.530 716 HA LEU 174 HA LEU 174 -4.124 3.846 3.846 717 1HB LEU 174 2HB LEU 174 -1.667 2.992 2.992 718 2HB LEU 174 1HB LEU 174 -1.852 3.477 3.477 719 HG LEU 174 HG LEU 174 -2.387 1.017 1.017 720 1HD1 LEU 174 3HD1 LEU 174 -2.179 1.633 1.633 721 2HD1 LEU 174 2HD1 LEU 174 -4.004 1.714 1.714 722 3HD1 LEU 174 1HD1 LEU 174 -3.150 0.204 0.204 723 1HD2 LEU 174 2HD2 LEU 174 -4.427 1.916 1.916 724 2HD2 LEU 174 1HD2 LEU 174 -4.828 0.612 0.612 725 3HD2 LEU 174 3HD2 LEU 174 -5.010 2.392 2.392 726 H ALA 175 H ALA 175 -5.539 5.803 5.803 727 HA ALA 175 HA ALA 175 -4.835 6.995 6.995 728 1HB ALA 175 3HB ALA 175 -5.812 8.111 8.111 729 2HB ALA 175 2HB ALA 175 -7.346 7.078 7.078 730 3HB ALA 175 1HB ALA 175 -6.869 8.434 8.434 731 HA PRO 176 HA PRO 176 -8.286 5.351 5.351 732 1HB PRO 176 2HB PRO 176 -9.242 8.237 8.237 733 2HB PRO 176 1HB PRO 176 -9.168 7.008 7.008 734 1HG PRO 176 2HG PRO 176 -7.244 8.953 8.953 735 2HG PRO 176 1HG PRO 176 -6.764 7.234 7.234 736 1HD PRO 176 2HD PRO 176 -6.575 8.758 8.758 737 2HD PRO 176 1HD PRO 176 -5.457 7.537 7.537 738 H LYS 177 H LYS 177 -10.360 4.557 4.557 739 HA LYS 177 HA LYS 177 -11.247 5.458 5.458 740 1HB LYS 177 2HB LYS 177 -12.956 3.738 3.738 741 2HB LYS 177 1HB LYS 177 -11.419 3.139 3.139 742 1HG LYS 177 2HG LYS 177 -12.270 3.643 3.643 743 2HG LYS 177 1HG LYS 177 -13.867 4.110 4.110 744 1HD LYS 177 2HD LYS 177 -14.212 1.877 1.877 745 2HD LYS 177 1HD LYS 177 -12.541 1.379 1.379 746 1HE LYS 177 2HE LYS 177 -14.285 0.496 0.496 747 2HE LYS 177 1HE LYS 177 -13.038 1.541 1.541 748 1HZ LYS 177 2HZ LYS 177 -14.600 3.366 3.366 749 2HZ LYS 177 1HZ LYS 177 -15.767 2.384 2.384 750 3HZ LYS 177 3HZ LYS 177 -15.253 2.040 2.040 751 H LYS 178 H LYS 178 -13.134 6.449 6.449 752 HA LYS 178 HA LYS 178 -14.504 8.023 8.023 753 1HB LYS 178 2HB LYS 178 -14.218 8.230 8.230 754 2HB LYS 178 1HB LYS 178 -15.254 9.357 9.357 755 1HG LYS 178 2HG LYS 178 -12.182 9.063 9.063 756 2HG LYS 178 1HG LYS 178 -13.074 10.352 10.352 757 1HD LYS 178 2HD LYS 178 -14.100 11.112 11.112 758 2HD LYS 178 1HD LYS 178 -13.151 9.863 9.863 759 1HE LYS 178 2HE LYS 178 -11.012 10.929 10.929 760 2HE LYS 178 1HE LYS 178 -11.959 12.181 12.181 761 1HZ LYS 178 2HZ LYS 178 -12.954 12.855 12.855 762 2HZ LYS 178 1HZ LYS 178 -12.067 11.685 11.685 763 3HZ LYS 178 3HZ LYS 178 -11.261 12.957 12.957 764 H LYS 179 H LYS 179 -15.396 5.691 5.691 765 HA LYS 179 HA LYS 179 -17.214 4.777 4.777 766 1HB LYS 179 2HB LYS 179 -15.960 3.251 3.251 767 2HB LYS 179 1HB LYS 179 -16.964 3.889 3.889 768 1HG LYS 179 2HG LYS 179 -19.022 2.966 2.966 769 2HG LYS 179 1HG LYS 179 -18.008 2.442 2.442 770 1HD LYS 179 2HD LYS 179 -16.700 0.947 0.947 771 2HD LYS 179 1HD LYS 179 -17.768 1.447 1.447 772 1HE LYS 179 2HE LYS 179 -19.759 0.487 0.487 773 2HE LYS 179 1HE LYS 179 -18.658 -0.036 -0.036 774 1HZ LYS 179 3HZ LYS 179 -17.442 -1.360 -1.360 775 2HZ LYS 179 2HZ LYS 179 -18.509 -0.891 -0.891 776 3HZ LYS 179 1HZ LYS 179 -19.080 -1.806 -1.806 777 H GLN 180 H GLN 180 -19.160 5.679 5.679 778 HA GLN 180 HA GLN 180 -20.646 6.591 6.591 779 1HB GLN 180 2HB GLN 180 -19.786 8.617 8.617 780 2HB GLN 180 1HB GLN 180 -20.557 7.976 7.976 781 1HG GLN 180 2HG GLN 180 -22.823 8.152 8.152 782 2HG GLN 180 1HG GLN 180 -22.026 8.788 8.788 783 1HE2 GLN 180 1HE2 GLN 180 -23.540 9.614 9.614 784 2HE2 GLN 180 2HE2 GLN 180 -22.954 11.232 11.232 Start of MODEL 22 1 HA VAL 90 HA VAL 90 -3.479 16.738 16.738 2 HB VAL 90 HB VAL 90 -2.101 17.202 17.202 3 1HG1 VAL 90 3HG1 VAL 90 -2.239 19.214 19.214 4 2HG1 VAL 90 2HG1 VAL 90 -2.011 19.558 19.558 5 3HG1 VAL 90 1HG1 VAL 90 -3.508 18.714 18.714 6 1HG2 VAL 90 3HG2 VAL 90 0.147 17.648 17.648 7 2HG2 VAL 90 2HG2 VAL 90 0.056 16.363 16.363 8 3HG2 VAL 90 1HG2 VAL 90 0.149 18.094 18.094 9 H ILE 91 H ILE 91 -2.960 15.706 15.706 10 HA ILE 91 HA ILE 91 -2.623 12.870 12.870 11 HB ILE 91 HB ILE 91 -3.530 14.374 14.374 12 1HG1 ILE 91 2HG1 ILE 91 -5.182 14.619 14.619 13 2HG1 ILE 91 1HG1 ILE 91 -5.781 13.427 13.427 14 1HG2 ILE 91 1HG2 ILE 91 -3.352 11.356 11.356 15 2HG2 ILE 91 3HG2 ILE 91 -4.320 12.046 12.046 16 3HG2 ILE 91 2HG2 ILE 91 -2.540 12.241 12.241 17 1HD1 ILE 91 2HD1 ILE 91 -4.986 11.551 11.551 18 2HD1 ILE 91 1HD1 ILE 91 -4.534 12.792 12.792 19 3HD1 ILE 91 3HD1 ILE 91 -6.259 12.598 12.598 20 H GLN 92 H GLN 92 -0.825 11.885 11.885 21 HA GLN 92 HA GLN 92 1.397 13.329 13.329 22 1HB GLN 92 2HB GLN 92 1.226 10.778 10.778 23 2HB GLN 92 1HB GLN 92 2.718 11.739 11.739 24 1HG GLN 92 2HG GLN 92 1.924 13.536 13.536 25 2HG GLN 92 1HG GLN 92 0.231 13.003 13.003 26 1HE2 GLN 92 1HE2 GLN 92 -0.624 12.042 12.042 27 2HE2 GLN 92 2HE2 GLN 92 0.198 11.144 11.144 28 H VAL 93 H VAL 93 3.086 11.826 11.826 29 HA VAL 93 HA VAL 93 1.654 9.774 9.774 30 HB VAL 93 HB VAL 93 4.289 11.193 11.193 31 1HG1 VAL 93 3HG1 VAL 93 2.797 8.769 8.769 32 2HG1 VAL 93 2HG1 VAL 93 4.024 9.695 9.695 33 3HG1 VAL 93 1HG1 VAL 93 4.557 8.786 8.786 34 1HG2 VAL 93 1HG2 VAL 93 1.962 12.263 12.263 35 2HG2 VAL 93 3HG2 VAL 93 3.013 11.827 11.827 36 3HG2 VAL 93 2HG2 VAL 93 1.715 10.693 10.693 37 H LYS 94 H LYS 94 1.866 7.661 7.661 38 HA LYS 94 HA LYS 94 4.722 7.194 7.194 39 1HB LYS 94 2HB LYS 94 2.524 5.171 5.171 40 2HB LYS 94 1HB LYS 94 4.104 5.107 5.107 41 1HG LYS 94 2HG LYS 94 1.843 7.102 7.102 42 2HG LYS 94 1HG LYS 94 2.123 5.609 5.609 43 1HD LYS 94 2HD LYS 94 4.159 7.914 7.914 44 2HD LYS 94 1HD LYS 94 2.984 7.681 7.681 45 1HE LYS 94 2HE LYS 94 4.011 5.465 5.465 46 2HE LYS 94 1HE LYS 94 5.239 5.706 5.706 47 1HZ LYS 94 1HZ LYS 94 4.803 7.481 7.481 48 2HZ LYS 94 3HZ LYS 94 6.067 6.365 6.365 49 3HZ LYS 94 2HZ LYS 94 5.947 7.714 7.714 50 H GLU 95 H GLU 95 5.411 4.923 4.923 51 HA GLU 95 HA GLU 95 4.165 4.651 4.651 52 1HB GLU 95 2HB GLU 95 6.225 6.190 6.190 53 2HB GLU 95 1HB GLU 95 7.083 4.683 4.683 54 1HG GLU 95 2HG GLU 95 6.602 3.648 3.648 55 2HG GLU 95 1HG GLU 95 5.562 5.065 5.065 56 H ILE 96 H ILE 96 4.507 2.523 2.523 57 HA ILE 96 HA ILE 96 6.087 0.704 0.704 58 HB ILE 96 HB ILE 96 3.340 0.587 0.587 59 1HG1 ILE 96 2HG1 ILE 96 3.602 -1.915 -1.915 60 2HG1 ILE 96 1HG1 ILE 96 5.298 -1.807 -1.807 61 1HG2 ILE 96 3HG2 ILE 96 3.037 0.413 0.413 62 2HG2 ILE 96 2HG2 ILE 96 3.813 -1.248 -1.248 63 3HG2 ILE 96 1HG2 ILE 96 2.358 -0.953 -0.953 64 1HD1 ILE 96 1HD1 ILE 96 4.082 -0.328 -0.328 65 2HD1 ILE 96 3HD1 ILE 96 5.163 -1.769 -1.769 66 3HD1 ILE 96 2HD1 ILE 96 5.802 -0.194 -0.194 67 H LYS 97 H LYS 97 6.873 -1.142 -1.142 68 HA LYS 97 HA LYS 97 6.201 -0.432 -0.432 69 1HB LYS 97 2HB LYS 97 8.733 -1.952 -1.952 70 2HB LYS 97 1HB LYS 97 8.008 -1.587 -1.587 71 1HG LYS 97 2HG LYS 97 8.336 0.840 0.840 72 2HG LYS 97 1HG LYS 97 9.100 0.524 0.524 73 1HD LYS 97 2HD LYS 97 10.928 -0.753 -0.753 74 2HD LYS 97 1HD LYS 97 10.146 -0.567 -0.567 75 1HE LYS 97 2HE LYS 97 11.183 1.789 1.789 76 2HE LYS 97 1HE LYS 97 12.063 1.037 1.037 77 1HZ LYS 97 1HZ LYS 97 9.386 2.320 2.320 78 2HZ LYS 97 3HZ LYS 97 10.853 2.994 2.994 79 3HZ LYS 97 2HZ LYS 97 10.222 1.620 1.620 80 H PHE 98 H PHE 98 5.755 -2.097 -2.097 81 HA PHE 98 HA PHE 98 5.624 -4.739 -4.739 82 1HB PHE 98 2HB PHE 98 3.545 -3.391 -3.391 83 2HB PHE 98 1HB PHE 98 3.622 -5.157 -5.157 84 HD1 PHE 98 2HD PHE 98 3.964 -5.759 -5.759 85 HD2 PHE 98 1HD PHE 98 1.897 -2.603 -2.603 86 HE1 PHE 98 2HE PHE 98 2.778 -5.410 -5.410 87 HE2 PHE 98 1HE PHE 98 0.565 -2.259 -2.259 88 HZ PHE 98 HZ PHE 98 0.903 -3.852 -3.852 89 H ARG 99 H ARG 99 6.609 -6.256 -6.256 90 HA ARG 99 HA ARG 99 8.156 -5.325 -5.325 91 1HB ARG 99 2HB ARG 99 8.222 -7.831 -7.831 92 2HB ARG 99 1HB ARG 99 9.441 -7.340 -7.340 93 1HG ARG 99 2HG ARG 99 10.607 -6.242 -6.242 94 2HG ARG 99 1HG ARG 99 9.232 -5.128 -5.128 95 1HD ARG 99 2HD ARG 99 9.723 -7.801 -7.801 96 2HD ARG 99 1HD ARG 99 10.001 -6.119 -6.119 97 HE ARG 99 HE ARG 99 7.250 -6.674 -6.674 98 1HH1 ARG 99 1HH1 ARG 99 9.497 -6.673 -6.673 99 2HH1 ARG 99 2HH1 ARG 99 8.239 -6.663 -6.663 100 1HH2 ARG 99 1HH2 ARG 99 5.568 -6.664 -6.664 101 2HH2 ARG 99 2HH2 ARG 99 5.980 -6.657 -6.657 102 HA PRO 100 HA PRO 100 6.026 -8.062 -8.062 103 1HB PRO 100 2HB PRO 100 8.763 -9.351 -9.351 104 2HB PRO 100 1HB PRO 100 7.589 -8.812 -8.812 105 1HG PRO 100 2HG PRO 100 9.878 -7.389 -7.389 106 2HG PRO 100 1HG PRO 100 8.440 -6.592 -6.592 107 1HD PRO 100 2HD PRO 100 9.344 -6.334 -6.334 108 2HD PRO 100 1HD PRO 100 7.890 -5.598 -5.598 109 H GLY 101 H GLY 101 5.052 -10.050 -10.050 110 1HA GLY 101 2HA GLY 101 4.452 -12.020 -12.020 111 2HA GLY 101 1HA GLY 101 6.175 -12.253 -12.253 112 H THR 102 H THR 102 6.232 -12.631 -12.631 113 HA THR 102 HA THR 102 6.257 -12.561 -12.561 114 HB THR 102 HB THR 102 5.581 -9.624 -9.624 115 HG1 THR 102 1HG THR 102 7.853 -9.432 -9.432 116 1HG2 THR 102 1HG2 THR 102 6.842 -11.526 -11.526 117 2HG2 THR 102 3HG2 THR 102 7.218 -9.749 -9.749 118 3HG2 THR 102 2HG2 THR 102 5.536 -10.321 -10.321 119 H ASP 103 H ASP 103 4.733 -13.742 -13.742 120 HA ASP 103 HA ASP 103 2.452 -12.267 -12.267 121 1HB ASP 103 2HB ASP 103 2.303 -14.033 -14.033 122 2HB ASP 103 1HB ASP 103 2.602 -15.206 -15.206 123 H GLU 104 H GLU 104 3.606 -15.445 -15.445 124 HA GLU 104 HA GLU 104 1.033 -14.252 -14.252 125 1HB GLU 104 2HB GLU 104 2.358 -16.358 -16.358 126 2HB GLU 104 1HB GLU 104 0.671 -15.764 -15.764 127 1HG GLU 104 2HG GLU 104 0.112 -16.543 -16.543 128 2HG GLU 104 1HG GLU 104 1.786 -17.205 -17.205 129 H GLY 105 H GLY 105 3.195 -14.940 -14.940 130 1HA GLY 105 2HA GLY 105 2.588 -12.224 -12.224 131 2HA GLY 105 1HA GLY 105 3.018 -13.639 -13.639 132 H ASP 106 H ASP 106 4.451 -12.458 -12.458 133 HA ASP 106 HA ASP 106 6.433 -11.024 -11.024 134 1HB ASP 106 2HB ASP 106 7.252 -12.480 -12.480 135 2HB ASP 106 1HB ASP 106 6.400 -11.433 -11.433 136 H TYR 107 H TYR 107 3.988 -11.106 -11.106 137 HA TYR 107 HA TYR 107 3.986 -8.340 -8.340 138 1HB TYR 107 2HB TYR 107 3.382 -10.247 -10.247 139 2HB TYR 107 1HB TYR 107 2.065 -10.746 -10.746 140 HD1 TYR 107 1HD TYR 107 1.956 -7.164 -7.164 141 HD2 TYR 107 2HD TYR 107 1.110 -10.869 -10.869 142 HE1 TYR 107 1HE TYR 107 -0.148 -6.247 -6.247 143 HE2 TYR 107 2HE TYR 107 -0.685 -9.803 -9.803 144 HH TYR 107 HH TYR 107 -1.771 -6.536 -6.536 145 H GLN 108 H GLN 108 1.111 -10.217 -10.217 146 HA GLN 108 HA GLN 108 0.045 -8.163 -8.163 147 1HB GLN 108 2HB GLN 108 -0.808 -10.661 -10.661 148 2HB GLN 108 1HB GLN 108 -1.691 -9.335 -9.335 149 1HG GLN 108 2HG GLN 108 -0.152 -11.229 -11.229 150 2HG GLN 108 1HG GLN 108 -1.529 -11.802 -11.802 151 1HE2 GLN 108 1HE2 GLN 108 -0.477 -8.646 -8.646 152 2HE2 GLN 108 2HE2 GLN 108 -1.916 -8.367 -8.367 153 H VAL 109 H VAL 109 2.600 -9.609 -9.609 154 HA VAL 109 HA VAL 109 2.129 -8.709 -8.709 155 HB VAL 109 HB VAL 109 4.677 -9.258 -9.258 156 1HG1 VAL 109 2HG1 VAL 109 4.346 -8.149 -8.149 157 2HG1 VAL 109 1HG1 VAL 109 5.818 -9.016 -9.016 158 3HG1 VAL 109 3HG1 VAL 109 5.368 -7.466 -7.466 159 1HG2 VAL 109 3HG2 VAL 109 3.183 -11.159 -11.159 160 2HG2 VAL 109 2HG2 VAL 109 4.802 -11.140 -11.140 161 3HG2 VAL 109 1HG2 VAL 109 3.344 -10.547 -10.547 162 H LYS 110 H LYS 110 3.406 -7.197 -7.197 163 HA LYS 110 HA LYS 110 3.482 -4.643 -4.643 164 1HB LYS 110 2HB LYS 110 4.445 -5.611 -5.611 165 2HB LYS 110 1HB LYS 110 4.433 -3.904 -3.904 166 1HG LYS 110 2HG LYS 110 6.061 -6.210 -6.210 167 2HG LYS 110 1HG LYS 110 6.534 -4.512 -4.512 168 1HD LYS 110 2HD LYS 110 5.597 -3.598 -3.598 169 2HD LYS 110 1HD LYS 110 5.238 -5.262 -5.262 170 1HE LYS 110 2HE LYS 110 8.054 -4.143 -4.143 171 2HE LYS 110 1HE LYS 110 7.366 -4.427 -4.427 172 1HZ LYS 110 1HZ LYS 110 7.185 -6.762 -6.762 173 2HZ LYS 110 3HZ LYS 110 7.839 -6.491 -6.491 174 3HZ LYS 110 2HZ LYS 110 8.785 -6.212 -6.212 175 H LEU 111 H LEU 111 1.172 -6.363 -6.363 176 HA LEU 111 HA LEU 111 -0.213 -3.992 -3.992 177 1HB LEU 111 2HB LEU 111 -0.550 -6.326 -6.326 178 2HB LEU 111 1HB LEU 111 -1.378 -6.766 -6.766 179 HG LEU 111 HG LEU 111 -2.265 -4.363 -4.363 180 1HD1 LEU 111 3HD1 LEU 111 -2.010 -6.340 -6.340 181 2HD1 LEU 111 2HD1 LEU 111 -3.118 -7.282 -7.282 182 3HD1 LEU 111 1HD1 LEU 111 -3.728 -5.823 -5.823 183 1HD2 LEU 111 1HD2 LEU 111 -3.633 -6.362 -6.362 184 2HD2 LEU 111 3HD2 LEU 111 -3.470 -4.573 -4.573 185 3HD2 LEU 111 2HD2 LEU 111 -4.574 -5.260 -5.260 186 H ARG 112 H ARG 112 0.401 -6.136 -6.136 187 HA ARG 112 HA ARG 112 -1.378 -5.054 -5.054 188 1HB ARG 112 2HB ARG 112 0.466 -7.035 -7.035 189 2HB ARG 112 1HB ARG 112 1.190 -5.826 -5.826 190 1HG ARG 112 2HG ARG 112 -0.982 -5.761 -5.761 191 2HG ARG 112 1HG ARG 112 -1.662 -6.979 -6.979 192 1HD ARG 112 2HD ARG 112 0.704 -7.384 -7.384 193 2HD ARG 112 1HD ARG 112 -0.919 -8.172 -8.172 194 HE ARG 112 HE ARG 112 1.327 -8.856 -8.856 195 1HH1 ARG 112 1HH2 ARG 112 -2.169 -9.213 -9.213 196 2HH1 ARG 112 2HH2 ARG 112 -2.339 -10.647 -10.647 197 1HH2 ARG 112 1HH1 ARG 112 1.072 -10.780 -10.780 198 2HH2 ARG 112 2HH1 ARG 112 -0.474 -11.548 -11.548 199 H SER 113 H SER 113 2.122 -4.063 -4.063 200 HA SER 113 HA SER 113 2.182 -2.065 -2.065 201 1HB SER 113 2HB SER 113 4.100 -2.938 -2.938 202 2HB SER 113 1HB SER 113 3.565 -2.175 -2.175 203 HG SER 113 HG SER 113 5.065 -0.926 -0.926 204 H LEU 114 H LEU 114 0.847 -2.016 -2.016 205 HA LEU 114 HA LEU 114 0.295 0.759 0.759 206 1HB LEU 114 2HB LEU 114 -1.099 -1.713 -1.713 207 2HB LEU 114 1HB LEU 114 -1.598 -0.033 -0.033 208 HG LEU 114 HG LEU 114 1.224 -1.139 -1.139 209 1HD1 LEU 114 1HD1 LEU 114 -1.253 -0.753 -0.753 210 2HD1 LEU 114 3HD1 LEU 114 0.387 -1.202 -1.202 211 3HD1 LEU 114 2HD1 LEU 114 -0.515 -2.313 -2.313 212 1HD2 LEU 114 3HD2 LEU 114 -0.259 1.494 1.494 213 2HD2 LEU 114 2HD2 LEU 114 1.264 1.241 1.241 214 3HD2 LEU 114 1HD2 LEU 114 1.244 1.112 1.112 215 H ILE 115 H ILE 115 -1.670 -1.982 -1.982 216 HA ILE 115 HA ILE 115 -4.007 -0.539 -0.539 217 HB ILE 115 HB ILE 115 -3.350 -2.011 -2.011 218 1HG1 ILE 115 2HG1 ILE 115 -2.558 -3.598 -3.598 219 2HG1 ILE 115 1HG1 ILE 115 -3.984 -4.178 -4.178 220 1HG2 ILE 115 3HG2 ILE 115 -5.656 -1.499 -1.499 221 2HG2 ILE 115 2HG2 ILE 115 -5.776 -2.574 -2.574 222 3HG2 ILE 115 1HG2 ILE 115 -5.345 -0.837 -0.837 223 1HD1 ILE 115 2HD1 ILE 115 -5.451 -3.424 -3.424 224 2HD1 ILE 115 1HD1 ILE 115 -3.901 -2.981 -2.981 225 3HD1 ILE 115 3HD1 ILE 115 -4.258 -4.712 -4.712 226 H ARG 116 H ARG 116 -1.348 -0.867 -0.867 227 HA ARG 116 HA ARG 116 -2.042 0.707 0.707 228 1HB ARG 116 2HB ARG 116 -0.206 -0.745 -0.745 229 2HB ARG 116 1HB ARG 116 0.674 -0.087 -0.087 230 1HG ARG 116 2HG ARG 116 1.263 1.931 1.931 231 2HG ARG 116 1HG ARG 116 0.136 1.582 1.582 232 1HD ARG 116 2HD ARG 116 1.554 -0.404 -0.404 233 2HD ARG 116 1HD ARG 116 2.693 0.004 0.004 234 HE ARG 116 HE ARG 116 2.347 2.372 2.372 235 1HH1 ARG 116 1HH2 ARG 116 3.585 -0.954 -0.954 236 2HH1 ARG 116 2HH2 ARG 116 4.736 -0.539 -0.539 237 1HH2 ARG 116 1HH1 ARG 116 3.915 2.923 2.923 238 2HH2 ARG 116 2HH1 ARG 116 4.928 1.694 1.694 239 H PHE 117 H PHE 117 -0.367 1.732 1.732 240 HA PHE 117 HA PHE 117 0.026 4.302 4.302 241 1HB PHE 117 2HB PHE 117 -0.579 2.994 2.994 242 2HB PHE 117 1HB PHE 117 0.184 4.599 4.599 243 HD1 PHE 117 1HD PHE 117 1.644 2.734 2.734 244 HD2 PHE 117 2HD PHE 117 1.266 3.010 3.010 245 HE1 PHE 117 1HE PHE 117 3.976 1.985 1.985 246 HE2 PHE 117 2HE PHE 117 3.599 2.102 2.102 247 HZ PHE 117 HZ PHE 117 4.974 1.675 1.675 248 H LEU 118 H LEU 118 -2.785 2.938 2.938 249 HA LEU 118 HA LEU 118 -4.223 5.373 5.373 250 1HB LEU 118 2HB LEU 118 -4.822 2.513 2.513 251 2HB LEU 118 1HB LEU 118 -6.070 3.819 3.819 252 HG LEU 118 HG LEU 118 -3.453 4.688 4.688 253 1HD1 LEU 118 1HD1 LEU 118 -3.760 2.021 2.021 254 2HD1 LEU 118 3HD1 LEU 118 -4.511 2.792 2.792 255 3HD1 LEU 118 2HD1 LEU 118 -2.815 3.272 3.272 256 1HD2 LEU 118 3HD2 LEU 118 -5.666 5.692 5.692 257 2HD2 LEU 118 2HD2 LEU 118 -4.789 5.376 5.376 258 3HD2 LEU 118 1HD2 LEU 118 -6.158 4.297 4.297 259 H GLU 119 H GLU 119 -3.972 3.087 3.087 260 HA GLU 119 HA GLU 119 -6.363 3.842 3.842 261 1HB GLU 119 2HB GLU 119 -3.889 2.284 2.284 262 2HB GLU 119 1HB GLU 119 -5.037 2.866 2.866 263 1HG GLU 119 2HG GLU 119 -6.907 1.638 1.638 264 2HG GLU 119 1HG GLU 119 -5.798 1.040 1.040 265 H GLU 120 H GLU 120 -2.926 4.886 4.886 266 HA GLU 120 HA GLU 120 -3.260 6.701 6.701 267 1HB GLU 120 2HB GLU 120 -1.423 7.130 7.130 268 2HB GLU 120 1HB GLU 120 -1.313 7.935 7.935 269 1HG GLU 120 2HG GLU 120 -0.721 5.663 5.663 270 2HG GLU 120 1HG GLU 120 -0.685 4.988 4.988 271 H GLY 121 H GLY 121 -4.145 6.641 6.641 272 1HA GLY 121 2HA GLY 121 -5.439 7.990 7.990 273 2HA GLY 121 1HA GLY 121 -5.324 9.234 9.234 274 H ASP 122 H ASP 122 -3.287 7.395 7.395 275 HA ASP 122 HA ASP 122 -2.057 9.941 9.941 276 1HB ASP 122 2HB ASP 122 -0.677 7.238 7.238 277 2HB ASP 122 1HB ASP 122 0.062 8.845 8.845 278 H LYS 123 H LYS 123 -1.329 9.481 9.481 279 HA LYS 123 HA LYS 123 -3.092 7.375 7.375 280 1HB LYS 123 2HB LYS 123 -1.530 8.413 8.413 281 2HB LYS 123 1HB LYS 123 -3.295 8.364 8.364 282 1HG LYS 123 2HG LYS 123 -3.284 10.511 10.511 283 2HG LYS 123 1HG LYS 123 -3.012 10.678 10.678 284 1HD LYS 123 2HD LYS 123 -1.509 12.108 12.108 285 2HD LYS 123 1HD LYS 123 -0.538 10.946 10.946 286 1HE LYS 123 2HE LYS 123 0.084 9.665 9.665 287 2HE LYS 123 1HE LYS 123 -1.428 10.046 10.046 288 1HZ LYS 123 3HZ LYS 123 0.824 11.919 11.919 289 2HZ LYS 123 2HZ LYS 123 0.489 11.103 11.103 290 3HZ LYS 123 1HZ LYS 123 -0.599 12.265 12.265 291 H ALA 124 H ALA 124 -1.920 5.545 5.545 292 HA ALA 124 HA ALA 124 0.970 6.002 6.002 293 1HB ALA 124 3HB ALA 124 -0.175 3.762 3.762 294 2HB ALA 124 2HB ALA 124 -0.357 3.509 3.509 295 3HB ALA 124 1HB ALA 124 1.285 3.682 3.682 296 H LYS 125 H LYS 125 2.258 5.669 5.669 297 HA LYS 125 HA LYS 125 0.464 5.470 5.470 298 1HB LYS 125 2HB LYS 125 3.477 6.241 6.241 299 2HB LYS 125 1HB LYS 125 2.590 6.008 6.008 300 1HG LYS 125 2HG LYS 125 1.185 7.976 7.976 301 2HG LYS 125 1HG LYS 125 1.961 8.191 8.191 302 1HD LYS 125 2HD LYS 125 4.087 8.767 8.767 303 2HD LYS 125 1HD LYS 125 3.619 8.138 8.138 304 1HE LYS 125 2HE LYS 125 2.025 9.954 9.954 305 2HE LYS 125 1HE LYS 125 2.365 10.631 10.631 306 1HZ LYS 125 1HZ LYS 125 4.655 10.929 10.929 307 2HZ LYS 125 3HZ LYS 125 4.317 10.325 10.325 308 3HZ LYS 125 2HZ LYS 125 3.595 11.770 11.770 309 H ILE 126 H ILE 126 0.527 3.514 3.514 310 HA ILE 126 HA ILE 126 2.576 1.658 1.658 311 HB ILE 126 HB ILE 126 0.737 1.610 1.610 312 1HG1 ILE 126 2HG1 ILE 126 -0.914 1.738 1.738 313 2HG1 ILE 126 1HG1 ILE 126 -0.623 -0.023 -0.023 314 1HG2 ILE 126 3HG2 ILE 126 2.435 -0.365 -0.365 315 2HG2 ILE 126 2HG2 ILE 126 1.159 -0.878 -0.878 316 3HG2 ILE 126 1HG2 ILE 126 2.604 0.023 0.023 317 1HD1 ILE 126 3HD1 ILE 126 0.953 0.288 0.288 318 2HD1 ILE 126 2HD1 ILE 126 0.085 1.857 1.857 319 3HD1 ILE 126 1HD1 ILE 126 -0.853 0.307 0.307 320 H THR 127 H THR 127 4.534 1.556 1.556 321 HA THR 127 HA THR 127 4.715 2.941 2.941 322 HB THR 127 HB THR 127 6.981 2.301 2.301 323 HG1 THR 127 1HG THR 127 5.635 3.890 3.890 324 1HG2 THR 127 1HG2 THR 127 6.673 3.872 3.872 325 2HG2 THR 127 3HG2 THR 127 8.145 3.989 3.989 326 3HG2 THR 127 2HG2 THR 127 7.710 2.415 2.415 327 H LEU 128 H LEU 128 4.640 1.458 1.458 328 HA LEU 128 HA LEU 128 5.528 -1.247 -1.247 329 1HB LEU 128 2HB LEU 128 3.920 -0.057 -0.057 330 2HB LEU 128 1HB LEU 128 5.365 -0.620 -0.620 331 HG LEU 128 HG LEU 128 3.877 -2.333 -2.333 332 1HD1 LEU 128 2HD1 LEU 128 2.250 -1.155 -1.155 333 2HD1 LEU 128 1HD1 LEU 128 2.896 -2.039 -2.039 334 3HD1 LEU 128 3HD1 LEU 128 2.193 -2.957 -2.957 335 1HD2 LEU 128 1HD2 LEU 128 5.430 -3.254 -3.254 336 2HD2 LEU 128 3HD2 LEU 128 5.859 -3.485 -3.485 337 3HD2 LEU 128 2HD2 LEU 128 4.402 -4.311 -4.311 338 H ARG 129 H ARG 129 7.375 -2.175 -2.175 339 HA ARG 129 HA ARG 129 9.183 -0.376 -0.376 340 1HB ARG 129 2HB ARG 129 9.909 -0.209 -0.209 341 2HB ARG 129 1HB ARG 129 9.786 -2.003 -2.003 342 1HG ARG 129 2HG ARG 129 11.657 -2.277 -2.277 343 2HG ARG 129 1HG ARG 129 11.538 -0.557 -0.557 344 1HD ARG 129 2HD ARG 129 12.413 0.100 0.100 345 2HD ARG 129 1HD ARG 129 12.426 -1.655 -1.655 346 HE ARG 129 HE ARG 129 13.924 -1.252 -1.252 347 1HH1 ARG 129 1HH2 ARG 129 14.011 -0.735 -0.735 348 2HH1 ARG 129 2HH2 ARG 129 15.737 -0.820 -0.820 349 1HH2 ARG 129 1HH1 ARG 129 16.268 -1.366 -1.366 350 2HH2 ARG 129 2HH1 ARG 129 17.037 -1.184 -1.184 351 H PHE 130 H PHE 130 8.895 -1.372 -1.372 352 HA PHE 130 HA PHE 130 8.412 -4.230 -4.230 353 1HB PHE 130 2HB PHE 130 9.214 -2.065 -2.065 354 2HB PHE 130 1HB PHE 130 8.696 -3.791 -3.791 355 HD1 PHE 130 1HD PHE 130 6.610 -4.654 -4.654 356 HD2 PHE 130 2HD PHE 130 7.619 -0.460 -0.460 357 HE1 PHE 130 1HE PHE 130 4.270 -3.988 -3.988 358 HE2 PHE 130 2HE PHE 130 5.194 0.122 0.122 359 HZ PHE 130 HZ PHE 130 3.520 -1.732 -1.732 360 H ARG 131 H ARG 131 10.210 -5.434 -5.434 361 HA ARG 131 HA ARG 131 12.912 -4.376 -4.376 362 1HB ARG 131 2HB ARG 131 12.043 -7.130 -7.130 363 2HB ARG 131 1HB ARG 131 13.735 -6.525 -6.525 364 1HG ARG 131 2HG ARG 131 13.160 -4.652 -4.652 365 2HG ARG 131 1HG ARG 131 11.482 -5.280 -5.280 366 1HD ARG 131 2HD ARG 131 12.351 -7.425 -7.425 367 2HD ARG 131 1HD ARG 131 14.033 -6.754 -6.754 368 HE ARG 131 HE ARG 131 11.759 -5.914 -5.914 369 1HH1 ARG 131 1HH2 ARG 131 15.044 -5.186 -5.186 370 2HH1 ARG 131 2HH2 ARG 131 15.416 -4.081 -4.081 371 1HH2 ARG 131 1HH1 ARG 131 12.286 -4.427 -4.427 372 2HH2 ARG 131 2HH1 ARG 131 13.833 -3.648 -3.648 373 H GLY 132 H GLY 132 13.039 -4.170 -4.170 374 1HA GLY 132 2HA GLY 132 10.847 -4.913 -4.913 375 2HA GLY 132 1HA GLY 132 12.294 -4.269 -4.269 376 H ARG 133 H ARG 133 10.037 -6.452 -6.452 377 HA ARG 133 HA ARG 133 11.648 -8.678 -8.678 378 1HB ARG 133 2HB ARG 133 8.699 -8.306 -8.306 379 2HB ARG 133 1HB ARG 133 9.344 -9.395 -9.395 380 1HG ARG 133 2HG ARG 133 8.713 -10.632 -10.632 381 2HG ARG 133 1HG ARG 133 10.445 -10.828 -10.828 382 1HD ARG 133 2HD ARG 133 11.159 -9.372 -9.372 383 2HD ARG 133 1HD ARG 133 9.442 -8.911 -8.911 384 HE ARG 133 HE ARG 133 9.466 -11.711 -11.711 385 1HH1 ARG 133 1HH1 ARG 133 11.259 -9.045 -9.045 386 2HH1 ARG 133 2HH1 ARG 133 11.463 -9.876 -9.876 387 1HH2 ARG 133 1HH2 ARG 133 9.752 -12.822 -12.822 388 2HH2 ARG 133 2HH2 ARG 133 10.595 -12.048 -12.048 389 H GLU 134 H GLU 134 9.271 -7.014 -7.014 390 HA GLU 134 HA GLU 134 10.605 -6.522 -6.522 391 1HB GLU 134 2HB GLU 134 8.070 -6.667 -6.667 392 2HB GLU 134 1HB GLU 134 8.023 -5.175 -5.175 393 1HG GLU 134 2HG GLU 134 9.213 -3.953 -3.953 394 2HG GLU 134 1HG GLU 134 9.041 -5.471 -5.471 395 H MET 135 H MET 135 9.025 -4.186 -4.186 396 HA MET 135 HA MET 135 11.391 -3.210 -3.210 397 1HB MET 135 2HB MET 135 11.394 -0.886 -0.886 398 2HB MET 135 1HB MET 135 11.944 -2.136 -2.136 399 1HG MET 135 2HG MET 135 9.567 -2.154 -2.154 400 2HG MET 135 1HG MET 135 9.226 -0.709 -0.709 401 1HE MET 135 2HE MET 135 8.429 0.322 0.322 402 2HE MET 135 1HE MET 135 9.402 0.505 0.505 403 3HE MET 135 3HE MET 135 8.928 -1.132 -1.132 404 H ALA 136 H ALA 136 7.939 -3.395 -3.395 405 HA ALA 136 HA ALA 136 7.185 -1.667 -1.667 406 1HB ALA 136 1HB ALA 136 7.406 -0.279 -0.279 407 2HB ALA 136 3HB ALA 136 6.352 0.299 0.299 408 3HB ALA 136 2HB ALA 136 8.125 0.301 0.301 409 H HIS 137 H HIS 137 5.251 -2.587 -2.587 410 HA HIS 137 HA HIS 137 4.117 -4.045 -4.045 411 1HB HIS 137 2HB HIS 137 4.255 -4.777 -4.777 412 2HB HIS 137 1HB HIS 137 3.478 -5.713 -5.713 413 HD1 HIS 137 1HD HIS 137 4.969 -6.798 -6.798 414 HD2 HIS 137 2HD HIS 137 7.161 -4.492 -4.492 415 HE1 HIS 137 1HE HIS 137 7.455 -7.196 -7.196 416 H GLN 138 H GLN 138 1.825 -4.137 -4.137 417 HA GLN 138 HA GLN 138 0.286 -3.031 -3.031 418 1HB GLN 138 2HB GLN 138 -0.646 -3.628 -3.628 419 2HB GLN 138 1HB GLN 138 -1.677 -2.993 -2.993 420 1HG GLN 138 2HG GLN 138 -0.294 -0.904 -0.904 421 2HG GLN 138 1HG GLN 138 0.718 -1.514 -1.514 422 1HE2 GLN 138 1HE2 GLN 138 -0.171 -1.715 -1.715 423 2HE2 GLN 138 2HE2 GLN 138 -1.668 -0.978 -0.978 424 H GLN 139 H GLN 139 1.817 -5.611 -5.611 425 HA GLN 139 HA GLN 139 -0.464 -7.414 -7.414 426 1HB GLN 139 2HB GLN 139 2.362 -8.420 -8.420 427 2HB GLN 139 1HB GLN 139 0.796 -9.225 -9.225 428 1HG GLN 139 2HG GLN 139 0.349 -7.479 -7.479 429 2HG GLN 139 1HG GLN 139 1.993 -6.794 -6.794 430 1HE2 GLN 139 1HE2 GLN 139 0.334 -9.937 -9.937 431 2HE2 GLN 139 2HE2 GLN 139 1.634 -10.602 -10.602 432 H ILE 140 H ILE 140 3.061 -6.979 -6.979 433 HA ILE 140 HA ILE 140 3.367 -8.233 -8.233 434 HB ILE 140 HB ILE 140 4.950 -6.327 -6.327 435 1HG1 ILE 140 2HG1 ILE 140 5.126 -9.285 -9.285 436 2HG1 ILE 140 1HG1 ILE 140 4.477 -8.724 -8.724 437 1HG2 ILE 140 2HG2 ILE 140 5.342 -7.637 -7.637 438 2HG2 ILE 140 1HG2 ILE 140 6.654 -6.855 -6.855 439 3HG2 ILE 140 3HG2 ILE 140 5.316 -5.856 -5.856 440 1HD1 ILE 140 1HD1 ILE 140 6.585 -7.632 -7.632 441 2HD1 ILE 140 3HD1 ILE 140 7.350 -8.213 -8.213 442 3HD1 ILE 140 2HD1 ILE 140 6.810 -9.398 -9.398 443 H GLY 141 H GLY 141 2.317 -5.023 -5.023 444 1HA GLY 141 2HA GLY 141 2.324 -4.282 -4.282 445 2HA GLY 141 1HA GLY 141 1.562 -3.367 -3.367 446 H MET 142 H MET 142 -0.450 -4.934 -4.934 447 HA MET 142 HA MET 142 -2.106 -4.267 -4.267 448 1HB MET 142 2HB MET 142 -3.596 -3.622 -3.622 449 2HB MET 142 1HB MET 142 -2.089 -3.570 -3.570 450 1HG MET 142 2HG MET 142 -2.689 -5.903 -5.903 451 2HG MET 142 1HG MET 142 -4.134 -5.752 -5.752 452 1HE MET 142 2HE MET 142 -5.354 -6.518 -6.518 453 2HE MET 142 1HE MET 142 -5.313 -5.638 -5.638 454 3HE MET 142 3HE MET 142 -3.825 -6.425 -6.425 455 H GLU 143 H GLU 143 -0.753 -7.358 -7.358 456 HA GLU 143 HA GLU 143 -3.045 -8.451 -8.451 457 1HB GLU 143 2HB GLU 143 -0.789 -9.811 -9.811 458 2HB GLU 143 1HB GLU 143 -0.286 -9.371 -9.371 459 1HG GLU 143 2HG GLU 143 -1.286 -11.406 -11.406 460 2HG GLU 143 1HG GLU 143 -2.689 -10.372 -10.372 461 H VAL 144 H VAL 144 -0.027 -7.008 -7.008 462 HA VAL 144 HA VAL 144 -0.494 -7.728 -7.728 463 HB VAL 144 HB VAL 144 1.461 -5.665 -5.665 464 1HG1 VAL 144 1HG1 VAL 144 1.030 -7.408 -7.408 465 2HG1 VAL 144 3HG1 VAL 144 2.635 -6.745 -6.745 466 3HG1 VAL 144 2HG1 VAL 144 1.263 -5.621 -5.621 467 1HG2 VAL 144 1HG2 VAL 144 1.055 -8.676 -8.676 468 2HG2 VAL 144 3HG2 VAL 144 1.580 -7.700 -7.700 469 3HG2 VAL 144 2HG2 VAL 144 2.762 -7.986 -7.986 470 H LEU 145 H LEU 145 -0.391 -4.617 -4.617 471 HA LEU 145 HA LEU 145 -1.272 -2.904 -2.904 472 1HB LEU 145 2HB LEU 145 -1.961 -3.098 -3.098 473 2HB LEU 145 1HB LEU 145 -2.493 -1.740 -1.740 474 HG LEU 145 HG LEU 145 0.332 -2.565 -2.565 475 1HD1 LEU 145 3HD1 LEU 145 -1.390 -0.076 -0.076 476 2HD1 LEU 145 2HD1 LEU 145 0.375 -0.163 -0.163 477 3HD1 LEU 145 1HD1 LEU 145 -0.772 -1.294 -1.294 478 1HD2 LEU 145 3HD2 LEU 145 -0.568 -0.739 -0.739 479 2HD2 LEU 145 2HD2 LEU 145 0.599 -2.074 -2.074 480 3HD2 LEU 145 1HD2 LEU 145 1.050 -0.533 -0.533 481 H ASN 146 H ASN 146 -3.292 -4.467 -4.467 482 HA ASN 146 HA ASN 146 -5.876 -3.714 -3.714 483 1HB ASN 146 2HB ASN 146 -4.505 -4.986 -4.986 484 2HB ASN 146 1HB ASN 146 -5.435 -6.346 -6.346 485 1HD2 ASN 146 1HD2 ASN 146 -6.024 -6.655 -6.655 486 2HD2 ASN 146 2HD2 ASN 146 -7.249 -5.775 -5.775 487 H ARG 147 H ARG 147 -3.859 -6.585 -6.585 488 HA ARG 147 HA ARG 147 -6.084 -7.369 -7.369 489 1HB ARG 147 2HB ARG 147 -4.782 -8.934 -8.934 490 2HB ARG 147 1HB ARG 147 -3.244 -8.103 -8.103 491 1HG ARG 147 2HG ARG 147 -3.285 -9.110 -9.110 492 2HG ARG 147 1HG ARG 147 -5.084 -9.363 -9.363 493 1HD ARG 147 2HD ARG 147 -4.698 -11.384 -11.384 494 2HD ARG 147 1HD ARG 147 -3.101 -10.743 -10.743 495 HE ARG 147 HE ARG 147 -2.056 -11.482 -11.482 496 1HH1 ARG 147 1HH1 ARG 147 -5.596 -11.930 -11.930 497 2HH1 ARG 147 2HH1 ARG 147 -5.501 -13.021 -13.021 498 1HH2 ARG 147 1HH2 ARG 147 -1.954 -12.985 -12.985 499 2HH2 ARG 147 2HH2 ARG 147 -3.411 -13.626 -13.626 500 H VAL 148 H VAL 148 -3.498 -4.913 -4.913 501 HA VAL 148 HA VAL 148 -3.378 -5.345 -5.345 502 HB VAL 148 HB VAL 148 -2.902 -2.732 -2.732 503 1HG1 VAL 148 2HG1 VAL 148 -2.867 -3.476 -3.476 504 2HG1 VAL 148 1HG1 VAL 148 -1.387 -4.401 -4.401 505 3HG1 VAL 148 3HG1 VAL 148 -1.409 -2.590 -2.590 506 1HG2 VAL 148 3HG2 VAL 148 -0.957 -5.049 -5.049 507 2HG2 VAL 148 2HG2 VAL 148 -1.679 -4.142 -4.142 508 3HG2 VAL 148 1HG2 VAL 148 -0.550 -3.309 -3.309 509 H LYS 149 H LYS 149 -5.179 -3.050 -3.050 510 HA LYS 149 HA LYS 149 -6.665 -1.743 -1.743 511 1HB LYS 149 2HB LYS 149 -6.883 -1.223 -1.223 512 2HB LYS 149 1HB LYS 149 -7.555 -2.852 -2.852 513 1HG LYS 149 2HG LYS 149 -9.500 -2.343 -2.343 514 2HG LYS 149 1HG LYS 149 -9.157 -1.507 -1.507 515 1HD LYS 149 2HD LYS 149 -10.614 -0.162 -0.162 516 2HD LYS 149 1HD LYS 149 -9.157 0.516 0.516 517 1HE LYS 149 2HE LYS 149 -9.303 1.673 1.673 518 2HE LYS 149 1HE LYS 149 -8.008 0.415 0.415 519 1HZ LYS 149 1HZ LYS 149 -9.643 -0.956 -0.956 520 2HZ LYS 149 3HZ LYS 149 -10.849 0.216 0.216 521 3HZ LYS 149 2HZ LYS 149 -9.511 0.563 0.563 522 H ASP 150 H ASP 150 -7.371 -4.937 -4.937 523 HA ASP 150 HA ASP 150 -9.921 -5.010 -5.010 524 1HB ASP 150 2HB ASP 150 -8.007 -6.813 -6.813 525 2HB ASP 150 1HB ASP 150 -9.402 -7.497 -7.497 526 H ASP 151 H ASP 151 -6.794 -6.404 -6.404 527 HA ASP 151 HA ASP 151 -8.455 -7.439 -7.439 528 1HB ASP 151 2HB ASP 151 -6.220 -8.347 -8.347 529 2HB ASP 151 1HB ASP 151 -5.451 -6.917 -6.917 530 H LEU 152 H LEU 152 -6.722 -4.220 -4.220 531 HA LEU 152 HA LEU 152 -7.095 -3.809 -3.809 532 1HB LEU 152 2HB LEU 152 -6.014 -2.519 -2.519 533 2HB LEU 152 1HB LEU 152 -7.041 -1.409 -1.409 534 HG LEU 152 HG LEU 152 -4.970 -3.170 -3.170 535 1HD1 LEU 152 3HD1 LEU 152 -4.042 -2.231 -2.231 536 2HD1 LEU 152 2HD1 LEU 152 -4.415 -0.545 -0.545 537 3HD1 LEU 152 1HD1 LEU 152 -3.210 -1.540 -1.540 538 1HD2 LEU 152 3HD2 LEU 152 -6.247 -0.493 -0.493 539 2HD2 LEU 152 2HD2 LEU 152 -6.450 -2.098 -2.098 540 3HD2 LEU 152 1HD2 LEU 152 -4.886 -1.242 -1.242 541 H GLN 153 H GLN 153 -8.982 -3.066 -3.066 542 HA GLN 153 HA GLN 153 -10.305 -1.194 -1.194 543 1HB GLN 153 2HB GLN 153 -10.472 -3.643 -3.643 544 2HB GLN 153 1HB GLN 153 -11.842 -3.786 -3.786 545 1HG GLN 153 2HG GLN 153 -12.876 -1.783 -1.783 546 2HG GLN 153 1HG GLN 153 -11.258 -1.706 -1.706 547 1HE2 GLN 153 1HE2 GLN 153 -13.574 -4.374 -4.374 548 2HE2 GLN 153 2HE2 GLN 153 -13.628 -5.124 -5.124 549 H GLU 154 H GLU 154 -10.845 -3.246 -3.246 550 HA GLU 154 HA GLU 154 -13.297 -2.437 -2.437 551 1HB GLU 154 2HB GLU 154 -11.003 -3.002 -3.002 552 2HB GLU 154 1HB GLU 154 -12.671 -3.603 -3.603 553 1HG GLU 154 2HG GLU 154 -12.005 -5.117 -5.117 554 2HG GLU 154 1HG GLU 154 -10.344 -4.383 -4.383 555 H LEU 155 H LEU 155 -10.124 -1.397 -1.397 556 HA LEU 155 HA LEU 155 -10.884 0.518 0.518 557 1HB LEU 155 2HB LEU 155 -9.482 -1.512 -1.512 558 2HB LEU 155 1HB LEU 155 -8.351 -0.986 -0.986 559 HG LEU 155 HG LEU 155 -7.487 -0.949 -0.949 560 1HD1 LEU 155 1HD1 LEU 155 -6.517 0.650 0.650 561 2HD1 LEU 155 3HD1 LEU 155 -7.545 1.982 1.982 562 3HD1 LEU 155 2HD1 LEU 155 -6.303 1.188 1.188 563 1HD2 LEU 155 3HD2 LEU 155 -9.434 -0.487 -0.487 564 2HD2 LEU 155 2HD2 LEU 155 -7.843 0.224 0.224 565 3HD2 LEU 155 1HD2 LEU 155 -9.143 1.290 1.290 566 H ALA 156 H ALA 156 -8.755 0.038 0.038 567 HA ALA 156 HA ALA 156 -8.061 2.990 2.990 568 1HB ALA 156 2HB ALA 156 -6.744 0.636 0.636 569 2HB ALA 156 1HB ALA 156 -6.342 2.377 2.377 570 3HB ALA 156 3HB ALA 156 -6.049 1.580 1.580 571 H VAL 157 H VAL 157 -8.849 3.992 3.992 572 HA VAL 157 HA VAL 157 -8.501 1.692 1.692 573 HB VAL 157 HB VAL 157 -9.972 2.676 2.676 574 1HG1 VAL 157 3HG1 VAL 157 -11.292 2.821 2.821 575 2HG1 VAL 157 2HG1 VAL 157 -12.156 2.688 2.688 576 3HG1 VAL 157 1HG1 VAL 157 -11.083 1.322 1.322 577 1HG2 VAL 157 2HG2 VAL 157 -9.347 5.177 5.177 578 2HG2 VAL 157 1HG2 VAL 157 -11.075 4.835 4.835 579 3HG2 VAL 157 3HG2 VAL 157 -10.460 5.028 5.028 580 H VAL 158 H VAL 158 -8.323 2.304 2.304 581 HA VAL 158 HA VAL 158 -5.905 3.854 3.854 582 HB VAL 158 HB VAL 158 -7.377 2.407 2.407 583 1HG1 VAL 158 1HG1 VAL 158 -5.418 3.834 3.834 584 2HG1 VAL 158 3HG1 VAL 158 -4.397 2.817 2.817 585 3HG1 VAL 158 2HG1 VAL 158 -5.184 2.105 2.105 586 1HG2 VAL 158 3HG2 VAL 158 -5.455 1.202 1.202 587 2HG2 VAL 158 2HG2 VAL 158 -7.157 0.654 0.654 588 3HG2 VAL 158 1HG2 VAL 158 -5.893 0.390 0.390 589 H GLU 159 H GLU 159 -5.870 5.547 5.547 590 HA GLU 159 HA GLU 159 -8.246 7.108 7.108 591 1HB GLU 159 2HB GLU 159 -6.003 7.969 7.969 592 2HB GLU 159 1HB GLU 159 -5.485 7.475 7.475 593 1HG GLU 159 2HG GLU 159 -7.065 9.231 9.231 594 2HG GLU 159 1HG GLU 159 -7.624 9.612 9.612 595 H SER 160 H SER 160 -5.988 5.374 5.374 596 HA SER 160 HA SER 160 -7.902 5.546 5.546 597 1HB SER 160 2HB SER 160 -6.141 7.512 7.512 598 2HB SER 160 1HB SER 160 -5.143 6.156 6.156 599 HG SER 160 HG SER 160 -6.237 7.365 7.365 600 H PHE 161 H PHE 161 -7.436 3.821 3.821 601 HA PHE 161 HA PHE 161 -5.210 2.131 2.131 602 1HB PHE 161 2HB PHE 161 -7.904 1.602 1.602 603 2HB PHE 161 1HB PHE 161 -6.922 0.870 0.870 604 HD1 PHE 161 2HD PHE 161 -7.173 1.422 1.422 605 HD2 PHE 161 1HD PHE 161 -5.574 -1.110 -1.110 606 HE1 PHE 161 2HE PHE 161 -6.155 0.030 0.030 607 HE2 PHE 161 1HE PHE 161 -4.265 -2.223 -2.223 608 HZ PHE 161 HZ PHE 161 -4.796 -1.742 -1.742 609 HA PRO 162 HA PRO 162 -4.673 4.562 4.562 610 1HB PRO 162 2HB PRO 162 -1.863 5.132 5.132 611 2HB PRO 162 1HB PRO 162 -3.314 6.076 6.076 612 1HG PRO 162 2HG PRO 162 -1.664 4.668 4.668 613 2HG PRO 162 1HG PRO 162 -3.379 5.162 5.162 614 1HD PRO 162 2HD PRO 162 -2.331 2.618 2.618 615 2HD PRO 162 1HD PRO 162 -3.431 2.603 2.603 616 H THR 163 H THR 163 -1.531 4.112 4.112 617 HA THR 163 HA THR 163 -1.732 2.319 2.319 618 HB THR 163 HB THR 163 -3.105 4.926 4.926 619 HG1 THR 163 1HG THR 163 -3.182 2.816 2.816 620 1HG2 THR 163 2HG2 THR 163 -1.246 4.259 4.259 621 2HG2 THR 163 1HG2 THR 163 -2.601 5.470 5.470 622 3HG2 THR 163 3HG2 THR 163 -1.330 5.740 5.740 623 H LYS 164 H LYS 164 -0.602 5.412 5.412 624 HA LYS 164 HA LYS 164 1.314 5.561 5.561 625 1HB LYS 164 2HB LYS 164 -0.093 7.462 7.462 626 2HB LYS 164 1HB LYS 164 0.874 7.453 7.453 627 1HG LYS 164 2HG LYS 164 2.921 8.058 8.058 628 2HG LYS 164 1HG LYS 164 2.025 7.829 7.829 629 1HD LYS 164 2HD LYS 164 0.500 9.714 9.714 630 2HD LYS 164 1HD LYS 164 1.354 9.921 9.921 631 1HE LYS 164 2HE LYS 164 2.111 11.623 11.623 632 2HE LYS 164 1HE LYS 164 3.475 10.505 10.505 633 1HZ LYS 164 2HZ LYS 164 1.719 10.328 10.328 634 2HZ LYS 164 1HZ LYS 164 3.315 10.909 10.909 635 3HZ LYS 164 3HZ LYS 164 2.997 9.276 9.276 636 H ILE 165 H ILE 165 2.998 4.128 4.128 637 HA ILE 165 HA ILE 165 4.462 4.051 4.051 638 HB ILE 165 HB ILE 165 5.255 2.854 2.854 639 1HG1 ILE 165 2HG1 ILE 165 3.019 1.952 1.952 640 2HG1 ILE 165 1HG1 ILE 165 2.949 2.174 2.174 641 1HG2 ILE 165 3HG2 ILE 165 6.873 2.798 2.798 642 2HG2 ILE 165 2HG2 ILE 165 5.636 1.910 1.910 643 3HG2 ILE 165 1HG2 ILE 165 6.364 1.152 1.152 644 1HD1 ILE 165 1HD1 ILE 165 4.531 -0.057 -0.057 645 2HD1 ILE 165 3HD1 ILE 165 2.877 -0.202 -0.202 646 3HD1 ILE 165 2HD1 ILE 165 4.278 0.150 0.150 647 H GLU 166 H GLU 166 6.339 4.994 4.994 648 HA GLU 166 HA GLU 166 7.285 6.783 6.783 649 1HB GLU 166 2HB GLU 166 7.069 7.437 7.437 650 2HB GLU 166 1HB GLU 166 8.172 8.298 8.298 651 1HG GLU 166 2HG GLU 166 5.100 8.100 8.100 652 2HG GLU 166 1HG GLU 166 6.043 9.511 9.511 653 H GLY 167 H GLY 167 9.138 5.802 5.802 654 1HA GLY 167 2HA GLY 167 11.174 4.778 4.778 655 2HA GLY 167 1HA GLY 167 11.024 4.934 4.934 656 H ARG 168 H ARG 168 11.496 2.971 2.971 657 HA ARG 168 HA ARG 168 9.898 0.797 0.797 658 1HB ARG 168 2HB ARG 168 12.491 0.654 0.654 659 2HB ARG 168 1HB ARG 168 11.562 -0.750 -0.750 660 1HG ARG 168 2HG ARG 168 11.919 0.334 0.334 661 2HG ARG 168 1HG ARG 168 13.223 1.289 1.289 662 1HD ARG 168 2HD ARG 168 14.365 -0.858 -0.858 663 2HD ARG 168 1HD ARG 168 12.964 -1.798 -1.798 664 HE ARG 168 HE ARG 168 14.223 0.071 0.071 665 1HH1 ARG 168 1HH2 ARG 168 14.247 -3.208 -3.208 666 2HH1 ARG 168 2HH2 ARG 168 14.991 -3.950 -3.950 667 1HH2 ARG 168 1HH1 ARG 168 15.224 -0.951 -0.951 668 2HH2 ARG 168 2HH1 ARG 168 15.552 -2.652 -2.652 669 H GLN 169 H GLN 169 8.513 2.464 2.464 670 HA GLN 169 HA GLN 169 8.046 0.858 0.858 671 1HB GLN 169 2HB GLN 169 9.090 3.668 3.668 672 2HB GLN 169 1HB GLN 169 8.268 2.855 2.855 673 1HG GLN 169 2HG GLN 169 10.296 1.174 1.174 674 2HG GLN 169 1HG GLN 169 11.105 2.426 2.426 675 1HE2 GLN 169 1HE2 GLN 169 9.394 4.520 4.520 676 2HE2 GLN 169 2HE2 GLN 169 10.273 4.719 4.719 677 H MET 170 H MET 170 5.905 1.342 1.342 678 HA MET 170 HA MET 170 4.664 3.669 3.669 679 1HB MET 170 2HB MET 170 3.829 1.632 1.632 680 2HB MET 170 1HB MET 170 3.392 0.893 0.893 681 1HG MET 170 2HG MET 170 1.653 2.594 2.594 682 2HG MET 170 1HG MET 170 2.248 3.498 3.498 683 1HE MET 170 1HE MET 170 1.397 -0.323 -0.323 684 2HE MET 170 3HE MET 170 0.371 -0.689 -0.689 685 3HE MET 170 2HE MET 170 2.114 -0.328 -0.328 686 H ILE 171 H ILE 171 4.036 5.158 5.158 687 HA ILE 171 HA ILE 171 3.252 4.146 4.146 688 HB ILE 171 HB ILE 171 2.754 6.862 6.862 689 1HG1 ILE 171 2HG1 ILE 171 5.187 5.978 5.978 690 2HG1 ILE 171 1HG1 ILE 171 4.702 7.635 7.635 691 1HG2 ILE 171 2HG2 ILE 171 2.224 5.645 5.645 692 2HG2 ILE 171 1HG2 ILE 171 2.438 7.447 7.447 693 3HG2 ILE 171 3HG2 ILE 171 1.070 6.648 6.648 694 1HD1 ILE 171 1HD1 ILE 171 4.515 5.044 5.044 695 2HD1 ILE 171 3HD1 ILE 171 5.892 6.212 6.212 696 3HD1 ILE 171 2HD1 ILE 171 4.216 6.676 6.676 697 H MET 172 H MET 172 1.369 3.348 3.348 698 HA MET 172 HA MET 172 -1.176 4.275 4.275 699 1HB MET 172 2HB MET 172 -1.282 1.900 1.900 700 2HB MET 172 1HB MET 172 -0.187 1.686 1.686 701 1HG MET 172 2HG MET 172 -1.926 2.170 2.170 702 2HG MET 172 1HG MET 172 -2.999 2.852 2.852 703 1HE MET 172 1HE MET 172 -3.457 0.912 0.912 704 2HE MET 172 3HE MET 172 -4.152 -0.624 -0.624 705 3HE MET 172 2HE MET 172 -2.387 -0.519 -0.519 706 H VAL 173 H VAL 173 -2.475 5.386 5.386 707 HA VAL 173 HA VAL 173 -0.890 6.139 6.139 708 HB VAL 173 HB VAL 173 -3.392 7.465 7.465 709 1HG1 VAL 173 3HG1 VAL 173 -1.201 7.872 7.872 710 2HG1 VAL 173 2HG1 VAL 173 -1.960 9.367 9.367 711 3HG1 VAL 173 1HG1 VAL 173 -2.968 8.180 8.180 712 1HG2 VAL 173 2HG2 VAL 173 -0.455 7.961 7.961 713 2HG2 VAL 173 1HG2 VAL 173 -1.842 7.542 7.542 714 3HG2 VAL 173 3HG2 VAL 173 -1.791 9.142 9.142 715 H LEU 174 H LEU 174 -1.777 5.741 5.741 716 HA LEU 174 HA LEU 174 -4.343 4.393 4.393 717 1HB LEU 174 2HB LEU 174 -2.419 3.011 3.011 718 2HB LEU 174 1HB LEU 174 -1.715 3.807 3.807 719 HG LEU 174 HG LEU 174 -4.224 3.227 3.227 720 1HD1 LEU 174 2HD1 LEU 174 -4.951 2.440 2.440 721 2HD1 LEU 174 1HD1 LEU 174 -3.801 1.037 1.037 722 3HD1 LEU 174 3HD1 LEU 174 -5.141 1.248 1.248 723 1HD2 LEU 174 1HD2 LEU 174 -2.006 2.386 2.386 724 2HD2 LEU 174 3HD2 LEU 174 -3.477 1.302 1.302 725 3HD2 LEU 174 2HD2 LEU 174 -2.225 0.981 0.981 726 H ALA 175 H ALA 175 -5.707 6.265 6.265 727 HA ALA 175 HA ALA 175 -5.018 7.449 7.449 728 1HB ALA 175 3HB ALA 175 -5.711 8.833 8.833 729 2HB ALA 175 2HB ALA 175 -7.245 7.829 7.829 730 3HB ALA 175 1HB ALA 175 -6.920 9.078 9.078 731 HA PRO 176 HA PRO 176 -7.932 5.424 5.424 732 1HB PRO 176 2HB PRO 176 -9.043 7.281 7.281 733 2HB PRO 176 1HB PRO 176 -7.348 6.658 6.658 734 1HG PRO 176 2HG PRO 176 -8.306 9.264 9.264 735 2HG PRO 176 1HG PRO 176 -6.899 9.010 9.010 736 1HD PRO 176 2HD PRO 176 -6.563 9.167 9.167 737 2HD PRO 176 1HD PRO 176 -5.595 7.989 7.989 738 H LYS 177 H LYS 177 -10.066 4.717 4.717 739 HA LYS 177 HA LYS 177 -11.650 5.798 5.798 740 1HB LYS 177 2HB LYS 177 -11.719 3.355 3.355 741 2HB LYS 177 1HB LYS 177 -12.648 4.001 4.001 742 1HG LYS 177 2HG LYS 177 -14.298 4.993 4.993 743 2HG LYS 177 1HG LYS 177 -13.469 3.844 3.844 744 1HD LYS 177 2HD LYS 177 -14.922 3.171 3.171 745 2HD LYS 177 1HD LYS 177 -15.627 3.023 3.023 746 1HE LYS 177 2HE LYS 177 -13.887 1.325 1.325 747 2HE LYS 177 1HE LYS 177 -13.197 1.420 1.420 748 1HZ LYS 177 1HZ LYS 177 -15.982 0.650 0.650 749 2HZ LYS 177 3HZ LYS 177 -14.730 -0.392 -0.392 750 3HZ LYS 177 2HZ LYS 177 -15.350 0.752 0.752 751 H LYS 178 H LYS 178 -12.882 7.493 7.493 752 HA LYS 178 HA LYS 178 -13.899 8.616 8.616 753 1HB LYS 178 2HB LYS 178 -13.987 9.435 9.435 754 2HB LYS 178 1HB LYS 178 -15.099 10.173 10.173 755 1HG LYS 178 2HG LYS 178 -13.278 11.688 11.688 756 2HG LYS 178 1HG LYS 178 -13.134 11.006 11.006 757 1HD LYS 178 2HD LYS 178 -11.297 9.532 9.532 758 2HD LYS 178 1HD LYS 178 -11.536 10.013 10.013 759 1HE LYS 178 2HE LYS 178 -10.843 12.364 12.364 760 2HE LYS 178 1HE LYS 178 -10.588 11.860 11.860 761 1HZ LYS 178 3HZ LYS 178 -9.208 10.731 10.731 762 2HZ LYS 178 2HZ LYS 178 -8.557 11.835 11.835 763 3HZ LYS 178 1HZ LYS 178 -8.967 10.265 10.265 764 H LYS 179 H LYS 179 -15.538 7.342 7.342 765 HA LYS 179 HA LYS 179 -17.223 5.936 5.936 766 1HB LYS 179 2HB LYS 179 -16.614 5.089 5.089 767 2HB LYS 179 1HB LYS 179 -17.553 6.452 6.452 768 1HG LYS 179 2HG LYS 179 -18.823 4.371 4.371 769 2HG LYS 179 1HG LYS 179 -19.660 5.507 5.507 770 1HD LYS 179 2HD LYS 179 -18.672 4.292 4.292 771 2HD LYS 179 1HD LYS 179 -17.875 3.139 3.139 772 1HE LYS 179 2HE LYS 179 -20.929 3.590 3.590 773 2HE LYS 179 1HE LYS 179 -19.997 2.205 2.205 774 1HZ LYS 179 1HZ LYS 179 -19.341 1.593 1.593 775 2HZ LYS 179 3HZ LYS 179 -20.238 2.878 2.878 776 3HZ LYS 179 2HZ LYS 179 -21.032 1.621 1.621 777 H GLN 180 H GLN 180 -19.207 6.515 6.515 778 HA GLN 180 HA GLN 180 -19.904 9.237 9.237 779 1HB GLN 180 2HB GLN 180 -21.558 6.824 6.824 780 2HB GLN 180 1HB GLN 180 -22.041 8.545 8.545 781 1HG GLN 180 2HG GLN 180 -21.197 7.913 7.913 782 2HG GLN 180 1HG GLN 180 -19.916 8.940 8.940 783 1HE2 GLN 180 1HE2 GLN 180 -17.934 8.173 8.173 784 2HE2 GLN 180 2HE2 GLN 180 -17.455 6.511 6.511 Start of MODEL 23 1 HA VAL 90 HA VAL 90 -2.324 17.222 17.222 2 HB VAL 90 HB VAL 90 -3.963 17.457 17.457 3 1HG1 VAL 90 3HG1 VAL 90 -4.636 19.020 19.020 4 2HG1 VAL 90 2HG1 VAL 90 -5.735 17.709 17.709 5 3HG1 VAL 90 1HG1 VAL 90 -6.043 18.465 18.465 6 1HG2 VAL 90 1HG2 VAL 90 -5.673 15.353 15.353 7 2HG2 VAL 90 3HG2 VAL 90 -4.733 15.089 15.089 8 3HG2 VAL 90 2HG2 VAL 90 -6.137 16.191 16.191 9 H ILE 91 H ILE 91 -3.666 15.579 15.579 10 HA ILE 91 HA ILE 91 -3.093 12.847 12.847 11 HB ILE 91 HB ILE 91 -4.104 13.975 13.975 12 1HG1 ILE 91 2HG1 ILE 91 -5.769 14.276 14.276 13 2HG1 ILE 91 1HG1 ILE 91 -6.274 12.928 12.928 14 1HG2 ILE 91 2HG2 ILE 91 -3.698 11.066 11.066 15 2HG2 ILE 91 1HG2 ILE 91 -4.715 11.536 11.536 16 3HG2 ILE 91 3HG2 ILE 91 -2.953 11.858 11.858 17 1HD1 ILE 91 1HD1 ILE 91 -5.339 11.279 11.279 18 2HD1 ILE 91 3HD1 ILE 91 -4.975 12.662 12.662 19 3HD1 ILE 91 2HD1 ILE 91 -6.684 12.298 12.298 20 H GLN 92 H GLN 92 -1.321 11.763 11.763 21 HA GLN 92 HA GLN 92 0.861 13.383 13.383 22 1HB GLN 92 2HB GLN 92 0.882 10.762 10.762 23 2HB GLN 92 1HB GLN 92 2.258 11.896 11.896 24 1HG GLN 92 2HG GLN 92 1.191 13.538 13.538 25 2HG GLN 92 1HG GLN 92 -0.409 12.753 12.753 26 1HE2 GLN 92 1HE2 GLN 92 -1.095 11.751 11.751 27 2HE2 GLN 92 2HE2 GLN 92 -0.158 10.883 10.883 28 H VAL 93 H VAL 93 2.601 12.092 12.092 29 HA VAL 93 HA VAL 93 1.198 10.105 10.105 30 HB VAL 93 HB VAL 93 3.674 11.716 11.716 31 1HG1 VAL 93 1HG1 VAL 93 2.229 9.284 9.284 32 2HG1 VAL 93 3HG1 VAL 93 3.308 10.350 10.350 33 3HG1 VAL 93 2HG1 VAL 93 4.028 9.377 9.377 34 1HG2 VAL 93 1HG2 VAL 93 1.197 12.621 12.621 35 2HG2 VAL 93 3HG2 VAL 93 2.200 12.446 12.446 36 3HG2 VAL 93 2HG2 VAL 93 1.047 11.141 11.141 37 H LYS 94 H LYS 94 1.561 7.905 7.905 38 HA LYS 94 HA LYS 94 4.437 7.525 7.525 39 1HB LYS 94 2HB LYS 94 2.249 5.476 5.476 40 2HB LYS 94 1HB LYS 94 3.903 5.395 5.395 41 1HG LYS 94 2HG LYS 94 1.791 7.476 7.476 42 2HG LYS 94 1HG LYS 94 2.090 5.976 5.976 43 1HD LYS 94 2HD LYS 94 4.433 6.663 6.663 44 2HD LYS 94 1HD LYS 94 4.209 8.167 8.167 45 1HE LYS 94 2HE LYS 94 2.457 8.955 8.955 46 2HE LYS 94 1HE LYS 94 2.743 7.474 7.474 47 1HZ LYS 94 1HZ LYS 94 4.771 9.528 9.528 48 2HZ LYS 94 3HZ LYS 94 3.975 9.372 9.372 49 3HZ LYS 94 2HZ LYS 94 5.029 8.150 8.150 50 H GLU 95 H GLU 95 5.106 5.195 5.195 51 HA GLU 95 HA GLU 95 3.914 4.829 4.829 52 1HB GLU 95 2HB GLU 95 5.903 6.451 6.451 53 2HB GLU 95 1HB GLU 95 6.814 5.028 5.028 54 1HG GLU 95 2HG GLU 95 6.435 3.841 3.841 55 2HG GLU 95 1HG GLU 95 5.391 5.214 5.214 56 H ILE 96 H ILE 96 4.332 2.743 2.743 57 HA ILE 96 HA ILE 96 5.898 0.921 0.921 58 HB ILE 96 HB ILE 96 3.174 0.822 0.822 59 1HG1 ILE 96 2HG1 ILE 96 3.365 -1.690 -1.690 60 2HG1 ILE 96 1HG1 ILE 96 5.046 -1.630 -1.630 61 1HG2 ILE 96 3HG2 ILE 96 2.786 0.701 0.701 62 2HG2 ILE 96 2HG2 ILE 96 3.547 -0.962 -0.962 63 3HG2 ILE 96 1HG2 ILE 96 2.118 -0.673 -0.673 64 1HD1 ILE 96 1HD1 ILE 96 3.960 -0.154 -0.154 65 2HD1 ILE 96 3HD1 ILE 96 4.966 -1.649 -1.649 66 3HD1 ILE 96 2HD1 ILE 96 5.670 -0.098 -0.098 67 H LYS 97 H LYS 97 6.648 -0.952 -0.952 68 HA LYS 97 HA LYS 97 6.018 -0.266 -0.266 69 1HB LYS 97 2HB LYS 97 8.632 -1.613 -1.613 70 2HB LYS 97 1HB LYS 97 7.950 -1.253 -1.253 71 1HG LYS 97 2HG LYS 97 8.079 1.189 1.189 72 2HG LYS 97 1HG LYS 97 8.805 0.856 0.856 73 1HD LYS 97 2HD LYS 97 10.750 -0.256 -0.256 74 2HD LYS 97 1HD LYS 97 10.026 0.000 0.000 75 1HE LYS 97 2HE LYS 97 10.865 2.272 2.272 76 2HE LYS 97 1HE LYS 97 11.817 1.685 1.685 77 1HZ LYS 97 2HZ LYS 97 9.973 2.271 2.271 78 2HZ LYS 97 1HZ LYS 97 9.073 2.822 2.822 79 3HZ LYS 97 3HZ LYS 97 10.509 3.615 3.615 80 H PHE 98 H PHE 98 5.786 -1.998 -1.998 81 HA PHE 98 HA PHE 98 5.720 -4.636 -4.636 82 1HB PHE 98 2HB PHE 98 3.546 -3.284 -3.284 83 2HB PHE 98 1HB PHE 98 3.648 -5.058 -5.058 84 HD1 PHE 98 1HD PHE 98 4.047 -5.728 -5.728 85 HD2 PHE 98 2HD PHE 98 2.031 -2.412 -2.412 86 HE1 PHE 98 1HE PHE 98 2.934 -5.447 -5.447 87 HE2 PHE 98 2HE PHE 98 0.740 -2.165 -2.165 88 HZ PHE 98 HZ PHE 98 1.093 -3.876 -3.876 89 H ARG 99 H ARG 99 6.544 -6.214 -6.214 90 HA ARG 99 HA ARG 99 7.704 -5.270 -5.270 91 1HB ARG 99 2HB ARG 99 9.107 -5.737 -5.737 92 2HB ARG 99 1HB ARG 99 8.577 -7.451 -7.451 93 1HG ARG 99 2HG ARG 99 9.747 -7.816 -7.816 94 2HG ARG 99 1HG ARG 99 10.000 -6.037 -6.037 95 1HD ARG 99 2HD ARG 99 11.507 -6.084 -6.084 96 2HD ARG 99 1HD ARG 99 11.359 -7.888 -7.888 97 HE ARG 99 HE ARG 99 12.702 -7.991 -7.991 98 1HH1 ARG 99 1HH1 ARG 99 11.737 -4.604 -4.604 99 2HH1 ARG 99 2HH1 ARG 99 12.827 -3.937 -3.937 100 1HH2 ARG 99 1HH2 ARG 99 14.159 -7.062 -7.062 101 2HH2 ARG 99 2HH2 ARG 99 14.217 -5.346 -5.346 102 HA PRO 100 HA PRO 100 5.413 -8.328 -8.328 103 1HB PRO 100 2HB PRO 100 8.072 -9.436 -9.436 104 2HB PRO 100 1HB PRO 100 6.670 -8.916 -8.916 105 1HG PRO 100 2HG PRO 100 9.079 -7.480 -7.480 106 2HG PRO 100 1HG PRO 100 7.642 -6.731 -6.731 107 1HD PRO 100 2HD PRO 100 8.597 -6.131 -6.131 108 2HD PRO 100 1HD PRO 100 6.933 -5.745 -5.745 109 H GLY 101 H GLY 101 4.678 -10.376 -10.376 110 1HA GLY 101 2HA GLY 101 4.456 -12.372 -12.372 111 2HA GLY 101 1HA GLY 101 6.100 -12.644 -12.644 112 H THR 102 H THR 102 4.610 -11.016 -11.016 113 HA THR 102 HA THR 102 6.354 -12.139 -12.139 114 HB THR 102 HB THR 102 5.547 -9.177 -9.177 115 HG1 THR 102 1HG THR 102 7.801 -8.903 -8.903 116 1HG2 THR 102 3HG2 THR 102 7.090 -11.167 -11.167 117 2HG2 THR 102 2HG2 THR 102 7.312 -9.369 -9.369 118 3HG2 THR 102 1HG2 THR 102 5.710 -10.124 -10.124 119 H ASP 103 H ASP 103 4.933 -13.367 -13.367 120 HA ASP 103 HA ASP 103 2.565 -12.167 -12.167 121 1HB ASP 103 2HB ASP 103 2.505 -13.822 -13.822 122 2HB ASP 103 1HB ASP 103 2.993 -15.043 -15.043 123 H GLU 104 H GLU 104 3.855 -15.332 -15.332 124 HA GLU 104 HA GLU 104 1.329 -14.029 -14.029 125 1HB GLU 104 2HB GLU 104 1.503 -16.503 -16.503 126 2HB GLU 104 1HB GLU 104 2.484 -16.291 -16.291 127 1HG GLU 104 2HG GLU 104 0.505 -15.208 -15.208 128 2HG GLU 104 1HG GLU 104 -0.426 -15.302 -15.302 129 H GLY 105 H GLY 105 3.624 -14.959 -14.959 130 1HA GLY 105 2HA GLY 105 2.961 -12.367 -12.367 131 2HA GLY 105 1HA GLY 105 3.538 -13.844 -13.844 132 H ASP 106 H ASP 106 4.812 -12.464 -12.464 133 HA ASP 106 HA ASP 106 6.761 -10.954 -10.954 134 1HB ASP 106 2HB ASP 106 7.538 -12.255 -12.255 135 2HB ASP 106 1HB ASP 106 6.550 -11.171 -11.171 136 H TYR 107 H TYR 107 4.167 -11.081 -11.081 137 HA TYR 107 HA TYR 107 4.082 -8.309 -8.309 138 1HB TYR 107 2HB TYR 107 3.474 -10.221 -10.221 139 2HB TYR 107 1HB TYR 107 2.176 -10.739 -10.739 140 HD1 TYR 107 2HD TYR 107 2.094 -7.167 -7.167 141 HD2 TYR 107 1HD TYR 107 1.096 -10.863 -10.863 142 HE1 TYR 107 2HE TYR 107 -0.019 -6.226 -6.226 143 HE2 TYR 107 1HE TYR 107 -0.644 -9.745 -9.745 144 HH TYR 107 HH TYR 107 -1.683 -6.484 -6.484 145 H GLN 108 H GLN 108 1.248 -10.222 -10.222 146 HA GLN 108 HA GLN 108 0.171 -8.180 -8.180 147 1HB GLN 108 2HB GLN 108 -0.652 -10.653 -10.653 148 2HB GLN 108 1HB GLN 108 -1.551 -9.382 -9.382 149 1HG GLN 108 2HG GLN 108 0.074 -11.380 -11.380 150 2HG GLN 108 1HG GLN 108 -1.373 -11.847 -11.847 151 1HE2 GLN 108 1HE2 GLN 108 -0.393 -8.606 -8.606 152 2HE2 GLN 108 2HE2 GLN 108 -1.682 -8.506 -8.506 153 H VAL 109 H VAL 109 2.759 -9.578 -9.578 154 HA VAL 109 HA VAL 109 2.348 -8.688 -8.688 155 HB VAL 109 HB VAL 109 4.877 -9.096 -9.096 156 1HG1 VAL 109 1HG1 VAL 109 4.579 -8.173 -8.173 157 2HG1 VAL 109 3HG1 VAL 109 6.062 -8.954 -8.954 158 3HG1 VAL 109 2HG1 VAL 109 5.539 -7.381 -7.381 159 1HG2 VAL 109 1HG2 VAL 109 3.522 -11.123 -11.123 160 2HG2 VAL 109 3HG2 VAL 109 5.130 -11.065 -11.065 161 3HG2 VAL 109 2HG2 VAL 109 3.638 -10.622 -10.622 162 H LYS 110 H LYS 110 3.565 -7.152 -7.152 163 HA LYS 110 HA LYS 110 3.624 -4.595 -4.595 164 1HB LYS 110 2HB LYS 110 4.562 -5.558 -5.558 165 2HB LYS 110 1HB LYS 110 4.532 -3.847 -3.847 166 1HG LYS 110 2HG LYS 110 6.201 -6.134 -6.134 167 2HG LYS 110 1HG LYS 110 6.656 -4.442 -4.442 168 1HD LYS 110 2HD LYS 110 5.744 -3.491 -3.491 169 2HD LYS 110 1HD LYS 110 5.367 -5.141 -5.141 170 1HE LYS 110 2HE LYS 110 7.807 -5.733 -5.733 171 2HE LYS 110 1HE LYS 110 8.194 -4.063 -4.063 172 1HZ LYS 110 2HZ LYS 110 6.832 -4.741 -4.741 173 2HZ LYS 110 1HZ LYS 110 8.452 -4.267 -4.267 174 3HZ LYS 110 3HZ LYS 110 7.203 -3.180 -3.180 175 H LEU 111 H LEU 111 1.346 -6.339 -6.339 176 HA LEU 111 HA LEU 111 -0.106 -4.002 -4.002 177 1HB LEU 111 2HB LEU 111 -0.415 -6.381 -6.381 178 2HB LEU 111 1HB LEU 111 -1.242 -6.766 -6.766 179 HG LEU 111 HG LEU 111 -2.107 -4.431 -4.431 180 1HD1 LEU 111 1HD1 LEU 111 -1.852 -6.451 -6.451 181 2HD1 LEU 111 3HD1 LEU 111 -2.950 -7.372 -7.372 182 3HD1 LEU 111 2HD1 LEU 111 -3.576 -5.953 -5.953 183 1HD2 LEU 111 3HD2 LEU 111 -3.552 -6.287 -6.287 184 2HD2 LEU 111 2HD2 LEU 111 -3.299 -4.499 -4.499 185 3HD2 LEU 111 1HD2 LEU 111 -4.430 -5.193 -5.193 186 H ARG 112 H ARG 112 0.563 -6.114 -6.114 187 HA ARG 112 HA ARG 112 -1.223 -5.057 -5.057 188 1HB ARG 112 2HB ARG 112 0.517 -7.076 -7.076 189 2HB ARG 112 1HB ARG 112 1.468 -5.785 -5.785 190 1HG ARG 112 2HG ARG 112 -0.477 -5.455 -5.455 191 2HG ARG 112 1HG ARG 112 -1.299 -6.842 -6.842 192 1HD ARG 112 2HD ARG 112 -0.090 -7.757 -7.757 193 2HD ARG 112 1HD ARG 112 0.852 -8.222 -8.222 194 HE ARG 112 HE ARG 112 1.637 -5.621 -5.621 195 1HH1 ARG 112 1HH1 ARG 112 2.125 -9.159 -9.159 196 2HH1 ARG 112 2HH1 ARG 112 3.748 -9.069 -9.069 197 1HH2 ARG 112 1HH2 ARG 112 3.827 -5.518 -5.518 198 2HH2 ARG 112 2HH2 ARG 112 4.726 -6.973 -6.973 199 H SER 113 H SER 113 2.281 -4.015 -4.015 200 HA SER 113 HA SER 113 2.328 -2.143 -2.143 201 1HB SER 113 2HB SER 113 4.290 -2.935 -2.935 202 2HB SER 113 1HB SER 113 3.786 -2.122 -2.122 203 HG SER 113 HG SER 113 3.854 -0.164 -0.164 204 H LEU 114 H LEU 114 1.062 -1.872 -1.872 205 HA LEU 114 HA LEU 114 0.695 0.835 0.835 206 1HB LEU 114 2HB LEU 114 1.198 -0.952 -0.952 207 2HB LEU 114 1HB LEU 114 -0.339 -1.777 -1.777 208 HG LEU 114 HG LEU 114 -1.559 0.155 0.155 209 1HD1 LEU 114 1HD1 LEU 114 1.236 1.215 1.215 210 2HD1 LEU 114 3HD1 LEU 114 -0.244 1.959 1.959 211 3HD1 LEU 114 2HD1 LEU 114 0.055 1.941 1.941 212 1HD2 LEU 114 3HD2 LEU 114 -1.126 -1.842 -1.842 213 2HD2 LEU 114 2HD2 LEU 114 -1.411 -0.391 -0.391 214 3HD2 LEU 114 1HD2 LEU 114 0.264 -1.017 -1.017 215 H ILE 115 H ILE 115 -1.499 -1.998 -1.998 216 HA ILE 115 HA ILE 115 -3.788 -0.537 -0.537 217 HB ILE 115 HB ILE 115 -3.059 -2.151 -2.151 218 1HG1 ILE 115 2HG1 ILE 115 -2.493 -3.708 -3.708 219 2HG1 ILE 115 1HG1 ILE 115 -3.944 -4.193 -4.193 220 1HG2 ILE 115 1HG2 ILE 115 -5.551 -1.364 -1.364 221 2HG2 ILE 115 3HG2 ILE 115 -5.598 -2.577 -2.577 222 3HG2 ILE 115 2HG2 ILE 115 -5.094 -0.895 -0.895 223 1HD1 ILE 115 1HD1 ILE 115 -5.371 -3.288 -3.288 224 2HD1 ILE 115 3HD1 ILE 115 -3.786 -2.971 -2.971 225 3HD1 ILE 115 2HD1 ILE 115 -4.303 -4.669 -4.669 226 H ARG 116 H ARG 116 -1.197 -0.923 -0.923 227 HA ARG 116 HA ARG 116 -2.061 0.515 0.515 228 1HB ARG 116 2HB ARG 116 -0.254 -1.045 -1.045 229 2HB ARG 116 1HB ARG 116 0.746 -0.156 -0.156 230 1HG ARG 116 2HG ARG 116 1.295 1.564 1.564 231 2HG ARG 116 1HG ARG 116 -0.038 1.139 1.139 232 1HD ARG 116 2HD ARG 116 2.199 0.426 0.426 233 2HD ARG 116 1HD ARG 116 1.133 -1.002 -1.002 234 HE ARG 116 HE ARG 116 3.301 -0.030 -0.030 235 1HH1 ARG 116 1HH1 ARG 116 1.535 -2.711 -2.711 236 2HH1 ARG 116 2HH1 ARG 116 2.522 -3.945 -3.945 237 1HH2 ARG 116 1HH2 ARG 116 4.610 -1.714 -1.714 238 2HH2 ARG 116 2HH2 ARG 116 4.280 -3.374 -3.374 239 H PHE 117 H PHE 117 -0.236 1.694 1.694 240 HA PHE 117 HA PHE 117 0.098 4.261 4.261 241 1HB PHE 117 2HB PHE 117 -0.463 3.102 3.102 242 2HB PHE 117 1HB PHE 117 0.254 4.706 4.706 243 HD1 PHE 117 1HD PHE 117 1.758 2.702 2.702 244 HD2 PHE 117 2HD PHE 117 1.372 3.257 3.257 245 HE1 PHE 117 1HE PHE 117 4.045 1.899 1.899 246 HE2 PHE 117 2HE PHE 117 3.689 2.336 2.336 247 HZ PHE 117 HZ PHE 117 5.044 1.718 1.718 248 H LEU 118 H LEU 118 -2.592 2.875 2.875 249 HA LEU 118 HA LEU 118 -4.146 5.219 5.219 250 1HB LEU 118 2HB LEU 118 -4.613 2.299 2.299 251 2HB LEU 118 1HB LEU 118 -5.932 3.522 3.522 252 HG LEU 118 HG LEU 118 -3.318 4.427 4.427 253 1HD1 LEU 118 3HD1 LEU 118 -3.731 1.773 1.773 254 2HD1 LEU 118 2HD1 LEU 118 -4.538 2.599 2.599 255 3HD1 LEU 118 1HD1 LEU 118 -2.805 2.995 2.995 256 1HD2 LEU 118 1HD2 LEU 118 -5.544 5.516 5.516 257 2HD2 LEU 118 3HD2 LEU 118 -4.731 5.124 5.124 258 3HD2 LEU 118 2HD2 LEU 118 -6.104 4.111 4.111 259 H GLU 119 H GLU 119 -3.890 2.886 2.886 260 HA GLU 119 HA GLU 119 -6.341 3.471 3.471 261 1HB GLU 119 2HB GLU 119 -3.757 2.123 2.123 262 2HB GLU 119 1HB GLU 119 -4.984 2.590 2.590 263 1HG GLU 119 2HG GLU 119 -6.683 1.148 1.148 264 2HG GLU 119 1HG GLU 119 -5.531 0.733 0.733 265 H GLU 120 H GLU 120 -2.945 4.662 4.662 266 HA GLU 120 HA GLU 120 -3.472 6.475 6.475 267 1HB GLU 120 2HB GLU 120 -1.487 7.006 7.006 268 2HB GLU 120 1HB GLU 120 -1.498 7.731 7.731 269 1HG GLU 120 2HG GLU 120 -1.106 5.265 5.265 270 2HG GLU 120 1HG GLU 120 -0.607 4.936 4.936 271 H GLY 121 H GLY 121 -4.351 6.362 6.362 272 1HA GLY 121 2HA GLY 121 -5.642 7.669 7.669 273 2HA GLY 121 1HA GLY 121 -5.528 8.949 8.949 274 H ASP 122 H ASP 122 -3.484 7.076 7.076 275 HA ASP 122 HA ASP 122 -2.298 9.636 9.636 276 1HB ASP 122 2HB ASP 122 -0.838 6.987 6.987 277 2HB ASP 122 1HB ASP 122 -0.169 8.624 8.624 278 H LYS 123 H LYS 123 -1.534 9.424 9.424 279 HA LYS 123 HA LYS 123 -3.323 7.707 7.707 280 1HB LYS 123 2HB LYS 123 -3.726 10.169 10.169 281 2HB LYS 123 1HB LYS 123 -1.991 10.395 10.395 282 1HG LYS 123 2HG LYS 123 -3.881 8.522 8.522 283 2HG LYS 123 1HG LYS 123 -3.874 10.274 10.274 284 1HD LYS 123 2HD LYS 123 -1.344 8.498 8.498 285 2HD LYS 123 1HD LYS 123 -2.494 9.036 9.036 286 1HE LYS 123 2HE LYS 123 -2.181 11.382 11.382 287 2HE LYS 123 1HE LYS 123 -0.755 10.669 10.669 288 1HZ LYS 123 2HZ LYS 123 -1.072 10.700 10.700 289 2HZ LYS 123 1HZ LYS 123 -0.050 11.719 11.719 290 3HZ LYS 123 3HZ LYS 123 0.231 10.044 10.044 291 H ALA 124 H ALA 124 -2.104 5.943 5.943 292 HA ALA 124 HA ALA 124 0.789 6.347 6.347 293 1HB ALA 124 2HB ALA 124 -0.196 4.527 4.527 294 2HB ALA 124 1HB ALA 124 -0.939 3.864 3.864 295 3HB ALA 124 3HB ALA 124 0.876 3.926 3.926 296 H LYS 125 H LYS 125 1.912 6.164 6.164 297 HA LYS 125 HA LYS 125 0.259 5.547 5.547 298 1HB LYS 125 2HB LYS 125 3.185 6.592 6.592 299 2HB LYS 125 1HB LYS 125 2.183 6.437 6.437 300 1HG LYS 125 2HG LYS 125 0.656 8.230 8.230 301 2HG LYS 125 1HG LYS 125 1.656 8.340 8.340 302 1HD LYS 125 2HD LYS 125 2.267 10.169 10.169 303 2HD LYS 125 1HD LYS 125 3.641 9.011 9.011 304 1HE LYS 125 2HE LYS 125 3.001 8.110 8.110 305 2HE LYS 125 1HE LYS 125 1.560 9.209 9.209 306 1HZ LYS 125 3HZ LYS 125 3.082 11.077 11.077 307 2HZ LYS 125 2HZ LYS 125 4.415 10.025 10.025 308 3HZ LYS 125 1HZ LYS 125 3.374 10.119 10.119 309 H ILE 126 H ILE 126 0.417 3.649 3.649 310 HA ILE 126 HA ILE 126 2.573 1.937 1.937 311 HB ILE 126 HB ILE 126 0.723 1.767 1.767 312 1HG1 ILE 126 2HG1 ILE 126 -0.885 2.205 2.205 313 2HG1 ILE 126 1HG1 ILE 126 -0.851 0.438 0.438 314 1HG2 ILE 126 3HG2 ILE 126 2.301 -0.140 -0.140 315 2HG2 ILE 126 2HG2 ILE 126 1.021 -0.717 -0.717 316 3HG2 ILE 126 1HG2 ILE 126 2.504 0.086 0.086 317 1HD1 ILE 126 3HD1 ILE 126 0.581 0.183 0.183 318 2HD1 ILE 126 2HD1 ILE 126 0.352 1.942 1.942 319 3HD1 ILE 126 1HD1 ILE 126 -1.083 0.847 0.847 320 H THR 127 H THR 127 4.449 1.745 1.745 321 HA THR 127 HA THR 127 4.519 3.039 3.039 322 HB THR 127 HB THR 127 6.851 2.421 2.421 323 HG1 THR 127 1HG THR 127 5.567 4.058 4.058 324 1HG2 THR 127 2HG2 THR 127 6.468 3.960 3.960 325 2HG2 THR 127 1HG2 THR 127 7.989 4.030 4.030 326 3HG2 THR 127 3HG2 THR 127 7.457 2.464 2.464 327 H LEU 128 H LEU 128 4.367 1.510 1.510 328 HA LEU 128 HA LEU 128 5.036 -1.251 -1.251 329 1HB LEU 128 2HB LEU 128 3.862 0.401 0.401 330 2HB LEU 128 1HB LEU 128 5.227 -0.475 -0.475 331 HG LEU 128 HG LEU 128 3.027 -1.743 -1.743 332 1HD1 LEU 128 1HD1 LEU 128 2.155 -0.341 -0.341 333 2HD1 LEU 128 3HD1 LEU 128 2.902 -1.422 -1.422 334 3HD1 LEU 128 2HD1 LEU 128 1.648 -2.049 -2.049 335 1HD2 LEU 128 3HD2 LEU 128 5.041 -3.233 -3.233 336 2HD2 LEU 128 2HD2 LEU 128 3.534 -3.940 -3.940 337 3HD2 LEU 128 1HD2 LEU 128 4.754 -3.237 -3.237 338 H ARG 129 H ARG 129 7.024 -2.272 -2.272 339 HA ARG 129 HA ARG 129 8.939 -0.632 -0.632 340 1HB ARG 129 2HB ARG 129 9.461 -0.273 -0.273 341 2HB ARG 129 1HB ARG 129 9.473 -2.064 -2.064 342 1HG ARG 129 2HG ARG 129 11.398 -2.205 -2.205 343 2HG ARG 129 1HG ARG 129 11.196 -0.478 -0.478 344 1HD ARG 129 2HD ARG 129 13.178 -0.855 -0.855 345 2HD ARG 129 1HD ARG 129 11.910 0.107 0.107 346 HE ARG 129 HE ARG 129 11.405 -2.673 -2.673 347 1HH1 ARG 129 1HH1 ARG 129 13.897 -0.202 -0.202 348 2HH1 ARG 129 2HH1 ARG 129 14.473 -0.946 -0.946 349 1HH2 ARG 129 1HH2 ARG 129 12.182 -3.672 -3.672 350 2HH2 ARG 129 2HH2 ARG 129 13.478 -2.945 -2.945 351 H PHE 130 H PHE 130 8.733 -1.740 -1.740 352 HA PHE 130 HA PHE 130 8.003 -4.488 -4.488 353 1HB PHE 130 2HB PHE 130 9.130 -2.231 -2.231 354 2HB PHE 130 1HB PHE 130 8.732 -3.918 -3.918 355 HD1 PHE 130 2HD PHE 130 6.553 -4.844 -4.844 356 HD2 PHE 130 1HD PHE 130 7.473 -0.768 -0.768 357 HE1 PHE 130 2HE PHE 130 4.245 -4.256 -4.256 358 HE2 PHE 130 1HE PHE 130 5.078 -0.209 -0.209 359 HZ PHE 130 HZ PHE 130 3.464 -1.976 -1.976 360 H ARG 131 H ARG 131 9.644 -6.093 -6.093 361 HA ARG 131 HA ARG 131 12.453 -5.541 -5.541 362 1HB ARG 131 2HB ARG 131 11.540 -7.899 -7.899 363 2HB ARG 131 1HB ARG 131 11.012 -7.857 -7.857 364 1HG ARG 131 2HG ARG 131 13.040 -9.172 -9.172 365 2HG ARG 131 1HG ARG 131 13.443 -7.687 -7.687 366 1HD ARG 131 2HD ARG 131 14.494 -6.699 -6.699 367 2HD ARG 131 1HD ARG 131 13.992 -8.171 -8.171 368 HE ARG 131 HE ARG 131 15.662 -9.433 -9.433 369 1HH1 ARG 131 1HH2 ARG 131 15.424 -6.178 -6.178 370 2HH1 ARG 131 2HH2 ARG 131 16.920 -6.315 -6.315 371 1HH2 ARG 131 1HH1 ARG 131 17.672 -9.588 -9.588 372 2HH2 ARG 131 2HH1 ARG 131 18.211 -8.277 -8.277 373 H GLY 132 H GLY 132 12.647 -3.581 -3.581 374 1HA GLY 132 2HA GLY 132 10.559 -3.493 -3.493 375 2HA GLY 132 1HA GLY 132 11.657 -2.147 -2.147 376 H ARG 133 H ARG 133 10.354 -3.979 -3.979 377 HA ARG 133 HA ARG 133 12.354 -3.355 -3.355 378 1HB ARG 133 2HB ARG 133 13.384 -5.342 -5.342 379 2HB ARG 133 1HB ARG 133 12.185 -6.351 -6.351 380 1HG ARG 133 2HG ARG 133 14.392 -6.494 -6.494 381 2HG ARG 133 1HG ARG 133 13.285 -5.678 -5.678 382 1HD ARG 133 2HD ARG 133 14.281 -3.407 -3.407 383 2HD ARG 133 1HD ARG 133 15.475 -4.396 -4.396 384 HE ARG 133 HE ARG 133 16.553 -4.889 -4.889 385 1HH1 ARG 133 1HH2 ARG 133 13.316 -3.519 -3.519 386 2HH1 ARG 133 2HH2 ARG 133 13.643 -3.198 -3.198 387 1HH2 ARG 133 1HH1 ARG 133 16.972 -4.445 -4.445 388 2HH2 ARG 133 2HH1 ARG 133 15.744 -3.734 -3.734 389 H GLU 134 H GLU 134 11.626 -5.966 -5.966 390 HA GLU 134 HA GLU 134 8.851 -5.532 -5.532 391 1HB GLU 134 2HB GLU 134 10.690 -7.879 -7.879 392 2HB GLU 134 1HB GLU 134 9.073 -7.534 -7.534 393 1HG GLU 134 2HG GLU 134 11.622 -5.804 -5.804 394 2HG GLU 134 1HG GLU 134 10.877 -6.875 -6.875 395 H MET 135 H MET 135 10.118 -6.281 -6.281 396 HA MET 135 HA MET 135 7.887 -8.046 -8.046 397 1HB MET 135 2HB MET 135 10.452 -7.867 -7.867 398 2HB MET 135 1HB MET 135 8.959 -8.742 -8.742 399 1HG MET 135 2HG MET 135 10.408 -10.417 -10.417 400 2HG MET 135 1HG MET 135 9.269 -10.195 -10.195 401 1HE MET 135 3HE MET 135 12.859 -9.700 -9.700 402 2HE MET 135 2HE MET 135 13.798 -8.941 -8.941 403 3HE MET 135 1HE MET 135 12.558 -7.988 -7.988 404 H ALA 136 H ALA 136 8.289 -5.110 -5.110 405 HA ALA 136 HA ALA 136 7.063 -4.286 -4.286 406 1HB ALA 136 3HB ALA 136 8.314 -2.412 -2.412 407 2HB ALA 136 2HB ALA 136 7.342 -1.931 -1.931 408 3HB ALA 136 1HB ALA 136 8.947 -2.693 -2.693 409 H HIS 137 H HIS 137 5.013 -4.792 -4.792 410 HA HIS 137 HA HIS 137 3.817 -3.964 -3.964 411 1HB HIS 137 2HB HIS 137 3.327 -6.613 -6.613 412 2HB HIS 137 1HB HIS 137 2.302 -5.844 -5.844 413 HD1 HIS 137 1HD HIS 137 2.550 -7.032 -7.032 414 HD2 HIS 137 2HD HIS 137 6.205 -6.229 -6.229 415 HE1 HIS 137 1HE HIS 137 4.400 -7.710 -7.710 416 H GLN 138 H GLN 138 1.331 -3.984 -3.984 417 HA GLN 138 HA GLN 138 0.507 -2.996 -2.996 418 1HB GLN 138 2HB GLN 138 -1.712 -2.565 -2.565 419 2HB GLN 138 1HB GLN 138 -0.365 -1.720 -1.720 420 1HG GLN 138 2HG GLN 138 -0.314 -3.468 -3.468 421 2HG GLN 138 1HG GLN 138 -1.680 -4.345 -4.345 422 1HE2 GLN 138 1HE2 GLN 138 -0.865 -2.036 -2.036 423 2HE2 GLN 138 2HE2 GLN 138 -2.381 -1.211 -1.211 424 H GLN 139 H GLN 139 1.221 -5.860 -5.860 425 HA GLN 139 HA GLN 139 -1.117 -7.274 -7.274 426 1HB GLN 139 2HB GLN 139 1.589 -8.473 -8.473 427 2HB GLN 139 1HB GLN 139 0.045 -9.324 -9.324 428 1HG GLN 139 2HG GLN 139 -0.819 -7.870 -7.870 429 2HG GLN 139 1HG GLN 139 0.886 -7.247 -7.247 430 1HE2 GLN 139 1HE2 GLN 139 1.645 -10.190 -10.190 431 2HE2 GLN 139 2HE2 GLN 139 1.703 -11.085 -11.085 432 H ILE 140 H ILE 140 2.433 -6.736 -6.736 433 HA ILE 140 HA ILE 140 3.003 -8.100 -8.100 434 HB ILE 140 HB ILE 140 4.346 -6.285 -6.285 435 1HG1 ILE 140 2HG1 ILE 140 4.486 -9.262 -9.262 436 2HG1 ILE 140 1HG1 ILE 140 3.550 -8.712 -8.712 437 1HG2 ILE 140 2HG2 ILE 140 5.185 -7.813 -7.813 438 2HG2 ILE 140 1HG2 ILE 140 6.340 -7.047 -7.047 439 3HG2 ILE 140 3HG2 ILE 140 5.223 -6.029 -6.029 440 1HD1 ILE 140 3HD1 ILE 140 5.660 -7.840 -7.840 441 2HD1 ILE 140 2HD1 ILE 140 6.591 -8.567 -8.567 442 3HD1 ILE 140 1HD1 ILE 140 5.653 -9.625 -9.625 443 H GLY 141 H GLY 141 2.006 -4.851 -4.851 444 1HA GLY 141 2HA GLY 141 2.207 -4.095 -4.095 445 2HA GLY 141 1HA GLY 141 1.357 -3.223 -3.223 446 H MET 142 H MET 142 -0.758 -4.756 -4.756 447 HA MET 142 HA MET 142 -2.158 -4.014 -4.014 448 1HB MET 142 2HB MET 142 -3.941 -3.609 -3.609 449 2HB MET 142 1HB MET 142 -2.562 -3.409 -3.409 450 1HG MET 142 2HG MET 142 -3.062 -5.898 -5.898 451 2HG MET 142 1HG MET 142 -4.429 -5.743 -5.743 452 1HE MET 142 3HE MET 142 -5.729 -6.713 -6.713 453 2HE MET 142 2HE MET 142 -5.869 -5.935 -5.935 454 3HE MET 142 1HE MET 142 -4.288 -6.590 -6.590 455 H GLU 143 H GLU 143 -1.036 -7.182 -7.182 456 HA GLU 143 HA GLU 143 -3.243 -8.210 -8.210 457 1HB GLU 143 2HB GLU 143 -1.134 -9.646 -9.646 458 2HB GLU 143 1HB GLU 143 -0.434 -9.244 -9.244 459 1HG GLU 143 2HG GLU 143 -1.444 -11.237 -11.237 460 2HG GLU 143 1HG GLU 143 -2.843 -10.222 -10.222 461 H VAL 144 H VAL 144 -0.119 -6.811 -6.811 462 HA VAL 144 HA VAL 144 -0.463 -7.584 -7.584 463 HB VAL 144 HB VAL 144 1.454 -5.526 -5.526 464 1HG1 VAL 144 2HG1 VAL 144 1.126 -7.313 -7.313 465 2HG1 VAL 144 1HG1 VAL 144 2.714 -6.635 -6.635 466 3HG1 VAL 144 3HG1 VAL 144 1.356 -5.526 -5.526 467 1HG2 VAL 144 1HG2 VAL 144 1.008 -8.529 -8.529 468 2HG2 VAL 144 3HG2 VAL 144 1.521 -7.527 -7.527 469 3HG2 VAL 144 2HG2 VAL 144 2.725 -7.880 -7.880 470 H LEU 145 H LEU 145 -0.410 -4.435 -4.435 471 HA LEU 145 HA LEU 145 -1.135 -2.792 -2.792 472 1HB LEU 145 2HB LEU 145 -1.739 -2.953 -2.953 473 2HB LEU 145 1HB LEU 145 -2.346 -1.577 -1.577 474 HG LEU 145 HG LEU 145 0.550 -2.326 -2.326 475 1HD1 LEU 145 3HD1 LEU 145 -1.449 -0.088 -0.088 476 2HD1 LEU 145 2HD1 LEU 145 0.318 0.120 0.120 477 3HD1 LEU 145 1HD1 LEU 145 -0.574 -1.213 -1.213 478 1HD2 LEU 145 3HD2 LEU 145 -0.647 -0.472 -0.472 479 2HD2 LEU 145 2HD2 LEU 145 0.593 -1.736 -1.736 480 3HD2 LEU 145 1HD2 LEU 145 1.033 -0.210 -0.210 481 H ASN 146 H ASN 146 -3.321 -4.180 -4.180 482 HA ASN 146 HA ASN 146 -5.802 -3.334 -3.334 483 1HB ASN 146 2HB ASN 146 -4.648 -4.354 -4.354 484 2HB ASN 146 1HB ASN 146 -5.408 -5.875 -5.875 485 1HD2 ASN 146 1HD2 ASN 146 -5.998 -6.002 -6.002 486 2HD2 ASN 146 2HD2 ASN 146 -7.444 -5.345 -5.345 487 H ARG 147 H ARG 147 -3.826 -6.330 -6.330 488 HA ARG 147 HA ARG 147 -6.038 -7.176 -7.176 489 1HB ARG 147 2HB ARG 147 -4.781 -8.751 -8.751 490 2HB ARG 147 1HB ARG 147 -3.218 -7.997 -7.997 491 1HG ARG 147 2HG ARG 147 -3.282 -9.051 -9.051 492 2HG ARG 147 1HG ARG 147 -5.112 -9.107 -9.107 493 1HD ARG 147 2HD ARG 147 -4.008 -11.429 -11.429 494 2HD ARG 147 1HD ARG 147 -4.900 -11.016 -11.016 495 HE ARG 147 HE ARG 147 -2.305 -10.004 -10.004 496 1HH1 ARG 147 1HH1 ARG 147 -3.740 -13.174 -13.174 497 2HH1 ARG 147 2HH1 ARG 147 -2.431 -14.093 -14.093 498 1HH2 ARG 147 1HH2 ARG 147 -0.542 -11.261 -11.261 499 2HH2 ARG 147 2HH2 ARG 147 -0.590 -12.991 -12.991 500 H VAL 148 H VAL 148 -3.391 -4.787 -4.787 501 HA VAL 148 HA VAL 148 -3.217 -5.307 -5.307 502 HB VAL 148 HB VAL 148 -2.724 -2.655 -2.655 503 1HG1 VAL 148 2HG1 VAL 148 -2.688 -3.425 -3.425 504 2HG1 VAL 148 1HG1 VAL 148 -1.264 -4.427 -4.427 505 3HG1 VAL 148 3HG1 VAL 148 -1.178 -2.619 -2.619 506 1HG2 VAL 148 1HG2 VAL 148 -0.832 -5.017 -5.017 507 2HG2 VAL 148 3HG2 VAL 148 -1.549 -4.047 -4.047 508 3HG2 VAL 148 2HG2 VAL 148 -0.387 -3.276 -3.276 509 H LYS 149 H LYS 149 -4.976 -2.977 -2.977 510 HA LYS 149 HA LYS 149 -6.434 -1.557 -1.557 511 1HB LYS 149 2HB LYS 149 -6.460 -1.303 -1.303 512 2HB LYS 149 1HB LYS 149 -7.283 -2.904 -2.904 513 1HG LYS 149 2HG LYS 149 -9.256 -2.241 -2.241 514 2HG LYS 149 1HG LYS 149 -8.657 -0.657 -0.657 515 1HD LYS 149 2HD LYS 149 -9.022 -1.584 -1.584 516 2HD LYS 149 1HD LYS 149 -10.192 -0.556 -0.556 517 1HE LYS 149 2HE LYS 149 -8.965 1.353 1.353 518 2HE LYS 149 1HE LYS 149 -7.555 0.440 0.440 519 1HZ LYS 149 3HZ LYS 149 -10.311 0.723 0.723 520 2HZ LYS 149 2HZ LYS 149 -8.934 1.579 1.579 521 3HZ LYS 149 1HZ LYS 149 -9.015 -0.103 -0.103 522 H ASP 150 H ASP 150 -7.196 -4.817 -4.817 523 HA ASP 150 HA ASP 150 -9.792 -4.771 -4.771 524 1HB ASP 150 2HB ASP 150 -7.988 -6.580 -6.580 525 2HB ASP 150 1HB ASP 150 -9.273 -7.299 -7.299 526 H ASP 151 H ASP 151 -6.688 -6.318 -6.318 527 HA ASP 151 HA ASP 151 -8.324 -7.401 -7.401 528 1HB ASP 151 2HB ASP 151 -6.064 -8.284 -8.284 529 2HB ASP 151 1HB ASP 151 -5.335 -6.854 -6.854 530 H LEU 152 H LEU 152 -6.705 -4.143 -4.143 531 HA LEU 152 HA LEU 152 -7.046 -3.707 -3.707 532 1HB LEU 152 2HB LEU 152 -5.977 -2.423 -2.423 533 2HB LEU 152 1HB LEU 152 -7.013 -1.324 -1.324 534 HG LEU 152 HG LEU 152 -5.040 -3.131 -3.131 535 1HD1 LEU 152 2HD1 LEU 152 -3.939 -2.358 -2.358 536 2HD1 LEU 152 1HD1 LEU 152 -4.214 -0.629 -0.629 537 3HD1 LEU 152 3HD1 LEU 152 -3.146 -1.657 -1.657 538 1HD2 LEU 152 3HD2 LEU 152 -6.072 -0.306 -0.306 539 2HD2 LEU 152 2HD2 LEU 152 -6.536 -1.858 -1.858 540 3HD2 LEU 152 1HD2 LEU 152 -4.888 -1.194 -1.194 541 H GLN 153 H GLN 153 -8.946 -3.005 -3.005 542 HA GLN 153 HA GLN 153 -10.449 -1.199 -1.199 543 1HB GLN 153 2HB GLN 153 -10.394 -3.569 -3.569 544 2HB GLN 153 1HB GLN 153 -11.826 -3.856 -3.856 545 1HG GLN 153 2HG GLN 153 -12.808 -1.711 -1.711 546 2HG GLN 153 1HG GLN 153 -11.175 -1.606 -1.606 547 1HE2 GLN 153 1HE2 GLN 153 -11.440 -2.165 -2.165 548 2HE2 GLN 153 2HE2 GLN 153 -12.252 -3.577 -3.577 549 H GLU 154 H GLU 154 -10.678 -3.305 -3.305 550 HA GLU 154 HA GLU 154 -13.185 -2.721 -2.721 551 1HB GLU 154 2HB GLU 154 -10.720 -3.014 -3.014 552 2HB GLU 154 1HB GLU 154 -12.353 -3.673 -3.673 553 1HG GLU 154 2HG GLU 154 -11.805 -5.283 -5.283 554 2HG GLU 154 1HG GLU 154 -10.153 -4.521 -4.521 555 H LEU 155 H LEU 155 -10.031 -1.391 -1.391 556 HA LEU 155 HA LEU 155 -11.026 0.595 0.595 557 1HB LEU 155 2HB LEU 155 -9.392 -1.320 -1.320 558 2HB LEU 155 1HB LEU 155 -8.185 -0.487 -0.487 559 HG LEU 155 HG LEU 155 -9.486 1.212 1.212 560 1HD1 LEU 155 1HD1 LEU 155 -9.457 -0.960 -0.960 561 2HD1 LEU 155 3HD1 LEU 155 -7.706 -1.166 -1.166 562 3HD1 LEU 155 2HD1 LEU 155 -8.251 0.174 0.174 563 1HD2 LEU 155 1HD2 LEU 155 -6.531 0.657 0.657 564 2HD2 LEU 155 3HD2 LEU 155 -7.518 2.056 2.056 565 3HD2 LEU 155 2HD2 LEU 155 -7.114 1.884 1.884 566 H ALA 156 H ALA 156 -8.827 -0.020 -0.020 567 HA ALA 156 HA ALA 156 -8.341 2.949 2.949 568 1HB ALA 156 1HB ALA 156 -6.278 1.736 1.736 569 2HB ALA 156 3HB ALA 156 -6.703 0.821 0.821 570 3HB ALA 156 2HB ALA 156 -6.561 2.617 2.617 571 H VAL 157 H VAL 157 -9.351 3.795 3.795 572 HA VAL 157 HA VAL 157 -8.339 1.913 1.913 573 HB VAL 157 HB VAL 157 -10.103 2.473 2.473 574 1HG1 VAL 157 2HG1 VAL 157 -11.399 2.145 2.145 575 2HG1 VAL 157 1HG1 VAL 157 -12.213 1.901 1.901 576 3HG1 VAL 157 3HG1 VAL 157 -10.819 0.849 0.849 577 1HG2 VAL 157 2HG2 VAL 157 -10.300 5.037 5.037 578 2HG2 VAL 157 1HG2 VAL 157 -10.503 4.692 4.692 579 3HG2 VAL 157 3HG2 VAL 157 -11.863 4.352 4.352 580 H VAL 158 H VAL 158 -8.284 2.363 2.363 581 HA VAL 158 HA VAL 158 -6.187 4.179 4.179 582 HB VAL 158 HB VAL 158 -7.667 2.753 2.753 583 1HG1 VAL 158 1HG1 VAL 158 -5.596 3.997 3.997 584 2HG1 VAL 158 3HG1 VAL 158 -4.673 2.892 2.892 585 3HG1 VAL 158 2HG1 VAL 158 -5.570 2.214 2.214 586 1HG2 VAL 158 3HG2 VAL 158 -5.956 1.471 1.471 587 2HG2 VAL 158 2HG2 VAL 158 -7.643 1.012 1.012 588 3HG2 VAL 158 1HG2 VAL 158 -6.230 0.675 0.675 589 H GLU 159 H GLU 159 -6.040 5.807 5.807 590 HA GLU 159 HA GLU 159 -8.327 7.460 7.460 591 1HB GLU 159 2HB GLU 159 -6.011 8.134 8.134 592 2HB GLU 159 1HB GLU 159 -5.553 7.661 7.661 593 1HG GLU 159 2HG GLU 159 -7.033 9.571 9.571 594 2HG GLU 159 1HG GLU 159 -7.532 9.905 9.905 595 H SER 160 H SER 160 -6.205 5.552 5.552 596 HA SER 160 HA SER 160 -8.023 5.733 5.733 597 1HB SER 160 2HB SER 160 -6.458 7.789 7.789 598 2HB SER 160 1HB SER 160 -5.232 6.567 6.567 599 HG SER 160 HG SER 160 -7.763 7.140 7.140 600 H PHE 161 H PHE 161 -7.372 4.153 4.153 601 HA PHE 161 HA PHE 161 -5.124 2.457 2.457 602 1HB PHE 161 2HB PHE 161 -7.551 1.478 1.478 603 2HB PHE 161 1HB PHE 161 -7.180 1.332 1.332 604 HD1 PHE 161 1HD PHE 161 -5.167 0.248 0.248 605 HD2 PHE 161 2HD PHE 161 -6.612 0.019 0.019 606 HE1 PHE 161 1HE PHE 161 -3.454 -1.405 -1.405 607 HE2 PHE 161 2HE PHE 161 -5.095 -1.498 -1.498 608 HZ PHE 161 HZ PHE 161 -3.544 -2.509 -2.509 609 HA PRO 162 HA PRO 162 -4.609 4.840 4.840 610 1HB PRO 162 2HB PRO 162 -2.896 6.592 6.592 611 2HB PRO 162 1HB PRO 162 -4.455 6.187 6.187 612 1HG PRO 162 2HG PRO 162 -1.717 5.284 5.284 613 2HG PRO 162 1HG PRO 162 -3.243 5.491 5.491 614 1HD PRO 162 2HD PRO 162 -2.186 3.079 3.079 615 2HD PRO 162 1HD PRO 162 -3.430 3.130 3.130 616 H THR 163 H THR 163 -1.021 5.167 5.167 617 HA THR 163 HA THR 163 -1.896 6.204 6.204 618 HB THR 163 HB THR 163 0.774 6.944 6.944 619 HG1 THR 163 1HG THR 163 0.041 5.832 5.832 620 1HG2 THR 163 2HG2 THR 163 -2.067 8.091 8.091 621 2HG2 THR 163 1HG2 THR 163 -0.550 9.046 9.046 622 3HG2 THR 163 3HG2 THR 163 -0.959 8.419 8.419 623 H LYS 164 H LYS 164 1.496 5.480 5.480 624 HA LYS 164 HA LYS 164 1.721 4.111 4.111 625 1HB LYS 164 2HB LYS 164 2.876 6.938 6.938 626 2HB LYS 164 1HB LYS 164 3.551 5.802 5.802 627 1HG LYS 164 2HG LYS 164 1.386 5.849 5.849 628 2HG LYS 164 1HG LYS 164 0.705 6.982 6.982 629 1HD LYS 164 2HD LYS 164 1.374 8.256 8.256 630 2HD LYS 164 1HD LYS 164 2.467 8.668 8.668 631 1HE LYS 164 2HE LYS 164 4.271 7.237 7.237 632 2HE LYS 164 1HE LYS 164 3.149 6.733 6.733 633 1HZ LYS 164 1HZ LYS 164 4.042 9.508 9.508 634 2HZ LYS 164 3HZ LYS 164 4.613 8.502 8.502 635 3HZ LYS 164 2HZ LYS 164 3.000 9.032 9.032 636 H ILE 165 H ILE 165 3.502 2.717 2.717 637 HA ILE 165 HA ILE 165 5.171 3.132 3.132 638 HB ILE 165 HB ILE 165 5.774 1.482 1.482 639 1HG1 ILE 165 2HG1 ILE 165 3.935 0.649 0.649 640 2HG1 ILE 165 1HG1 ILE 165 3.443 0.877 0.877 641 1HG2 ILE 165 1HG2 ILE 165 7.545 1.827 1.827 642 2HG2 ILE 165 3HG2 ILE 165 6.459 0.886 0.886 643 3HG2 ILE 165 2HG2 ILE 165 7.157 0.131 0.131 644 1HD1 ILE 165 3HD1 ILE 165 5.446 -1.234 -1.234 645 2HD1 ILE 165 2HD1 ILE 165 3.714 -1.489 -1.489 646 3HD1 ILE 165 1HD1 ILE 165 4.882 -1.045 -1.045 647 H GLU 166 H GLU 166 6.990 4.107 4.107 648 HA GLU 166 HA GLU 166 8.073 5.235 5.235 649 1HB GLU 166 2HB GLU 166 7.502 6.831 6.831 650 2HB GLU 166 1HB GLU 166 8.584 7.397 7.397 651 1HG GLU 166 2HG GLU 166 6.651 7.440 7.440 652 2HG GLU 166 1HG GLU 166 5.557 6.821 6.821 653 H GLY 167 H GLY 167 10.089 4.357 4.357 654 1HA GLY 167 2HA GLY 167 12.056 3.573 3.573 655 2HA GLY 167 1HA GLY 167 11.531 4.167 4.167 656 H ARG 168 H ARG 168 11.886 2.458 2.458 657 HA ARG 168 HA ARG 168 10.831 -0.093 -0.093 658 1HB ARG 168 2HB ARG 168 12.625 0.649 0.649 659 2HB ARG 168 1HB ARG 168 12.240 -1.024 -1.024 660 1HG ARG 168 2HG ARG 168 13.480 -0.588 -0.588 661 2HG ARG 168 1HG ARG 168 13.910 1.051 1.051 662 1HD ARG 168 2HD ARG 168 15.800 -0.528 -0.528 663 2HD ARG 168 1HD ARG 168 15.081 -0.013 -0.013 664 HE ARG 168 HE ARG 168 14.022 -2.523 -2.523 665 1HH1 ARG 168 1HH1 ARG 168 16.172 -1.014 -1.014 666 2HH1 ARG 168 2HH1 ARG 168 16.296 -2.443 -2.443 667 1HH2 ARG 168 1HH2 ARG 168 14.211 -4.434 -4.434 668 2HH2 ARG 168 2HH2 ARG 168 15.165 -4.407 -4.407 669 H GLN 169 H GLN 169 8.880 1.817 1.817 670 HA GLN 169 HA GLN 169 7.936 0.730 0.730 671 1HB GLN 169 2HB GLN 169 9.369 3.325 3.325 672 2HB GLN 169 1HB GLN 169 8.033 3.143 3.143 673 1HG GLN 169 2HG GLN 169 9.405 1.328 1.328 674 2HG GLN 169 1HG GLN 169 10.772 1.711 1.711 675 1HE2 GLN 169 1HE2 GLN 169 9.324 4.669 4.669 676 2HE2 GLN 169 2HE2 GLN 169 10.155 5.283 5.283 677 H MET 170 H MET 170 5.839 1.375 1.375 678 HA MET 170 HA MET 170 4.811 3.669 3.669 679 1HB MET 170 2HB MET 170 3.746 1.201 1.201 680 2HB MET 170 1HB MET 170 2.988 1.497 1.497 681 1HG MET 170 2HG MET 170 2.168 3.748 3.748 682 2HG MET 170 1HG MET 170 2.594 2.729 2.729 683 1HE MET 170 1HE MET 170 1.291 0.880 0.880 684 2HE MET 170 3HE MET 170 1.851 -0.119 -0.119 685 3HE MET 170 2HE MET 170 0.125 -0.154 -0.154 686 H ILE 171 H ILE 171 3.041 4.775 4.775 687 HA ILE 171 HA ILE 171 3.053 3.995 3.995 688 HB ILE 171 HB ILE 171 2.365 6.614 6.614 689 1HG1 ILE 171 2HG1 ILE 171 4.828 5.998 5.998 690 2HG1 ILE 171 1HG1 ILE 171 4.263 7.589 7.589 691 1HG2 ILE 171 3HG2 ILE 171 1.947 5.725 5.725 692 2HG2 ILE 171 2HG2 ILE 171 2.116 7.480 7.480 693 3HG2 ILE 171 1HG2 ILE 171 0.739 6.540 6.540 694 1HD1 ILE 171 1HD1 ILE 171 3.881 6.159 6.159 695 2HD1 ILE 171 3HD1 ILE 171 4.578 4.847 4.847 696 3HD1 ILE 171 2HD1 ILE 171 5.611 6.256 6.256 697 H MET 172 H MET 172 1.122 3.498 3.498 698 HA MET 172 HA MET 172 -1.428 4.304 4.304 699 1HB MET 172 2HB MET 172 -1.586 1.906 1.906 700 2HB MET 172 1HB MET 172 -0.518 1.676 1.676 701 1HG MET 172 2HG MET 172 -2.271 2.233 2.233 702 2HG MET 172 1HG MET 172 -3.287 2.921 2.921 703 1HE MET 172 3HE MET 172 -3.716 1.004 1.004 704 2HE MET 172 2HE MET 172 -4.276 -0.632 -0.632 705 3HE MET 172 1HE MET 172 -2.520 -0.309 -0.309 706 H VAL 173 H VAL 173 -2.571 5.605 5.605 707 HA VAL 173 HA VAL 173 -0.907 6.178 6.178 708 HB VAL 173 HB VAL 173 -3.394 7.612 7.612 709 1HG1 VAL 173 2HG1 VAL 173 -1.628 7.827 7.827 710 2HG1 VAL 173 1HG1 VAL 173 -0.563 8.554 8.554 711 3HG1 VAL 173 3HG1 VAL 173 -2.126 9.381 9.381 712 1HG2 VAL 173 3HG2 VAL 173 -0.699 7.806 7.806 713 2HG2 VAL 173 2HG2 VAL 173 -2.318 7.418 7.418 714 3HG2 VAL 173 1HG2 VAL 173 -1.987 9.053 9.053 715 H LEU 174 H LEU 174 -1.972 5.792 5.792 716 HA LEU 174 HA LEU 174 -4.788 4.637 4.637 717 1HB LEU 174 2HB LEU 174 -3.625 2.721 2.721 718 2HB LEU 174 1HB LEU 174 -2.242 3.411 3.411 719 HG LEU 174 HG LEU 174 -3.769 3.605 3.605 720 1HD1 LEU 174 1HD1 LEU 174 -5.488 2.441 2.441 721 2HD1 LEU 174 3HD1 LEU 174 -5.571 1.559 1.559 722 3HD1 LEU 174 2HD1 LEU 174 -5.949 3.338 3.338 723 1HD2 LEU 174 3HD2 LEU 174 -3.213 0.856 0.856 724 2HD2 LEU 174 2HD2 LEU 174 -2.109 1.927 1.927 725 3HD2 LEU 174 1HD2 LEU 174 -3.734 1.323 1.323 726 H ALA 175 H ALA 175 -6.174 5.634 5.634 727 HA ALA 175 HA ALA 175 -5.108 7.227 7.227 728 1HB ALA 175 2HB ALA 175 -7.504 7.422 7.422 729 2HB ALA 175 1HB ALA 175 -7.155 8.762 8.762 730 3HB ALA 175 3HB ALA 175 -5.981 8.502 8.502 731 HA PRO 176 HA PRO 176 -8.036 5.470 5.470 732 1HB PRO 176 2HB PRO 176 -9.392 8.175 8.175 733 2HB PRO 176 1HB PRO 176 -8.946 6.950 6.950 734 1HG PRO 176 2HG PRO 176 -7.327 9.117 9.117 735 2HG PRO 176 1HG PRO 176 -6.585 7.467 7.467 736 1HD PRO 176 2HD PRO 176 -7.072 9.080 9.080 737 2HD PRO 176 1HD PRO 176 -5.679 7.998 7.998 738 H LYS 177 H LYS 177 -10.147 4.598 4.598 739 HA LYS 177 HA LYS 177 -11.886 4.896 4.896 740 1HB LYS 177 2HB LYS 177 -11.768 2.743 2.743 741 2HB LYS 177 1HB LYS 177 -12.125 3.608 3.608 742 1HG LYS 177 2HG LYS 177 -14.031 2.314 2.314 743 2HG LYS 177 1HG LYS 177 -14.491 4.018 4.018 744 1HD LYS 177 2HD LYS 177 -15.463 2.965 2.965 745 2HD LYS 177 1HD LYS 177 -13.967 3.662 3.662 746 1HE LYS 177 2HE LYS 177 -12.843 1.384 1.384 747 2HE LYS 177 1HE LYS 177 -14.373 0.746 0.746 748 1HZ LYS 177 1HZ LYS 177 -15.503 1.296 1.296 749 2HZ LYS 177 3HZ LYS 177 -14.064 1.893 1.893 750 3HZ LYS 177 2HZ LYS 177 -14.196 0.249 0.249 751 H LYS 178 H LYS 178 -13.203 6.584 6.584 752 HA LYS 178 HA LYS 178 -14.279 8.103 8.103 753 1HB LYS 178 2HB LYS 178 -14.843 7.974 7.974 754 2HB LYS 178 1HB LYS 178 -15.706 9.077 9.077 755 1HG LYS 178 2HG LYS 178 -14.116 10.534 10.534 756 2HG LYS 178 1HG LYS 178 -13.248 9.901 9.901 757 1HD LYS 178 2HD LYS 178 -12.104 8.212 8.212 758 2HD LYS 178 1HD LYS 178 -12.927 9.075 9.075 759 1HE LYS 178 2HE LYS 178 -10.597 9.872 9.872 760 2HE LYS 178 1HE LYS 178 -11.710 11.211 11.211 761 1HZ LYS 178 3HZ LYS 178 -11.338 10.548 10.548 762 2HZ LYS 178 2HZ LYS 178 -10.277 9.318 9.318 763 3HZ LYS 178 1HZ LYS 178 -9.883 10.946 10.946 764 H LYS 179 H LYS 179 -15.931 7.270 7.270 765 HA LYS 179 HA LYS 179 -16.690 4.694 4.694 766 1HB LYS 179 2HB LYS 179 -16.686 6.000 6.000 767 2HB LYS 179 1HB LYS 179 -18.213 6.790 6.790 768 1HG LYS 179 2HG LYS 179 -19.361 4.561 4.561 769 2HG LYS 179 1HG LYS 179 -17.815 3.748 3.748 770 1HD LYS 179 2HD LYS 179 -19.261 5.831 5.831 771 2HD LYS 179 1HD LYS 179 -19.468 4.050 4.050 772 1HE LYS 179 2HE LYS 179 -17.018 3.790 3.790 773 2HE LYS 179 1HE LYS 179 -16.828 5.593 5.593 774 1HZ LYS 179 3HZ LYS 179 -18.461 5.744 5.744 775 2HZ LYS 179 2HZ LYS 179 -18.623 4.055 4.055 776 3HZ LYS 179 1HZ LYS 179 -17.144 4.776 4.776 777 H GLN 180 H GLN 180 -18.022 3.685 3.685 778 HA GLN 180 HA GLN 180 -19.868 5.173 5.173 779 1HB GLN 180 2HB GLN 180 -19.543 2.133 2.133 780 2HB GLN 180 1HB GLN 180 -20.551 2.918 2.918 781 1HG GLN 180 2HG GLN 180 -17.467 3.087 3.087 782 2HG GLN 180 1HG GLN 180 -18.391 2.117 2.117 783 1HE2 GLN 180 1HE2 GLN 180 -20.217 3.563 3.563 784 2HE2 GLN 180 2HE2 GLN 180 -19.644 5.062 5.062 Start of MODEL 24 1 HA VAL 90 HA VAL 90 -3.066 16.983 16.983 2 HB VAL 90 HB VAL 90 -2.111 17.250 17.250 3 1HG1 VAL 90 1HG1 VAL 90 -1.653 19.361 19.361 4 2HG1 VAL 90 3HG1 VAL 90 -1.760 19.611 19.611 5 3HG1 VAL 90 2HG1 VAL 90 -3.169 18.909 18.909 6 1HG2 VAL 90 2HG2 VAL 90 0.527 17.597 17.597 7 2HG2 VAL 90 1HG2 VAL 90 0.097 16.282 16.282 8 3HG2 VAL 90 3HG2 VAL 90 0.219 17.984 17.984 9 H ILE 91 H ILE 91 -3.066 15.815 15.815 10 HA ILE 91 HA ILE 91 -2.540 12.983 12.983 11 HB ILE 91 HB ILE 91 -4.165 14.336 14.336 12 1HG1 ILE 91 2HG1 ILE 91 -5.308 14.615 14.615 13 2HG1 ILE 91 1HG1 ILE 91 -6.118 13.300 13.300 14 1HG2 ILE 91 1HG2 ILE 91 -3.686 11.363 11.363 15 2HG2 ILE 91 3HG2 ILE 91 -4.975 11.951 11.951 16 3HG2 ILE 91 2HG2 ILE 91 -3.252 12.205 12.205 17 1HD1 ILE 91 1HD1 ILE 91 -4.788 11.604 11.604 18 2HD1 ILE 91 3HD1 ILE 91 -4.129 12.963 12.963 19 3HD1 ILE 91 2HD1 ILE 91 -5.903 12.627 12.627 20 H GLN 92 H GLN 92 -0.755 12.128 12.128 21 HA GLN 92 HA GLN 92 0.975 13.819 13.819 22 1HB GLN 92 2HB GLN 92 1.641 11.504 11.504 23 2HB GLN 92 1HB GLN 92 2.802 12.733 12.733 24 1HG GLN 92 2HG GLN 92 1.758 14.486 14.486 25 2HG GLN 92 1HG GLN 92 0.368 13.454 13.454 26 1HE2 GLN 92 1HE2 GLN 92 0.204 12.824 12.824 27 2HE2 GLN 92 2HE2 GLN 92 1.486 12.322 12.322 28 H VAL 93 H VAL 93 2.612 12.513 12.513 29 HA VAL 93 HA VAL 93 1.367 9.976 9.976 30 HB VAL 93 HB VAL 93 3.837 11.367 11.367 31 1HG1 VAL 93 3HG1 VAL 93 2.451 8.626 8.626 32 2HG1 VAL 93 2HG1 VAL 93 3.527 9.267 9.267 33 3HG1 VAL 93 1HG1 VAL 93 4.248 8.857 8.857 34 1HG2 VAL 93 2HG2 VAL 93 1.366 11.989 11.989 35 2HG2 VAL 93 1HG2 VAL 93 2.502 11.408 11.408 36 3HG2 VAL 93 3HG2 VAL 93 1.340 10.239 10.239 37 H LYS 94 H LYS 94 1.781 8.396 8.396 38 HA LYS 94 HA LYS 94 4.742 8.065 8.065 39 1HB LYS 94 2HB LYS 94 2.783 6.258 6.258 40 2HB LYS 94 1HB LYS 94 4.503 6.513 6.513 41 1HG LYS 94 2HG LYS 94 2.258 8.593 8.593 42 2HG LYS 94 1HG LYS 94 2.800 7.513 7.513 43 1HD LYS 94 2HD LYS 94 4.636 9.568 9.568 44 2HD LYS 94 1HD LYS 94 3.707 9.867 9.867 45 1HE LYS 94 2HE LYS 94 5.850 7.656 7.656 46 2HE LYS 94 1HE LYS 94 6.095 9.271 9.271 47 1HZ LYS 94 2HZ LYS 94 4.377 8.720 8.720 48 2HZ LYS 94 1HZ LYS 94 4.141 7.201 7.201 49 3HZ LYS 94 3HZ LYS 94 5.624 7.566 7.566 50 H GLU 95 H GLU 95 5.279 5.595 5.595 51 HA GLU 95 HA GLU 95 3.797 4.954 4.954 52 1HB GLU 95 2HB GLU 95 5.932 6.389 6.389 53 2HB GLU 95 1HB GLU 95 6.744 4.853 4.853 54 1HG GLU 95 2HG GLU 95 5.995 3.807 3.807 55 2HG GLU 95 1HG GLU 95 5.154 5.348 5.348 56 H ILE 96 H ILE 96 4.095 2.720 2.720 57 HA ILE 96 HA ILE 96 5.727 1.008 1.008 58 HB ILE 96 HB ILE 96 2.989 0.779 0.779 59 1HG1 ILE 96 2HG1 ILE 96 3.394 -1.722 -1.722 60 2HG1 ILE 96 1HG1 ILE 96 5.106 -1.477 -1.477 61 1HG2 ILE 96 2HG2 ILE 96 2.750 0.496 0.496 62 2HG2 ILE 96 1HG2 ILE 96 3.619 -1.120 -1.120 63 3HG2 ILE 96 3HG2 ILE 96 2.130 -0.892 -0.892 64 1HD1 ILE 96 3HD1 ILE 96 5.320 0.263 0.263 65 2HD1 ILE 96 2HD1 ILE 96 3.596 -0.031 -0.031 66 3HD1 ILE 96 1HD1 ILE 96 4.817 -1.346 -1.346 67 H LYS 97 H LYS 97 6.547 -0.913 -0.913 68 HA LYS 97 HA LYS 97 5.969 -0.317 -0.317 69 1HB LYS 97 2HB LYS 97 8.505 -1.768 -1.768 70 2HB LYS 97 1HB LYS 97 7.891 -1.323 -1.323 71 1HG LYS 97 2HG LYS 97 8.073 1.134 1.134 72 2HG LYS 97 1HG LYS 97 8.969 0.579 0.579 73 1HD LYS 97 2HD LYS 97 9.790 0.155 0.155 74 2HD LYS 97 1HD LYS 97 10.453 1.376 1.376 75 1HE LYS 97 2HE LYS 97 12.107 -0.317 -0.317 76 2HE LYS 97 1HE LYS 97 11.203 -0.657 -0.657 77 1HZ LYS 97 1HZ LYS 97 10.828 -2.012 -2.012 78 2HZ LYS 97 3HZ LYS 97 11.653 -2.636 -2.636 79 3HZ LYS 97 2HZ LYS 97 9.980 -2.356 -2.356 80 H PHE 98 H PHE 98 5.747 -2.061 -2.061 81 HA PHE 98 HA PHE 98 5.654 -4.712 -4.712 82 1HB PHE 98 2HB PHE 98 3.624 -3.377 -3.377 83 2HB PHE 98 1HB PHE 98 3.749 -5.158 -5.158 84 HD1 PHE 98 2HD PHE 98 3.908 -5.988 -5.988 85 HD2 PHE 98 1HD PHE 98 2.121 -2.496 -2.496 86 HE1 PHE 98 2HE PHE 98 2.620 -5.834 -5.834 87 HE2 PHE 98 1HE PHE 98 0.687 -2.344 -2.344 88 HZ PHE 98 HZ PHE 98 0.868 -4.163 -4.163 89 H ARG 99 H ARG 99 6.471 -6.303 -6.303 90 HA ARG 99 HA ARG 99 7.862 -5.260 -5.260 91 1HB ARG 99 2HB ARG 99 8.399 -7.518 -7.518 92 2HB ARG 99 1HB ARG 99 9.325 -7.206 -7.206 93 1HG ARG 99 2HG ARG 99 9.912 -4.920 -4.920 94 2HG ARG 99 1HG ARG 99 9.153 -5.316 -5.316 95 1HD ARG 99 2HD ARG 99 10.834 -7.136 -7.136 96 2HD ARG 99 1HD ARG 99 11.534 -6.813 -6.813 97 HE ARG 99 HE ARG 99 11.344 -4.420 -4.420 98 1HH1 ARG 99 1HH1 ARG 99 13.321 -7.237 -7.237 99 2HH1 ARG 99 2HH1 ARG 99 14.830 -6.486 -6.486 100 1HH2 ARG 99 1HH2 ARG 99 13.384 -3.424 -3.424 101 2HH2 ARG 99 2HH2 ARG 99 14.868 -4.286 -4.286 102 HA PRO 100 HA PRO 100 5.584 -8.346 -8.346 103 1HB PRO 100 2HB PRO 100 7.736 -9.646 -9.646 104 2HB PRO 100 1HB PRO 100 6.787 -8.246 -8.246 105 1HG PRO 100 2HG PRO 100 9.493 -8.275 -8.275 106 2HG PRO 100 1HG PRO 100 8.861 -7.146 -7.146 107 1HD PRO 100 2HD PRO 100 9.085 -6.440 -6.440 108 2HD PRO 100 1HD PRO 100 7.689 -5.822 -5.822 109 H GLY 101 H GLY 101 5.150 -10.622 -10.622 110 1HA GLY 101 2HA GLY 101 5.047 -12.617 -12.617 111 2HA GLY 101 1HA GLY 101 6.755 -12.367 -12.367 112 H THR 102 H THR 102 6.792 -12.519 -12.519 113 HA THR 102 HA THR 102 6.541 -12.416 -12.416 114 HB THR 102 HB THR 102 5.564 -9.577 -9.577 115 HG1 THR 102 1HG THR 102 7.463 -10.058 -10.058 116 1HG2 THR 102 1HG2 THR 102 6.825 -11.311 -11.311 117 2HG2 THR 102 3HG2 THR 102 7.050 -9.504 -9.504 118 3HG2 THR 102 2HG2 THR 102 5.405 -10.222 -10.222 119 H ASP 103 H ASP 103 5.060 -13.788 -13.788 120 HA ASP 103 HA ASP 103 2.398 -12.741 -12.741 121 1HB ASP 103 2HB ASP 103 3.046 -14.583 -14.583 122 2HB ASP 103 1HB ASP 103 3.143 -15.575 -15.575 123 H GLU 104 H GLU 104 1.896 -15.352 -15.352 124 HA GLU 104 HA GLU 104 0.732 -13.193 -13.193 125 1HB GLU 104 2HB GLU 104 0.730 -15.976 -15.976 126 2HB GLU 104 1HB GLU 104 -0.372 -14.646 -14.646 127 1HG GLU 104 2HG GLU 104 -1.265 -14.504 -14.504 128 2HG GLU 104 1HG GLU 104 -0.255 -15.943 -15.943 129 H GLY 105 H GLY 105 3.291 -15.093 -15.093 130 1HA GLY 105 2HA GLY 105 2.923 -13.330 -13.330 131 2HA GLY 105 1HA GLY 105 3.591 -15.052 -15.052 132 H ASP 106 H ASP 106 3.840 -12.123 -12.123 133 HA ASP 106 HA ASP 106 6.403 -11.205 -11.205 134 1HB ASP 106 2HB ASP 106 6.687 -12.932 -12.932 135 2HB ASP 106 1HB ASP 106 5.928 -11.767 -11.767 136 H TYR 107 H TYR 107 3.548 -11.400 -11.400 137 HA TYR 107 HA TYR 107 3.758 -8.694 -8.694 138 1HB TYR 107 2HB TYR 107 3.253 -10.717 -10.717 139 2HB TYR 107 1HB TYR 107 1.855 -11.129 -11.129 140 HD1 TYR 107 2HD TYR 107 1.997 -7.615 -7.615 141 HD2 TYR 107 1HD TYR 107 0.918 -11.451 -11.451 142 HE1 TYR 107 2HE TYR 107 -0.096 -6.703 -6.703 143 HE2 TYR 107 1HE TYR 107 -0.673 -10.347 -10.347 144 HH TYR 107 HH TYR 107 -1.673 -7.008 -7.008 145 H GLN 108 H GLN 108 0.841 -10.538 -10.538 146 HA GLN 108 HA GLN 108 -0.287 -8.474 -8.474 147 1HB GLN 108 2HB GLN 108 -1.154 -10.979 -10.979 148 2HB GLN 108 1HB GLN 108 -2.020 -9.678 -9.678 149 1HG GLN 108 2HG GLN 108 -0.327 -11.671 -11.671 150 2HG GLN 108 1HG GLN 108 -1.853 -12.095 -12.095 151 1HE2 GLN 108 1HE2 GLN 108 -0.724 -8.844 -8.844 152 2HE2 GLN 108 2HE2 GLN 108 -1.942 -8.719 -8.719 153 H VAL 109 H VAL 109 2.266 -10.053 -10.053 154 HA VAL 109 HA VAL 109 1.827 -9.215 -9.215 155 HB VAL 109 HB VAL 109 4.378 -9.684 -9.684 156 1HG1 VAL 109 2HG1 VAL 109 4.022 -8.996 -8.996 157 2HG1 VAL 109 1HG1 VAL 109 5.486 -9.803 -9.803 158 3HG1 VAL 109 3HG1 VAL 109 5.065 -8.156 -8.156 159 1HG2 VAL 109 1HG2 VAL 109 2.927 -11.695 -11.695 160 2HG2 VAL 109 3HG2 VAL 109 4.470 -11.802 -11.802 161 3HG2 VAL 109 2HG2 VAL 109 2.942 -11.361 -11.361 162 H LYS 110 H LYS 110 3.271 -7.695 -7.695 163 HA LYS 110 HA LYS 110 3.403 -5.185 -5.185 164 1HB LYS 110 2HB LYS 110 4.417 -6.069 -6.069 165 2HB LYS 110 1HB LYS 110 4.500 -4.393 -4.393 166 1HG LYS 110 2HG LYS 110 5.923 -6.880 -6.880 167 2HG LYS 110 1HG LYS 110 6.544 -5.223 -5.223 168 1HD LYS 110 2HD LYS 110 5.737 -4.256 -4.256 169 2HD LYS 110 1HD LYS 110 5.066 -5.842 -5.842 170 1HE LYS 110 2HE LYS 110 7.364 -6.829 -6.829 171 2HE LYS 110 1HE LYS 110 8.053 -5.231 -5.231 172 1HZ LYS 110 3HZ LYS 110 6.472 -5.750 -5.750 173 2HZ LYS 110 2HZ LYS 110 8.157 -5.558 -5.558 174 3HZ LYS 110 1HZ LYS 110 7.132 -4.260 -4.260 175 H LEU 111 H LEU 111 0.989 -6.703 -6.703 176 HA LEU 111 HA LEU 111 -0.242 -4.289 -4.289 177 1HB LEU 111 2HB LEU 111 -0.682 -6.633 -6.633 178 2HB LEU 111 1HB LEU 111 -1.557 -6.977 -6.977 179 HG LEU 111 HG LEU 111 -2.256 -4.624 -4.624 180 1HD1 LEU 111 1HD1 LEU 111 -2.001 -6.684 -6.684 181 2HD1 LEU 111 3HD1 LEU 111 -3.178 -7.547 -7.547 182 3HD1 LEU 111 2HD1 LEU 111 -3.708 -6.120 -6.120 183 1HD2 LEU 111 3HD2 LEU 111 -3.846 -6.380 -6.380 184 2HD2 LEU 111 2HD2 LEU 111 -3.589 -4.589 -4.589 185 3HD2 LEU 111 1HD2 LEU 111 -4.658 -5.326 -5.326 186 H ARG 112 H ARG 112 0.208 -6.460 -6.460 187 HA ARG 112 HA ARG 112 -1.483 -5.218 -5.218 188 1HB ARG 112 2HB ARG 112 0.104 -7.383 -7.383 189 2HB ARG 112 1HB ARG 112 1.161 -6.217 -6.217 190 1HG ARG 112 2HG ARG 112 -0.674 -5.845 -5.845 191 2HG ARG 112 1HG ARG 112 -1.727 -6.975 -6.975 192 1HD ARG 112 2HD ARG 112 -0.672 -8.276 -8.276 193 2HD ARG 112 1HD ARG 112 0.100 -8.769 -8.769 194 HE ARG 112 HE ARG 112 1.497 -6.526 -6.526 195 1HH1 ARG 112 1HH2 ARG 112 1.038 -10.067 -10.067 196 2HH1 ARG 112 2HH2 ARG 112 2.611 -10.402 -10.402 197 1HH2 ARG 112 1HH1 ARG 112 3.623 -6.995 -6.995 198 2HH2 ARG 112 2HH1 ARG 112 4.102 -8.633 -8.633 199 H SER 113 H SER 113 2.104 -4.548 -4.548 200 HA SER 113 HA SER 113 2.327 -2.500 -2.500 201 1HB SER 113 2HB SER 113 4.175 -3.510 -3.510 202 2HB SER 113 1HB SER 113 3.665 -2.792 -2.792 203 HG SER 113 HG SER 113 3.875 -0.756 -0.756 204 H LEU 114 H LEU 114 0.968 -2.530 -2.530 205 HA LEU 114 HA LEU 114 0.650 0.183 0.183 206 1HB LEU 114 2HB LEU 114 -0.745 -2.247 -2.247 207 2HB LEU 114 1HB LEU 114 -1.583 -0.676 -0.676 208 HG LEU 114 HG LEU 114 1.246 -1.211 -1.211 209 1HD1 LEU 114 2HD1 LEU 114 -0.571 -2.531 -2.531 210 2HD1 LEU 114 1HD1 LEU 114 -1.483 -1.010 -1.010 211 3HD1 LEU 114 3HD1 LEU 114 0.110 -1.295 -1.295 212 1HD2 LEU 114 2HD2 LEU 114 -0.710 1.170 1.170 213 2HD2 LEU 114 1HD2 LEU 114 0.938 1.172 1.172 214 3HD2 LEU 114 3HD2 LEU 114 0.733 1.041 1.041 215 H ILE 115 H ILE 115 -1.537 -2.142 -2.142 216 HA ILE 115 HA ILE 115 -3.721 -0.465 -0.465 217 HB ILE 115 HB ILE 115 -3.205 -1.849 -1.849 218 1HG1 ILE 115 2HG1 ILE 115 -2.490 -3.601 -3.601 219 2HG1 ILE 115 1HG1 ILE 115 -3.956 -4.011 -4.011 220 1HG2 ILE 115 1HG2 ILE 115 -5.412 -1.306 -1.306 221 2HG2 ILE 115 3HG2 ILE 115 -5.663 -2.219 -2.219 222 3HG2 ILE 115 2HG2 ILE 115 -5.086 -0.509 -0.509 223 1HD1 ILE 115 1HD1 ILE 115 -3.883 -2.934 -2.934 224 2HD1 ILE 115 3HD1 ILE 115 -4.153 -4.673 -4.673 225 3HD1 ILE 115 2HD1 ILE 115 -5.391 -3.434 -3.434 226 H ARG 116 H ARG 116 -1.047 -0.927 -0.927 227 HA ARG 116 HA ARG 116 -1.518 0.798 0.798 228 1HB ARG 116 2HB ARG 116 0.436 -0.823 -0.823 229 2HB ARG 116 1HB ARG 116 1.327 0.433 0.433 230 1HG ARG 116 2HG ARG 116 0.139 1.211 1.211 231 2HG ARG 116 1HG ARG 116 1.553 0.106 0.106 232 1HD ARG 116 2HD ARG 116 2.902 1.769 1.769 233 2HD ARG 116 1HD ARG 116 1.511 2.914 2.914 234 HE ARG 116 HE ARG 116 1.758 3.270 3.270 235 1HH1 ARG 116 1HH2 ARG 116 4.108 0.854 0.854 236 2HH1 ARG 116 2HH2 ARG 116 5.115 0.942 0.942 237 1HH2 ARG 116 1HH1 ARG 116 3.129 3.367 3.367 238 2HH2 ARG 116 2HH1 ARG 116 4.553 2.384 2.384 239 H PHE 117 H PHE 117 0.214 1.584 1.584 240 HA PHE 117 HA PHE 117 0.612 4.336 4.336 241 1HB PHE 117 2HB PHE 117 0.376 2.850 2.850 242 2HB PHE 117 1HB PHE 117 0.672 4.661 4.661 243 HD1 PHE 117 1HD PHE 117 2.327 5.454 5.454 244 HD2 PHE 117 2HD PHE 117 2.015 1.398 1.398 245 HE1 PHE 117 1HE PHE 117 4.727 5.155 5.155 246 HE2 PHE 117 2HE PHE 117 4.395 1.006 1.006 247 HZ PHE 117 HZ PHE 117 5.736 2.905 2.905 248 H LEU 118 H LEU 118 -2.097 2.809 2.809 249 HA LEU 118 HA LEU 118 -3.436 5.104 5.104 250 1HB LEU 118 2HB LEU 118 -3.971 2.383 2.383 251 2HB LEU 118 1HB LEU 118 -5.312 3.198 3.198 252 HG LEU 118 HG LEU 118 -4.849 5.077 5.077 253 1HD1 LEU 118 2HD1 LEU 118 -4.036 2.330 2.330 254 2HD1 LEU 118 1HD1 LEU 118 -4.794 3.619 3.619 255 3HD1 LEU 118 3HD1 LEU 118 -3.273 4.011 4.011 256 1HD2 LEU 118 1HD2 LEU 118 -6.727 2.787 2.787 257 2HD2 LEU 118 3HD2 LEU 118 -6.829 4.566 4.566 258 3HD2 LEU 118 2HD2 LEU 118 -6.827 4.013 4.013 259 H GLU 119 H GLU 119 -3.398 3.173 3.173 260 HA GLU 119 HA GLU 119 -5.729 4.260 4.260 261 1HB GLU 119 2HB GLU 119 -3.561 2.329 2.329 262 2HB GLU 119 1HB GLU 119 -4.743 3.006 3.006 263 1HG GLU 119 2HG GLU 119 -6.649 2.079 2.079 264 2HG GLU 119 1HG GLU 119 -5.535 1.418 1.418 265 H GLU 120 H GLU 120 -2.286 5.029 5.029 266 HA GLU 120 HA GLU 120 -2.490 6.572 6.572 267 1HB GLU 120 2HB GLU 120 -0.574 6.977 6.977 268 2HB GLU 120 1HB GLU 120 -0.424 7.744 7.744 269 1HG GLU 120 2HG GLU 120 0.036 4.795 4.795 270 2HG GLU 120 1HG GLU 120 1.216 5.979 5.979 271 H GLY 121 H GLY 121 -3.711 6.856 6.856 272 1HA GLY 121 2HA GLY 121 -5.061 8.351 8.351 273 2HA GLY 121 1HA GLY 121 -4.639 9.496 9.496 274 H ASP 122 H ASP 122 -3.089 7.679 7.679 275 HA ASP 122 HA ASP 122 -2.044 10.267 10.267 276 1HB ASP 122 2HB ASP 122 -0.453 7.651 7.651 277 2HB ASP 122 1HB ASP 122 0.118 9.279 9.279 278 H LYS 123 H LYS 123 -1.305 9.676 9.676 279 HA LYS 123 HA LYS 123 -3.187 7.612 7.612 280 1HB LYS 123 2HB LYS 123 -1.239 9.017 9.017 281 2HB LYS 123 1HB LYS 123 -2.697 8.103 8.103 282 1HG LYS 123 2HG LYS 123 -3.854 10.013 10.013 283 2HG LYS 123 1HG LYS 123 -3.668 10.342 10.342 284 1HD LYS 123 2HD LYS 123 -2.744 12.235 12.235 285 2HD LYS 123 1HD LYS 123 -1.383 11.354 11.354 286 1HE LYS 123 2HE LYS 123 -0.598 10.352 10.352 287 2HE LYS 123 1HE LYS 123 -2.177 10.496 10.496 288 1HZ LYS 123 3HZ LYS 123 -0.354 12.743 12.743 289 2HZ LYS 123 2HZ LYS 123 -0.542 12.037 12.037 290 3HZ LYS 123 1HZ LYS 123 -1.836 12.874 12.874 291 H ALA 124 H ALA 124 -2.248 5.787 5.787 292 HA ALA 124 HA ALA 124 0.649 5.602 5.602 293 1HB ALA 124 3HB ALA 124 -1.691 3.696 3.696 294 2HB ALA 124 2HB ALA 124 0.070 3.245 3.245 295 3HB ALA 124 1HB ALA 124 -0.657 3.686 3.686 296 H LYS 125 H LYS 125 1.778 5.328 5.328 297 HA LYS 125 HA LYS 125 -0.248 5.145 5.145 298 1HB LYS 125 2HB LYS 125 0.670 7.513 7.513 299 2HB LYS 125 1HB LYS 125 2.293 6.895 6.895 300 1HG LYS 125 2HG LYS 125 2.705 6.080 6.080 301 2HG LYS 125 1HG LYS 125 1.068 6.614 6.614 302 1HD LYS 125 2HD LYS 125 3.141 8.511 8.511 303 2HD LYS 125 1HD LYS 125 3.115 8.160 8.160 304 1HE LYS 125 2HE LYS 125 0.827 9.008 9.008 305 2HE LYS 125 1HE LYS 125 0.749 9.398 9.398 306 1HZ LYS 125 1HZ LYS 125 2.689 10.507 10.507 307 2HZ LYS 125 3HZ LYS 125 1.323 11.300 11.300 308 3HZ LYS 125 2HZ LYS 125 2.605 10.883 10.883 309 H ILE 126 H ILE 126 0.247 3.449 3.449 310 HA ILE 126 HA ILE 126 2.405 1.796 1.796 311 HB ILE 126 HB ILE 126 0.649 1.591 1.591 312 1HG1 ILE 126 2HG1 ILE 126 -1.042 1.888 1.888 313 2HG1 ILE 126 1HG1 ILE 126 -0.851 0.121 0.121 314 1HG2 ILE 126 2HG2 ILE 126 2.246 -0.281 -0.281 315 2HG2 ILE 126 1HG2 ILE 126 0.987 -0.887 -0.887 316 3HG2 ILE 126 3HG2 ILE 126 2.456 -0.057 -0.057 317 1HD1 ILE 126 2HD1 ILE 126 0.667 0.199 0.199 318 2HD1 ILE 126 1HD1 ILE 126 -0.047 1.827 1.827 319 3HD1 ILE 126 3HD1 ILE 126 -1.126 0.375 0.375 320 H THR 127 H THR 127 4.363 1.580 1.580 321 HA THR 127 HA THR 127 4.535 2.851 2.851 322 HB THR 127 HB THR 127 6.784 2.332 2.332 323 HG1 THR 127 1HG THR 127 5.445 4.722 4.722 324 1HG2 THR 127 1HG2 THR 127 6.496 3.731 3.731 325 2HG2 THR 127 3HG2 THR 127 7.929 3.989 3.989 326 3HG2 THR 127 2HG2 THR 127 7.588 2.346 2.346 327 H LEU 128 H LEU 128 4.524 1.321 1.321 328 HA LEU 128 HA LEU 128 5.355 -1.401 -1.401 329 1HB LEU 128 2HB LEU 128 4.070 -0.069 -0.069 330 2HB LEU 128 1HB LEU 128 5.621 -0.651 -0.651 331 HG LEU 128 HG LEU 128 3.830 -2.221 -2.221 332 1HD1 LEU 128 3HD1 LEU 128 5.894 -3.416 -3.416 333 2HD1 LEU 128 2HD1 LEU 128 5.292 -3.488 -3.488 334 3HD1 LEU 128 1HD1 LEU 128 4.393 -4.337 -4.337 335 1HD2 LEU 128 3HD2 LEU 128 2.270 -1.238 -1.238 336 2HD2 LEU 128 2HD2 LEU 128 2.283 -3.038 -3.038 337 3HD2 LEU 128 1HD2 LEU 128 3.082 -1.927 -1.927 338 H ARG 129 H ARG 129 7.342 -2.311 -2.311 339 HA ARG 129 HA ARG 129 9.204 -0.491 -0.491 340 1HB ARG 129 2HB ARG 129 9.692 -0.556 -0.556 341 2HB ARG 129 1HB ARG 129 9.807 -2.329 -2.329 342 1HG ARG 129 2HG ARG 129 11.533 -1.514 -1.514 343 2HG ARG 129 1HG ARG 129 11.618 -0.054 -0.054 344 1HD ARG 129 2HD ARG 129 13.495 -1.648 -1.648 345 2HD ARG 129 1HD ARG 129 12.383 -1.459 -1.459 346 HE ARG 129 HE ARG 129 11.668 -3.684 -3.684 347 1HH1 ARG 129 1HH2 ARG 129 13.590 -2.695 -2.695 348 2HH1 ARG 129 2HH2 ARG 129 13.643 -4.288 -4.288 349 1HH2 ARG 129 1HH1 ARG 129 11.747 -5.810 -5.810 350 2HH2 ARG 129 2HH1 ARG 129 12.582 -6.076 -6.076 351 H PHE 130 H PHE 130 8.995 -1.405 -1.405 352 HA PHE 130 HA PHE 130 8.361 -4.181 -4.181 353 1HB PHE 130 2HB PHE 130 9.482 -1.956 -1.956 354 2HB PHE 130 1HB PHE 130 8.987 -3.613 -3.613 355 HD1 PHE 130 1HD PHE 130 6.842 -4.440 -4.440 356 HD2 PHE 130 2HD PHE 130 7.859 -0.344 -0.344 357 HE1 PHE 130 1HE PHE 130 4.415 -3.737 -3.737 358 HE2 PHE 130 2HE PHE 130 5.480 0.288 0.288 359 HZ PHE 130 HZ PHE 130 3.750 -1.516 -1.516 360 H ARG 131 H ARG 131 9.860 -5.707 -5.707 361 HA ARG 131 HA ARG 131 12.721 -5.196 -5.196 362 1HB ARG 131 2HB ARG 131 12.055 -7.164 -7.164 363 2HB ARG 131 1HB ARG 131 11.195 -7.879 -7.879 364 1HG ARG 131 2HG ARG 131 13.351 -8.986 -8.986 365 2HG ARG 131 1HG ARG 131 13.309 -8.197 -8.197 366 1HD ARG 131 2HD ARG 131 15.525 -7.887 -7.887 367 2HD ARG 131 1HD ARG 131 14.698 -6.279 -6.279 368 HE ARG 131 HE ARG 131 14.040 -7.490 -7.490 369 1HH1 ARG 131 1HH1 ARG 131 16.663 -5.916 -5.916 370 2HH1 ARG 131 2HH1 ARG 131 17.471 -5.297 -5.297 371 1HH2 ARG 131 1HH2 ARG 131 15.146 -6.649 -6.649 372 2HH2 ARG 131 2HH2 ARG 131 16.599 -5.721 -5.721 373 H GLY 132 H GLY 132 13.227 -4.628 -4.628 374 1HA GLY 132 2HA GLY 132 11.040 -4.486 -4.486 375 2HA GLY 132 1HA GLY 132 12.710 -3.979 -3.979 376 H ARG 133 H ARG 133 10.213 -5.743 -5.743 377 HA ARG 133 HA ARG 133 12.032 -7.345 -7.345 378 1HB ARG 133 2HB ARG 133 10.520 -8.788 -8.788 379 2HB ARG 133 1HB ARG 133 9.215 -8.390 -8.390 380 1HG ARG 133 2HG ARG 133 10.666 -9.372 -9.372 381 2HG ARG 133 1HG ARG 133 11.942 -9.712 -9.712 382 1HD ARG 133 2HD ARG 133 10.452 -11.360 -11.360 383 2HD ARG 133 1HD ARG 133 9.106 -10.952 -10.952 384 HE ARG 133 HE ARG 133 11.441 -11.584 -11.584 385 1HH1 ARG 133 1HH2 ARG 133 9.139 -13.122 -13.122 386 2HH1 ARG 133 2HH2 ARG 133 9.239 -14.688 -14.688 387 1HH2 ARG 133 1HH1 ARG 133 11.571 -13.705 -13.705 388 2HH2 ARG 133 2HH1 ARG 133 10.643 -15.023 -15.023 389 H GLU 134 H GLU 134 10.912 -4.711 -4.711 390 HA GLU 134 HA GLU 134 10.453 -4.302 -4.302 391 1HB GLU 134 2HB GLU 134 8.143 -5.365 -5.365 392 2HB GLU 134 1HB GLU 134 7.875 -4.128 -4.128 393 1HG GLU 134 2HG GLU 134 7.699 -2.365 -2.365 394 2HG GLU 134 1HG GLU 134 8.394 -3.441 -3.441 395 H MET 135 H MET 135 10.777 -3.883 -3.883 396 HA MET 135 HA MET 135 11.426 -2.378 -2.378 397 1HB MET 135 2HB MET 135 11.124 -0.185 -0.185 398 2HB MET 135 1HB MET 135 11.671 0.032 0.032 399 1HG MET 135 2HG MET 135 13.554 -1.559 -1.559 400 2HG MET 135 1HG MET 135 13.087 -1.702 -1.702 401 1HE MET 135 2HE MET 135 15.617 -1.189 -1.189 402 2HE MET 135 1HE MET 135 16.473 0.297 0.297 403 3HE MET 135 3HE MET 135 15.893 -0.902 -0.902 404 H ALA 136 H ALA 136 8.346 -2.746 -2.746 405 HA ALA 136 HA ALA 136 7.054 -1.270 -1.270 406 1HB ALA 136 2HB ALA 136 7.549 0.065 0.065 407 2HB ALA 136 1HB ALA 136 6.168 0.515 0.515 408 3HB ALA 136 3HB ALA 136 7.837 0.761 0.761 409 H HIS 137 H HIS 137 5.313 -2.521 -2.521 410 HA HIS 137 HA HIS 137 3.991 -3.347 -3.347 411 1HB HIS 137 2HB HIS 137 3.970 -5.215 -5.215 412 2HB HIS 137 1HB HIS 137 3.496 -5.417 -5.417 413 HD1 HIS 137 1HD HIS 137 5.175 -6.648 -6.648 414 HD2 HIS 137 2HD HIS 137 7.007 -4.571 -4.571 415 HE1 HIS 137 1HE HIS 137 7.647 -7.289 -7.289 416 H GLN 138 H GLN 138 1.663 -3.671 -3.671 417 HA GLN 138 HA GLN 138 0.538 -3.067 -3.067 418 1HB GLN 138 2HB GLN 138 -0.846 -2.838 -2.838 419 2HB GLN 138 1HB GLN 138 -1.675 -2.781 -2.781 420 1HG GLN 138 2HG GLN 138 -0.299 -0.776 -0.776 421 2HG GLN 138 1HG GLN 138 0.403 -0.747 -0.747 422 1HE2 GLN 138 1HE2 GLN 138 -0.642 0.543 0.543 423 2HE2 GLN 138 2HE2 GLN 138 -2.318 0.976 0.976 424 H GLN 139 H GLN 139 1.903 -5.414 -5.414 425 HA GLN 139 HA GLN 139 -0.353 -7.231 -7.231 426 1HB GLN 139 2HB GLN 139 2.468 -8.202 -8.202 427 2HB GLN 139 1HB GLN 139 0.924 -9.068 -9.068 428 1HG GLN 139 2HG GLN 139 0.325 -7.419 -7.419 429 2HG GLN 139 1HG GLN 139 1.938 -6.634 -6.634 430 1HE2 GLN 139 1HE2 GLN 139 3.597 -7.311 -7.311 431 2HE2 GLN 139 2HE2 GLN 139 3.771 -8.862 -8.862 432 H ILE 140 H ILE 140 3.203 -6.746 -6.746 433 HA ILE 140 HA ILE 140 3.659 -7.830 -7.830 434 HB ILE 140 HB ILE 140 4.839 -5.551 -5.551 435 1HG1 ILE 140 2HG1 ILE 140 6.730 -7.047 -7.047 436 2HG1 ILE 140 1HG1 ILE 140 5.840 -8.326 -8.326 437 1HG2 ILE 140 2HG2 ILE 140 5.307 -6.778 -6.778 438 2HG2 ILE 140 1HG2 ILE 140 6.619 -5.963 -5.963 439 3HG2 ILE 140 3HG2 ILE 140 5.187 -5.023 -5.023 440 1HD1 ILE 140 1HD1 ILE 140 4.946 -7.329 -7.329 441 2HD1 ILE 140 3HD1 ILE 140 6.188 -8.622 -8.622 442 3HD1 ILE 140 2HD1 ILE 140 4.508 -8.880 -8.880 443 H GLY 141 H GLY 141 2.478 -4.555 -4.555 444 1HA GLY 141 2HA GLY 141 2.384 -3.840 -3.840 445 2HA GLY 141 1HA GLY 141 1.605 -2.993 -2.993 446 H MET 142 H MET 142 -0.304 -4.663 -4.663 447 HA MET 142 HA MET 142 -2.090 -4.084 -4.084 448 1HB MET 142 2HB MET 142 -3.506 -3.428 -3.428 449 2HB MET 142 1HB MET 142 -1.996 -3.311 -3.311 450 1HG MET 142 2HG MET 142 -2.518 -5.599 -5.599 451 2HG MET 142 1HG MET 142 -3.972 -5.562 -5.562 452 1HE MET 142 2HE MET 142 -6.019 -4.229 -4.229 453 2HE MET 142 1HE MET 142 -5.203 -2.630 -2.630 454 3HE MET 142 3HE MET 142 -6.344 -2.980 -2.980 455 H GLU 143 H GLU 143 -0.537 -7.096 -7.096 456 HA GLU 143 HA GLU 143 -2.838 -8.376 -8.376 457 1HB GLU 143 2HB GLU 143 -0.520 -9.592 -9.592 458 2HB GLU 143 1HB GLU 143 -0.069 -9.259 -9.259 459 1HG GLU 143 2HG GLU 143 -0.967 -11.359 -11.359 460 2HG GLU 143 1HG GLU 143 -2.447 -10.444 -10.444 461 H VAL 144 H VAL 144 0.082 -6.924 -6.924 462 HA VAL 144 HA VAL 144 -0.434 -7.672 -7.672 463 HB VAL 144 HB VAL 144 1.545 -5.654 -5.654 464 1HG1 VAL 144 1HG1 VAL 144 0.954 -7.199 -7.199 465 2HG1 VAL 144 3HG1 VAL 144 2.603 -6.654 -6.654 466 3HG1 VAL 144 2HG1 VAL 144 1.282 -5.432 -5.432 467 1HG2 VAL 144 2HG2 VAL 144 1.084 -8.660 -8.660 468 2HG2 VAL 144 1HG2 VAL 144 1.712 -7.814 -7.814 469 3HG2 VAL 144 3HG2 VAL 144 2.801 -8.022 -8.022 470 H LEU 145 H LEU 145 -0.354 -4.510 -4.510 471 HA LEU 145 HA LEU 145 -1.324 -2.921 -2.921 472 1HB LEU 145 2HB LEU 145 -1.990 -2.968 -2.968 473 2HB LEU 145 1HB LEU 145 -2.590 -1.684 -1.684 474 HG LEU 145 HG LEU 145 0.305 -2.341 -2.341 475 1HD1 LEU 145 1HD1 LEU 145 -1.535 0.035 0.035 476 2HD1 LEU 145 3HD1 LEU 145 0.252 0.036 0.036 477 3HD1 LEU 145 2HD1 LEU 145 -0.816 -1.140 -1.140 478 1HD2 LEU 145 1HD2 LEU 145 -0.897 -0.542 -0.542 479 2HD2 LEU 145 3HD2 LEU 145 0.359 -1.801 -1.801 480 3HD2 LEU 145 2HD2 LEU 145 0.774 -0.254 -0.254 481 H ASN 146 H ASN 146 -3.242 -4.488 -4.488 482 HA ASN 146 HA ASN 146 -5.846 -3.865 -3.865 483 1HB ASN 146 2HB ASN 146 -4.430 -5.016 -5.016 484 2HB ASN 146 1HB ASN 146 -5.284 -6.460 -6.460 485 1HD2 ASN 146 1HD2 ASN 146 -5.823 -6.669 -6.669 486 2HD2 ASN 146 2HD2 ASN 146 -7.146 -5.852 -5.852 487 H ARG 147 H ARG 147 -3.856 -6.727 -6.727 488 HA ARG 147 HA ARG 147 -6.122 -7.494 -7.494 489 1HB ARG 147 2HB ARG 147 -4.971 -9.140 -9.140 490 2HB ARG 147 1HB ARG 147 -3.364 -8.404 -8.404 491 1HG ARG 147 2HG ARG 147 -3.370 -9.448 -9.448 492 2HG ARG 147 1HG ARG 147 -5.199 -9.491 -9.491 493 1HD ARG 147 2HD ARG 147 -4.140 -11.813 -11.813 494 2HD ARG 147 1HD ARG 147 -5.039 -11.404 -11.404 495 HE ARG 147 HE ARG 147 -2.390 -10.457 -10.457 496 1HH1 ARG 147 1HH2 ARG 147 -4.006 -13.555 -13.555 497 2HH1 ARG 147 2HH2 ARG 147 -2.796 -14.530 -14.530 498 1HH2 ARG 147 1HH1 ARG 147 -0.768 -11.783 -11.783 499 2HH2 ARG 147 2HH1 ARG 147 -0.930 -13.507 -13.507 500 H VAL 148 H VAL 148 -3.483 -5.170 -5.170 501 HA VAL 148 HA VAL 148 -3.290 -5.834 -5.834 502 HB VAL 148 HB VAL 148 -2.807 -3.116 -3.116 503 1HG1 VAL 148 1HG1 VAL 148 -2.688 -3.908 -3.908 504 2HG1 VAL 148 3HG1 VAL 148 -1.317 -4.973 -4.973 505 3HG1 VAL 148 2HG1 VAL 148 -1.169 -3.171 -3.171 506 1HG2 VAL 148 3HG2 VAL 148 -1.102 -5.567 -5.567 507 2HG2 VAL 148 2HG2 VAL 148 -1.588 -4.230 -4.230 508 3HG2 VAL 148 1HG2 VAL 148 -0.374 -3.921 -3.921 509 H LYS 149 H LYS 149 -5.011 -3.622 -3.622 510 HA LYS 149 HA LYS 149 -6.373 -2.155 -2.155 511 1HB LYS 149 2HB LYS 149 -6.282 -1.743 -1.743 512 2HB LYS 149 1HB LYS 149 -7.455 -3.103 -3.103 513 1HG LYS 149 2HG LYS 149 -8.592 -0.981 -0.981 514 2HG LYS 149 1HG LYS 149 -9.175 -1.947 -1.947 515 1HD LYS 149 2HD LYS 149 -8.973 0.498 0.498 516 2HD LYS 149 1HD LYS 149 -7.979 -0.490 -0.490 517 1HE LYS 149 2HE LYS 149 -6.677 0.773 0.773 518 2HE LYS 149 1HE LYS 149 -6.933 1.737 1.737 519 1HZ LYS 149 1HZ LYS 149 -5.727 0.102 0.102 520 2HZ LYS 149 3HZ LYS 149 -5.476 -0.851 -0.851 521 3HZ LYS 149 2HZ LYS 149 -4.799 0.703 0.703 522 H ASP 150 H ASP 150 -7.476 -5.052 -5.052 523 HA ASP 150 HA ASP 150 -9.962 -5.166 -5.166 524 1HB ASP 150 2HB ASP 150 -7.917 -7.197 -7.197 525 2HB ASP 150 1HB ASP 150 -9.592 -7.602 -7.602 526 H ASP 151 H ASP 151 -6.796 -6.610 -6.610 527 HA ASP 151 HA ASP 151 -8.394 -7.508 -7.508 528 1HB ASP 151 2HB ASP 151 -6.246 -8.501 -8.501 529 2HB ASP 151 1HB ASP 151 -5.393 -7.126 -7.126 530 H LEU 152 H LEU 152 -6.833 -4.298 -4.298 531 HA LEU 152 HA LEU 152 -6.826 -3.731 -3.731 532 1HB LEU 152 2HB LEU 152 -6.043 -2.363 -2.363 533 2HB LEU 152 1HB LEU 152 -7.281 -1.396 -1.396 534 HG LEU 152 HG LEU 152 -5.310 -0.455 -0.455 535 1HD1 LEU 152 1HD1 LEU 152 -6.651 -0.990 -0.990 536 2HD1 LEU 152 3HD1 LEU 152 -5.817 -2.564 -2.564 537 3HD1 LEU 152 2HD1 LEU 152 -4.911 -1.040 -1.040 538 1HD2 LEU 152 1HD2 LEU 152 -4.087 -3.172 -3.172 539 2HD2 LEU 152 3HD2 LEU 152 -3.866 -1.687 -1.687 540 3HD2 LEU 152 2HD2 LEU 152 -3.278 -1.650 -1.650 541 H GLN 153 H GLN 153 -9.057 -3.311 -3.311 542 HA GLN 153 HA GLN 153 -10.340 -1.408 -1.408 543 1HB GLN 153 2HB GLN 153 -10.538 -3.853 -3.853 544 2HB GLN 153 1HB GLN 153 -11.950 -3.935 -3.935 545 1HG GLN 153 2HG GLN 153 -12.847 -1.877 -1.877 546 2HG GLN 153 1HG GLN 153 -11.236 -1.912 -1.912 547 1HE2 GLN 153 1HE2 GLN 153 -13.796 -4.342 -4.342 548 2HE2 GLN 153 2HE2 GLN 153 -13.887 -5.129 -5.129 549 H GLU 154 H GLU 154 -10.884 -3.401 -3.401 550 HA GLU 154 HA GLU 154 -13.326 -2.602 -2.602 551 1HB GLU 154 2HB GLU 154 -10.945 -3.147 -3.147 552 2HB GLU 154 1HB GLU 154 -12.629 -3.692 -3.692 553 1HG GLU 154 2HG GLU 154 -12.119 -5.249 -5.249 554 2HG GLU 154 1HG GLU 154 -10.422 -4.602 -4.602 555 H LEU 155 H LEU 155 -10.116 -1.517 -1.517 556 HA LEU 155 HA LEU 155 -10.824 0.437 0.437 557 1HB LEU 155 2HB LEU 155 -9.431 -1.606 -1.606 558 2HB LEU 155 1HB LEU 155 -8.330 -1.123 -1.123 559 HG LEU 155 HG LEU 155 -7.365 -0.995 -0.995 560 1HD1 LEU 155 1HD1 LEU 155 -6.605 0.694 0.694 561 2HD1 LEU 155 3HD1 LEU 155 -7.599 1.952 1.952 562 3HD1 LEU 155 2HD1 LEU 155 -6.232 1.159 1.159 563 1HD2 LEU 155 2HD2 LEU 155 -9.248 -0.605 -0.605 564 2HD2 LEU 155 1HD2 LEU 155 -7.702 0.252 0.252 565 3HD2 LEU 155 3HD2 LEU 155 -9.111 1.178 1.178 566 H ALA 156 H ALA 156 -8.842 -0.185 -0.185 567 HA ALA 156 HA ALA 156 -8.430 2.761 2.761 568 1HB ALA 156 1HB ALA 156 -6.238 1.365 1.365 569 2HB ALA 156 3HB ALA 156 -6.776 0.694 0.694 570 3HB ALA 156 2HB ALA 156 -6.469 2.442 2.442 571 H VAL 157 H VAL 157 -9.237 3.687 3.687 572 HA VAL 157 HA VAL 157 -8.529 1.915 1.915 573 HB VAL 157 HB VAL 157 -10.433 2.712 2.712 574 1HG1 VAL 157 1HG1 VAL 157 -11.432 2.199 2.199 575 2HG1 VAL 157 3HG1 VAL 157 -12.427 2.119 2.119 576 3HG1 VAL 157 2HG1 VAL 157 -11.037 0.963 0.963 577 1HG2 VAL 157 3HG2 VAL 157 -10.402 4.932 4.932 578 2HG2 VAL 157 2HG2 VAL 157 -10.393 5.064 5.064 579 3HG2 VAL 157 1HG2 VAL 157 -11.923 4.600 4.600 580 H VAL 158 H VAL 158 -8.945 3.195 3.195 581 HA VAL 158 HA VAL 158 -6.381 4.156 4.156 582 HB VAL 158 HB VAL 158 -8.069 4.481 4.481 583 1HG1 VAL 158 3HG1 VAL 158 -5.809 2.526 2.526 584 2HG1 VAL 158 2HG1 VAL 158 -6.469 2.536 2.536 585 3HG1 VAL 158 1HG1 VAL 158 -5.655 3.991 3.991 586 1HG2 VAL 158 2HG2 VAL 158 -9.791 3.166 3.166 587 2HG2 VAL 158 1HG2 VAL 158 -8.985 2.380 2.380 588 3HG2 VAL 158 3HG2 VAL 158 -8.691 1.767 1.767 589 H GLU 159 H GLU 159 -5.831 6.025 6.025 590 HA GLU 159 HA GLU 159 -7.837 8.110 8.110 591 1HB GLU 159 2HB GLU 159 -5.410 8.561 8.561 592 2HB GLU 159 1HB GLU 159 -5.217 7.941 7.941 593 1HG GLU 159 2HG GLU 159 -6.781 9.856 9.856 594 2HG GLU 159 1HG GLU 159 -6.995 10.310 10.310 595 H SER 160 H SER 160 -5.990 5.659 5.659 596 HA SER 160 HA SER 160 -7.923 5.705 5.705 597 1HB SER 160 2HB SER 160 -6.105 7.591 7.591 598 2HB SER 160 1HB SER 160 -5.177 6.132 6.132 599 HG SER 160 HG SER 160 -7.699 7.009 7.009 600 H PHE 161 H PHE 161 -7.600 3.786 3.786 601 HA PHE 161 HA PHE 161 -5.404 2.059 2.059 602 1HB PHE 161 2HB PHE 161 -8.097 1.577 1.577 603 2HB PHE 161 1HB PHE 161 -7.028 0.840 0.840 604 HD1 PHE 161 1HD PHE 161 -7.690 1.217 1.217 605 HD2 PHE 161 2HD PHE 161 -5.547 -1.039 -1.039 606 HE1 PHE 161 1HE PHE 161 -6.834 -0.268 -0.268 607 HE2 PHE 161 2HE PHE 161 -4.362 -2.148 -2.148 608 HZ PHE 161 HZ PHE 161 -5.223 -1.928 -1.928 609 HA PRO 162 HA PRO 162 -4.807 3.794 3.794 610 1HB PRO 162 2HB PRO 162 -2.598 5.292 5.292 611 2HB PRO 162 1HB PRO 162 -4.190 5.561 5.561 612 1HG PRO 162 2HG PRO 162 -1.756 4.404 4.404 613 2HG PRO 162 1HG PRO 162 -3.287 5.009 5.009 614 1HD PRO 162 2HD PRO 162 -2.497 2.309 2.309 615 2HD PRO 162 1HD PRO 162 -3.646 2.566 2.566 616 H THR 163 H THR 163 -1.646 3.954 3.954 617 HA THR 163 HA THR 163 -1.489 2.345 2.345 618 HB THR 163 HB THR 163 -3.222 4.670 4.670 619 HG1 THR 163 1HG THR 163 -2.844 2.791 2.791 620 1HG2 THR 163 3HG2 THR 163 -1.211 4.579 4.579 621 2HG2 THR 163 2HG2 THR 163 -2.702 5.619 5.619 622 3HG2 THR 163 1HG2 THR 163 -1.487 5.862 5.862 623 H LYS 164 H LYS 164 -0.578 5.218 5.218 624 HA LYS 164 HA LYS 164 1.282 5.942 5.942 625 1HB LYS 164 2HB LYS 164 1.800 7.795 7.795 626 2HB LYS 164 1HB LYS 164 0.192 7.778 7.778 627 1HG LYS 164 2HG LYS 164 -0.885 6.771 6.771 628 2HG LYS 164 1HG LYS 164 0.687 6.567 6.567 629 1HD LYS 164 2HD LYS 164 0.979 9.029 9.029 630 2HD LYS 164 1HD LYS 164 -0.523 9.263 9.263 631 1HE LYS 164 2HE LYS 164 -0.997 9.664 9.664 632 2HE LYS 164 1HE LYS 164 -1.863 8.167 8.167 633 1HZ LYS 164 1HZ LYS 164 -0.068 6.869 6.869 634 2HZ LYS 164 3HZ LYS 164 0.726 8.276 8.276 635 3HZ LYS 164 2HZ LYS 164 -0.789 7.868 7.868 636 H ILE 165 H ILE 165 2.885 4.274 4.274 637 HA ILE 165 HA ILE 165 4.497 3.980 3.980 638 HB ILE 165 HB ILE 165 5.202 3.146 3.146 639 1HG1 ILE 165 2HG1 ILE 165 3.132 1.981 1.981 640 2HG1 ILE 165 1HG1 ILE 165 2.936 2.307 2.307 641 1HG2 ILE 165 3HG2 ILE 165 6.937 2.984 2.984 642 2HG2 ILE 165 2HG2 ILE 165 5.741 2.091 2.091 643 3HG2 ILE 165 1HG2 ILE 165 6.420 1.334 1.334 644 1HD1 ILE 165 3HD1 ILE 165 4.747 0.062 0.062 645 2HD1 ILE 165 2HD1 ILE 165 3.012 -0.137 -0.137 646 3HD1 ILE 165 1HD1 ILE 165 4.192 0.320 0.320 647 H GLU 166 H GLU 166 6.204 4.959 4.959 648 HA GLU 166 HA GLU 166 7.080 7.158 7.158 649 1HB GLU 166 2HB GLU 166 6.703 7.231 7.231 650 2HB GLU 166 1HB GLU 166 7.538 8.511 8.511 651 1HG GLU 166 2HG GLU 166 5.417 9.002 9.002 652 2HG GLU 166 1HG GLU 166 4.568 7.692 7.692 653 H GLY 167 H GLY 167 9.016 6.293 6.293 654 1HA GLY 167 2HA GLY 167 11.160 5.521 5.521 655 2HA GLY 167 1HA GLY 167 10.874 5.505 5.505 656 H ARG 168 H ARG 168 11.481 3.607 3.607 657 HA ARG 168 HA ARG 168 10.515 1.319 1.319 658 1HB ARG 168 2HB ARG 168 12.632 1.417 1.417 659 2HB ARG 168 1HB ARG 168 12.200 -0.014 -0.014 660 1HG ARG 168 2HG ARG 168 13.019 1.273 1.273 661 2HG ARG 168 1HG ARG 168 13.547 2.596 2.596 662 1HD ARG 168 2HD ARG 168 15.474 1.097 1.097 663 2HD ARG 168 1HD ARG 168 15.061 0.962 0.962 664 HE ARG 168 HE ARG 168 13.617 -0.999 -0.999 665 1HH1 ARG 168 1HH2 ARG 168 16.752 -0.235 -0.235 666 2HH1 ARG 168 2HH2 ARG 168 17.211 -1.892 -1.892 667 1HH2 ARG 168 1HH1 ARG 168 14.252 -3.239 -3.239 668 2HH2 ARG 168 2HH1 ARG 168 15.773 -3.620 -3.620 669 H GLN 169 H GLN 169 8.544 2.572 2.572 670 HA GLN 169 HA GLN 169 8.065 0.880 0.880 671 1HB GLN 169 2HB GLN 169 9.073 3.704 3.704 672 2HB GLN 169 1HB GLN 169 8.012 3.011 3.011 673 1HG GLN 169 2HG GLN 169 9.876 1.304 1.304 674 2HG GLN 169 1HG GLN 169 10.936 2.275 2.275 675 1HE2 GLN 169 1HE2 GLN 169 9.498 4.846 4.846 676 2HE2 GLN 169 2HE2 GLN 169 10.156 5.222 5.222 677 H MET 170 H MET 170 5.846 1.128 1.128 678 HA MET 170 HA MET 170 4.519 3.337 3.337 679 1HB MET 170 2HB MET 170 3.711 1.159 1.159 680 2HB MET 170 1HB MET 170 3.254 0.582 0.582 681 1HG MET 170 2HG MET 170 1.485 2.153 2.153 682 2HG MET 170 1HG MET 170 2.110 3.155 3.155 683 1HE MET 170 1HE MET 170 1.172 -0.534 -0.534 684 2HE MET 170 3HE MET 170 0.000 -0.935 -0.935 685 3HE MET 170 2HE MET 170 1.759 -0.907 -0.907 686 H ILE 171 H ILE 171 3.802 4.885 4.885 687 HA ILE 171 HA ILE 171 3.042 4.053 4.053 688 HB ILE 171 HB ILE 171 2.576 6.658 6.658 689 1HG1 ILE 171 2HG1 ILE 171 4.997 5.804 5.804 690 2HG1 ILE 171 1HG1 ILE 171 4.524 7.483 7.483 691 1HG2 ILE 171 3HG2 ILE 171 2.062 5.626 5.626 692 2HG2 ILE 171 2HG2 ILE 171 2.266 7.417 7.417 693 3HG2 ILE 171 1HG2 ILE 171 0.883 6.563 6.563 694 1HD1 ILE 171 3HD1 ILE 171 4.409 4.928 4.928 695 2HD1 ILE 171 2HD1 ILE 171 5.708 6.176 6.176 696 3HD1 ILE 171 1HD1 ILE 171 4.004 6.540 6.540 697 H MET 172 H MET 172 1.141 3.294 3.294 698 HA MET 172 HA MET 172 -1.324 4.362 4.362 699 1HB MET 172 2HB MET 172 -1.619 1.986 1.986 700 2HB MET 172 1HB MET 172 -0.668 1.684 1.684 701 1HG MET 172 2HG MET 172 -2.475 2.355 2.355 702 2HG MET 172 1HG MET 172 -3.430 3.053 3.053 703 1HE MET 172 3HE MET 172 -4.176 1.196 1.196 704 2HE MET 172 2HE MET 172 -4.193 -0.570 -0.570 705 3HE MET 172 1HE MET 172 -2.636 0.264 0.264 706 H VAL 173 H VAL 173 -2.642 5.342 5.342 707 HA VAL 173 HA VAL 173 -0.987 6.018 6.018 708 HB VAL 173 HB VAL 173 -3.516 7.344 7.344 709 1HG1 VAL 173 1HG1 VAL 173 -1.188 7.849 7.849 710 2HG1 VAL 173 3HG1 VAL 173 -2.128 9.271 9.271 711 3HG1 VAL 173 2HG1 VAL 173 -2.950 8.011 8.011 712 1HG2 VAL 173 1HG2 VAL 173 -0.598 7.722 7.722 713 2HG2 VAL 173 3HG2 VAL 173 -2.058 7.497 7.497 714 3HG2 VAL 173 2HG2 VAL 173 -1.817 9.035 9.035 715 H LEU 174 H LEU 174 -2.109 5.920 5.920 716 HA LEU 174 HA LEU 174 -4.509 4.322 4.322 717 1HB LEU 174 2HB LEU 174 -1.987 3.273 3.273 718 2HB LEU 174 1HB LEU 174 -2.336 3.638 3.638 719 HG LEU 174 HG LEU 174 -3.308 1.462 1.462 720 1HD1 LEU 174 1HD1 LEU 174 -2.096 1.462 1.462 721 2HD1 LEU 174 3HD1 LEU 174 -3.827 1.631 1.631 722 3HD1 LEU 174 2HD1 LEU 174 -3.346 0.222 0.222 723 1HD2 LEU 174 3HD2 LEU 174 -5.174 3.031 3.031 724 2HD2 LEU 174 2HD2 LEU 174 -5.404 2.633 2.633 725 3HD2 LEU 174 1HD2 LEU 174 -5.482 1.302 1.302 726 H ALA 175 H ALA 175 -5.739 6.251 6.251 727 HA ALA 175 HA ALA 175 -4.935 7.575 7.575 728 1HB ALA 175 1HB ALA 175 -6.251 8.539 8.539 729 2HB ALA 175 3HB ALA 175 -7.629 7.456 7.456 730 3HB ALA 175 2HB ALA 175 -7.147 8.877 8.877 731 HA PRO 176 HA PRO 176 -7.946 5.788 5.788 732 1HB PRO 176 2HB PRO 176 -8.903 8.630 8.630 733 2HB PRO 176 1HB PRO 176 -8.520 7.364 7.364 734 1HG PRO 176 2HG PRO 176 -6.740 9.389 9.389 735 2HG PRO 176 1HG PRO 176 -6.144 7.681 7.681 736 1HD PRO 176 2HD PRO 176 -6.623 9.270 9.270 737 2HD PRO 176 1HD PRO 176 -5.243 8.173 8.173 738 H LYS 177 H LYS 177 -9.946 4.803 4.803 739 HA LYS 177 HA LYS 177 -11.483 6.160 6.160 740 1HB LYS 177 2HB LYS 177 -12.960 4.254 4.254 741 2HB LYS 177 1HB LYS 177 -11.243 3.715 3.715 742 1HG LYS 177 2HG LYS 177 -11.705 2.574 2.574 743 2HG LYS 177 1HG LYS 177 -12.117 4.035 4.035 744 1HD LYS 177 2HD LYS 177 -13.952 2.525 2.525 745 2HD LYS 177 1HD LYS 177 -14.527 3.734 3.734 746 1HE LYS 177 2HE LYS 177 -14.007 2.135 2.135 747 2HE LYS 177 1HE LYS 177 -13.289 0.987 0.987 748 1HZ LYS 177 3HZ LYS 177 -15.439 0.844 0.844 749 2HZ LYS 177 2HZ LYS 177 -16.117 1.910 1.910 750 3HZ LYS 177 1HZ LYS 177 -15.531 0.395 0.395 751 H LYS 178 H LYS 178 -13.832 6.564 6.564 752 HA LYS 178 HA LYS 178 -14.258 8.269 8.269 753 1HB LYS 178 2HB LYS 178 -15.186 8.705 8.705 754 2HB LYS 178 1HB LYS 178 -16.249 7.277 7.277 755 1HG LYS 178 2HG LYS 178 -17.355 8.444 8.444 756 2HG LYS 178 1HG LYS 178 -16.207 9.807 9.807 757 1HD LYS 178 2HD LYS 178 -18.341 10.435 10.435 758 2HD LYS 178 1HD LYS 178 -17.140 10.254 10.254 759 1HE LYS 178 2HE LYS 178 -19.374 9.309 9.309 760 2HE LYS 178 1HE LYS 178 -18.137 7.993 7.993 761 1HZ LYS 178 2HZ LYS 178 -20.076 8.682 8.682 762 2HZ LYS 178 1HZ LYS 178 -20.181 7.373 7.373 763 3HZ LYS 178 3HZ LYS 178 -18.920 7.440 7.440 764 H LYS 179 H LYS 179 -14.578 7.375 7.375 765 HA LYS 179 HA LYS 179 -15.264 4.706 4.706 766 1HB LYS 179 2HB LYS 179 -15.349 6.986 6.986 767 2HB LYS 179 1HB LYS 179 -15.307 5.230 5.230 768 1HG LYS 179 2HG LYS 179 -13.076 6.803 6.803 769 2HG LYS 179 1HG LYS 179 -13.118 6.441 6.441 770 1HD LYS 179 2HD LYS 179 -13.081 3.998 3.998 771 2HD LYS 179 1HD LYS 179 -12.999 4.328 4.328 772 1HE LYS 179 2HE LYS 179 -10.803 5.454 5.454 773 2HE LYS 179 1HE LYS 179 -10.912 5.301 5.301 774 1HZ LYS 179 2HZ LYS 179 -10.928 2.920 2.920 775 2HZ LYS 179 1HZ LYS 179 -10.820 3.053 3.053 776 3HZ LYS 179 3HZ LYS 179 -9.546 3.604 3.604 777 H GLN 180 H GLN 180 -17.225 3.908 3.908 778 HA GLN 180 HA GLN 180 -19.549 5.551 5.551 779 1HB GLN 180 2HB GLN 180 -19.393 4.255 4.255 780 2HB GLN 180 1HB GLN 180 -19.265 2.731 2.731 781 1HG GLN 180 2HG GLN 180 -21.585 3.021 3.021 782 2HG GLN 180 1HG GLN 180 -21.674 4.675 4.675 783 1HE2 GLN 180 1HE2 GLN 180 -20.628 1.343 1.343 784 2HE2 GLN 180 2HE2 GLN 180 -21.498 1.362 1.362
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