NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
9125 | 1nee | 5312 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 H MET 1 -6.917 -5.109 -18.475 2 HA MET 1 HA MET 1 -4.252 -6.130 -17.773 3 1HB MET 1 1HB MET 1 -4.859 -4.643 -19.857 4 2HB MET 1 2HB MET 1 -4.934 -3.356 -18.661 5 1HG MET 1 1HG MET 1 -2.687 -3.458 -18.205 6 2HG MET 1 2HG MET 1 -2.545 -5.131 -18.741 7 1HE MET 1 1HE MET 1 -0.901 -2.217 -19.366 8 2HE MET 1 2HE MET 1 -2.405 -1.373 -19.737 9 3HE MET 1 3HE MET 1 -1.194 -1.611 -20.997 10 H ASP 2 H ASP 2 -7.005 -5.153 -16.283 11 HA ASP 2 HA ASP 2 -5.581 -3.492 -14.316 12 1HB ASP 2 1HB ASP 2 -8.369 -3.516 -15.320 13 2HB ASP 2 2HB ASP 2 -8.165 -3.196 -13.600 14 H ASP 3 H ASP 3 -8.228 -5.889 -14.385 15 HA ASP 3 HA ASP 3 -7.814 -6.618 -11.652 16 1HB ASP 3 1HB ASP 3 -9.498 -7.773 -13.870 17 2HB ASP 3 2HB ASP 3 -9.412 -8.519 -12.277 18 H TYR 4 H TYR 4 -7.745 -8.770 -14.484 19 HA TYR 4 HA TYR 4 -6.036 -10.634 -13.185 20 1HB TYR 4 1HB TYR 4 -7.532 -10.479 -15.650 21 2HB TYR 4 2HB TYR 4 -5.922 -11.123 -15.953 22 HD1 TYR 4 HD1 TYR 4 -8.125 -11.552 -12.977 23 HD2 TYR 4 HD2 TYR 4 -6.235 -13.396 -16.312 24 HE1 TYR 4 HE1 TYR 4 -8.859 -13.754 -12.167 25 HE2 TYR 4 HE2 TYR 4 -6.963 -15.604 -15.513 26 HH TYR 4 HH TYR 4 -8.910 -15.946 -12.558 27 H GLU 5 H GLU 5 -4.419 -8.899 -12.619 28 HA GLU 5 HA GLU 5 -2.760 -7.695 -14.518 29 1HB GLU 5 1HB GLU 5 -2.452 -8.395 -11.625 30 2HB GLU 5 2HB GLU 5 -1.052 -7.822 -12.521 31 1HG GLU 5 1HG GLU 5 -3.661 -6.336 -12.349 32 2HG GLU 5 2HG GLU 5 -2.289 -6.058 -11.278 33 H LYS 6 H LYS 6 -0.480 -8.194 -14.962 34 HA LYS 6 HA LYS 6 -0.133 -11.083 -15.365 35 1HB LYS 6 1HB LYS 6 -0.020 -9.061 -17.195 36 2HB LYS 6 2HB LYS 6 1.679 -9.243 -16.782 37 1HG LYS 6 1HG LYS 6 -0.007 -11.607 -17.521 38 2HG LYS 6 2HG LYS 6 0.760 -10.595 -18.747 39 1HD LYS 6 1HD LYS 6 2.931 -10.976 -17.489 40 2HD LYS 6 2HD LYS 6 2.075 -12.231 -16.592 41 1HE LYS 6 1HE LYS 6 2.624 -13.635 -18.229 42 2HE LYS 6 2HE LYS 6 1.489 -12.759 -19.255 43 1HZ LYS 6 1HZ LYS 6 3.541 -12.808 -20.388 44 2HZ LYS 6 2HZ LYS 6 4.412 -12.334 -19.018 45 3HZ LYS 6 3HZ LYS 6 3.386 -11.233 -19.789 46 H LEU 7 H LEU 7 0.433 -10.581 -12.881 47 HA LEU 7 HA LEU 7 3.067 -9.628 -12.364 48 1HB LEU 7 1HB LEU 7 2.686 -10.763 -10.121 49 2HB LEU 7 2HB LEU 7 1.582 -9.475 -10.563 50 HG LEU 7 HG LEU 7 0.519 -11.996 -11.448 51 1HD1 LEU 7 1HD1 LEU 7 0.107 -12.537 -8.829 52 2HD1 LEU 7 2HD1 LEU 7 1.781 -11.980 -8.796 53 3HD1 LEU 7 3HD1 LEU 7 1.321 -13.332 -9.832 54 1HD2 LEU 7 1HD2 LEU 7 -0.915 -10.149 -11.159 55 2HD2 LEU 7 2HD2 LEU 7 -0.331 -9.851 -9.522 56 3HD2 LEU 7 3HD2 LEU 7 -1.320 -11.271 -9.861 57 H LEU 8 H LEU 8 4.820 -10.641 -13.096 58 HA LEU 8 HA LEU 8 4.830 -13.535 -13.394 59 1HB LEU 8 1HB LEU 8 6.687 -11.339 -14.255 60 2HB LEU 8 2HB LEU 8 7.194 -13.017 -14.307 61 HG LEU 8 HG LEU 8 4.647 -12.804 -15.594 62 1HD1 LEU 8 1HD1 LEU 8 6.059 -10.413 -15.853 63 2HD1 LEU 8 2HD1 LEU 8 4.707 -10.968 -16.838 64 3HD1 LEU 8 3HD1 LEU 8 6.362 -11.295 -17.351 65 1HD2 LEU 8 1HD2 LEU 8 5.639 -14.132 -17.135 66 2HD2 LEU 8 2HD2 LEU 8 6.842 -14.312 -15.858 67 3HD2 LEU 8 3HD2 LEU 8 7.118 -13.172 -17.175 68 H GLU 9 H GLU 9 5.553 -11.386 -10.953 69 HA GLU 9 HA GLU 9 6.639 -11.557 -8.967 70 1HB GLU 9 1HB GLU 9 5.463 -13.788 -8.998 71 2HB GLU 9 2HB GLU 9 6.953 -14.493 -9.609 72 1HG GLU 9 1HG GLU 9 7.911 -14.502 -7.595 73 2HG GLU 9 2HG GLU 9 7.330 -12.884 -7.206 74 H ARG 10 H ARG 10 8.141 -10.920 -11.334 75 HA ARG 10 HA ARG 10 10.713 -12.228 -11.046 76 1HB ARG 10 1HB ARG 10 9.419 -10.487 -13.013 77 2HB ARG 10 2HB ARG 10 11.108 -10.088 -12.739 78 1HG ARG 10 1HG ARG 10 10.615 -12.948 -13.080 79 2HG ARG 10 2HG ARG 10 10.184 -11.968 -14.483 80 1HD ARG 10 1HD ARG 10 12.377 -11.096 -14.666 81 2HD ARG 10 2HD ARG 10 12.832 -11.712 -13.078 82 HE ARG 10 HE ARG 10 12.961 -13.115 -15.538 83 1HH1 ARG 10 1HH1 ARG 10 12.280 -13.553 -12.143 84 2HH1 ARG 10 2HH1 ARG 10 12.692 -15.234 -12.149 85 1HH2 ARG 10 1HH2 ARG 10 13.508 -15.330 -15.543 86 2HH2 ARG 10 2HH2 ARG 10 13.386 -16.241 -14.075 87 H ALA 11 H ALA 11 11.663 -11.667 -9.147 88 HA ALA 11 HA ALA 11 12.818 -10.423 -7.635 89 1HB ALA 11 1HB ALA 11 13.054 -8.028 -9.304 90 2HB ALA 11 2HB ALA 11 13.580 -9.522 -10.078 91 3HB ALA 11 3HB ALA 11 14.304 -9.019 -8.550 92 H ILE 12 H ILE 12 9.890 -10.172 -7.728 93 HA ILE 12 HA ILE 12 9.601 -7.462 -6.611 94 HB ILE 12 HB ILE 12 7.359 -9.266 -7.533 95 1HG1 ILE 12 1HG1 ILE 12 8.045 -6.844 -9.085 96 2HG1 ILE 12 2HG1 ILE 12 9.183 -8.181 -9.221 97 1HG2 ILE 12 1HG2 ILE 12 7.477 -6.365 -6.732 98 2HG2 ILE 12 2HG2 ILE 12 6.562 -7.660 -5.961 99 3HG2 ILE 12 3HG2 ILE 12 6.104 -7.092 -7.564 100 1HD1 ILE 12 1HD1 ILE 12 7.362 -8.083 -10.950 101 2HD1 ILE 12 2HD1 ILE 12 6.230 -8.499 -9.662 102 3HD1 ILE 12 3HD1 ILE 12 7.526 -9.617 -10.092 103 H ASP 13 H ASP 13 10.605 -10.022 -5.314 104 HA ASP 13 HA ASP 13 9.140 -9.666 -2.869 105 1HB ASP 13 1HB ASP 13 8.070 -11.522 -4.525 106 2HB ASP 13 2HB ASP 13 9.182 -12.531 -3.610 107 H GLN 14 H GLN 14 10.785 -12.721 -3.500 108 HA GLN 14 HA GLN 14 12.858 -11.869 -1.625 109 1HB GLN 14 1HB GLN 14 11.429 -14.162 -1.681 110 2HB GLN 14 2HB GLN 14 12.843 -14.658 -2.601 111 1HG GLN 14 1HG GLN 14 13.196 -13.260 0.009 112 2HG GLN 14 2HG GLN 14 12.782 -14.974 -0.024 113 1HE2 GLN 14 1HE2 GLN 14 15.275 -12.984 0.316 114 2HE2 GLN 14 2HE2 GLN 14 16.547 -13.931 -0.370 115 H LEU 15 H LEU 15 12.390 -12.696 -4.950 116 HA LEU 15 HA LEU 15 15.020 -13.351 -5.669 117 1HB LEU 15 1HB LEU 15 12.545 -12.822 -6.995 118 2HB LEU 15 2HB LEU 15 13.804 -11.899 -7.789 119 HG LEU 15 HG LEU 15 14.957 -14.390 -7.526 120 1HD1 LEU 15 1HD1 LEU 15 12.058 -14.680 -7.502 121 2HD1 LEU 15 2HD1 LEU 15 13.321 -15.864 -7.168 122 3HD1 LEU 15 3HD1 LEU 15 12.833 -15.542 -8.831 123 1HD2 LEU 15 1HD2 LEU 15 15.080 -14.302 -9.800 124 2HD2 LEU 15 2HD2 LEU 15 14.641 -12.626 -9.472 125 3HD2 LEU 15 3HD2 LEU 15 13.406 -13.776 -9.984 126 HA PRO 16 HA PRO 16 16.903 -9.354 -4.723 127 1HB PRO 16 1HB PRO 16 19.225 -9.937 -6.167 128 2HB PRO 16 2HB PRO 16 18.973 -10.247 -4.448 129 1HG PRO 16 1HG PRO 16 18.732 -12.105 -6.767 130 2HG PRO 16 2HG PRO 16 19.331 -12.422 -5.129 131 1HD PRO 16 1HD PRO 16 16.899 -13.233 -5.903 132 2HD PRO 16 2HD PRO 16 17.188 -12.635 -4.254 133 HA PRO 17 HA PRO 17 16.144 -6.977 -8.360 134 1HB PRO 17 1HB PRO 17 18.106 -5.078 -8.236 135 2HB PRO 17 2HB PRO 17 16.654 -5.064 -7.231 136 1HG PRO 17 1HG PRO 17 19.414 -5.999 -6.559 137 2HG PRO 17 2HG PRO 17 18.278 -5.063 -5.572 138 1HD PRO 17 1HD PRO 17 18.651 -7.708 -5.210 139 2HD PRO 17 2HD PRO 17 17.071 -6.934 -4.959 140 H GLU 18 H GLU 18 18.193 -9.278 -8.529 141 HA GLU 18 HA GLU 18 20.290 -8.637 -10.228 142 1HB GLU 18 1HB GLU 18 19.060 -10.988 -9.224 143 2HB GLU 18 2HB GLU 18 19.194 -11.183 -10.965 144 1HG GLU 18 1HG GLU 18 21.500 -11.087 -10.933 145 2HG GLU 18 2HG GLU 18 21.547 -10.257 -9.378 146 H VAL 19 H VAL 19 17.041 -9.811 -11.093 147 HA VAL 19 HA VAL 19 17.473 -9.323 -13.894 148 HB VAL 19 HB VAL 19 14.824 -9.885 -12.571 149 1HG1 VAL 19 1HG1 VAL 19 14.401 -9.349 -14.779 150 2HG1 VAL 19 2HG1 VAL 19 14.578 -11.102 -14.853 151 3HG1 VAL 19 3HG1 VAL 19 15.911 -10.059 -15.349 152 1HG2 VAL 19 1HG2 VAL 19 16.957 -11.841 -13.420 153 2HG2 VAL 19 2HG2 VAL 19 15.296 -12.282 -13.025 154 3HG2 VAL 19 3HG2 VAL 19 16.341 -11.582 -11.788 155 H PHE 20 H PHE 20 17.099 -7.512 -14.972 156 HA PHE 20 HA PHE 20 16.099 -5.189 -13.602 157 1HB PHE 20 1HB PHE 20 16.456 -4.122 -15.907 158 2HB PHE 20 2HB PHE 20 17.881 -4.736 -15.074 159 HD1 PHE 20 HD1 PHE 20 19.166 -6.513 -15.975 160 HD2 PHE 20 HD2 PHE 20 15.490 -5.386 -17.799 161 HE1 PHE 20 HE1 PHE 20 19.719 -7.894 -17.935 162 HE2 PHE 20 HE2 PHE 20 16.036 -6.766 -19.762 163 HZ PHE 20 HZ PHE 20 18.153 -8.023 -19.831 164 H GLU 21 H GLU 21 14.126 -4.313 -13.709 165 HA GLU 21 HA GLU 21 12.325 -4.496 -15.835 166 1HB GLU 21 1HB GLU 21 12.448 -6.925 -14.623 167 2HB GLU 21 2HB GLU 21 11.164 -6.166 -13.692 168 1HG GLU 21 1HG GLU 21 9.946 -5.705 -15.770 169 2HG GLU 21 2HG GLU 21 11.223 -6.507 -16.683 170 H THR 22 H THR 22 10.045 -3.858 -15.121 171 HA THR 22 HA THR 22 10.309 -1.819 -13.037 172 HB THR 22 HB THR 22 8.130 -2.191 -15.102 173 HG1 THR 22 HG1 THR 22 10.170 -1.669 -16.015 174 1HG2 THR 22 1HG2 THR 22 8.130 0.438 -14.506 175 2HG2 THR 22 2HG2 THR 22 8.505 -0.259 -12.930 176 3HG2 THR 22 3HG2 THR 22 7.042 -0.747 -13.786 177 H LYS 23 H LYS 23 9.374 -2.059 -11.102 178 HA LYS 23 HA LYS 23 7.669 -4.369 -10.649 179 1HB LYS 23 1HB LYS 23 8.391 -2.401 -8.514 180 2HB LYS 23 2HB LYS 23 8.097 -4.126 -8.375 181 1HG LYS 23 1HG LYS 23 10.222 -4.684 -9.053 182 2HG LYS 23 2HG LYS 23 10.462 -3.166 -9.921 183 1HD LYS 23 1HD LYS 23 10.291 -2.092 -7.559 184 2HD LYS 23 2HD LYS 23 10.650 -3.722 -6.986 185 1HE LYS 23 1HE LYS 23 12.445 -3.024 -9.110 186 2HE LYS 23 2HE LYS 23 12.459 -1.758 -7.882 187 1HZ LYS 23 1HZ LYS 23 13.000 -3.358 -6.214 188 2HZ LYS 23 2HZ LYS 23 14.091 -3.555 -7.491 189 3HZ LYS 23 3HZ LYS 23 12.815 -4.646 -7.295 190 H ARG 24 H ARG 24 5.635 -4.020 -11.317 191 HA ARG 24 HA ARG 24 4.305 -1.495 -10.708 192 1HB ARG 24 1HB ARG 24 3.160 -3.861 -12.189 193 2HB ARG 24 2HB ARG 24 2.570 -2.205 -12.195 194 1HG ARG 24 1HG ARG 24 3.760 -1.843 -14.023 195 2HG ARG 24 2HG ARG 24 5.226 -2.063 -13.066 196 1HD ARG 24 1HD ARG 24 5.636 -3.729 -14.522 197 2HD ARG 24 2HD ARG 24 4.522 -4.636 -13.504 198 HE ARG 24 HE ARG 24 2.808 -4.271 -15.112 199 1HH1 ARG 24 1HH1 ARG 24 5.961 -3.179 -16.169 200 2HH1 ARG 24 2HH1 ARG 24 5.532 -3.188 -17.844 201 1HH2 ARG 24 1HH2 ARG 24 2.256 -4.275 -17.313 202 2HH2 ARG 24 2HH2 ARG 24 3.433 -3.807 -18.494 203 H PHE 25 H PHE 25 3.883 -1.546 -8.529 204 HA PHE 25 HA PHE 25 2.510 -3.855 -7.390 205 1HB PHE 25 1HB PHE 25 4.388 -2.082 -6.388 206 2HB PHE 25 2HB PHE 25 2.893 -1.556 -5.627 207 HD1 PHE 25 HD1 PHE 25 5.653 -3.533 -5.160 208 HD2 PHE 25 HD2 PHE 25 1.415 -3.695 -4.810 209 HE1 PHE 25 HE1 PHE 25 5.863 -5.341 -3.503 210 HE2 PHE 25 HE2 PHE 25 1.617 -5.503 -3.153 211 HZ PHE 25 HZ PHE 25 3.843 -6.328 -2.498 212 H GLU 26 H GLU 26 0.513 -3.540 -8.597 213 HA GLU 26 HA GLU 26 -1.287 -1.727 -7.197 214 1HB GLU 26 1HB GLU 26 -0.491 -0.443 -9.140 215 2HB GLU 26 2HB GLU 26 -1.026 -1.727 -10.211 216 1HG GLU 26 1HG GLU 26 -3.351 -1.338 -9.315 217 2HG GLU 26 2HG GLU 26 -2.710 0.108 -8.541 218 H VAL 27 H VAL 27 -3.051 -2.797 -6.632 219 HA VAL 27 HA VAL 27 -4.261 -4.813 -8.371 220 HB VAL 27 HB VAL 27 -3.427 -5.414 -5.527 221 1HG1 VAL 27 1HG1 VAL 27 -4.209 -7.799 -6.533 222 2HG1 VAL 27 2HG1 VAL 27 -5.347 -6.711 -7.325 223 3HG1 VAL 27 3HG1 VAL 27 -5.234 -6.739 -5.565 224 1HG2 VAL 27 1HG2 VAL 27 -1.516 -6.171 -6.343 225 2HG2 VAL 27 2HG2 VAL 27 -2.033 -5.816 -7.992 226 3HG2 VAL 27 3HG2 VAL 27 -2.421 -7.374 -7.264 227 HA PRO 28 HA PRO 28 -7.952 -2.717 -6.963 228 1HB PRO 28 1HB PRO 28 -9.121 -5.455 -7.188 229 2HB PRO 28 2HB PRO 28 -9.720 -3.919 -7.824 230 1HG PRO 28 1HG PRO 28 -8.531 -5.680 -9.429 231 2HG PRO 28 2HG PRO 28 -8.257 -3.938 -9.624 232 1HD PRO 28 1HD PRO 28 -6.465 -6.024 -8.486 233 2HD PRO 28 2HD PRO 28 -6.055 -4.551 -9.386 234 H LYS 29 H LYS 29 -9.624 -2.930 -5.260 235 HA LYS 29 HA LYS 29 -10.149 -3.072 -3.056 236 1HB LYS 29 1HB LYS 29 -10.821 -5.296 -3.465 237 2HB LYS 29 2HB LYS 29 -9.164 -5.862 -3.613 238 1HG LYS 29 1HG LYS 29 -10.069 -6.643 -1.539 239 2HG LYS 29 2HG LYS 29 -8.846 -5.421 -1.193 240 1HD LYS 29 1HD LYS 29 -10.374 -3.914 -0.417 241 2HD LYS 29 2HD LYS 29 -11.660 -4.511 -1.467 242 1HE LYS 29 1HE LYS 29 -12.345 -6.057 0.034 243 2HE LYS 29 2HE LYS 29 -10.707 -6.393 0.593 244 1HZ LYS 29 1HZ LYS 29 -11.479 -5.327 2.412 245 2HZ LYS 29 2HZ LYS 29 -12.635 -4.432 1.559 246 3HZ LYS 29 3HZ LYS 29 -11.011 -3.950 1.544 247 H ALA 30 H ALA 30 -8.989 -1.739 -1.826 248 HA ALA 30 HA ALA 30 -6.716 -2.787 -0.411 249 1HB ALA 30 1HB ALA 30 -5.199 -2.034 -1.863 250 2HB ALA 30 2HB ALA 30 -5.557 -0.447 -1.182 251 3HB ALA 30 3HB ALA 30 -6.352 -0.970 -2.668 252 H TYR 31 H TYR 31 -8.717 -2.350 0.970 253 HA TYR 31 HA TYR 31 -8.213 0.103 2.425 254 1HB TYR 31 1HB TYR 31 -10.788 0.395 2.613 255 2HB TYR 31 2HB TYR 31 -9.963 0.992 1.179 256 HD1 TYR 31 HD1 TYR 31 -10.037 -0.402 -0.926 257 HD2 TYR 31 HD2 TYR 31 -12.515 -1.201 2.437 258 HE1 TYR 31 HE1 TYR 31 -11.548 -1.710 -2.360 259 HE2 TYR 31 HE2 TYR 31 -14.033 -2.513 1.015 260 HH TYR 31 HH TYR 31 -14.039 -3.694 -1.081 261 H SER 32 H SER 32 -9.013 0.026 4.610 262 HA SER 32 HA SER 32 -9.134 -2.709 5.579 263 1HB SER 32 1HB SER 32 -8.682 -1.825 7.756 264 2HB SER 32 2HB SER 32 -7.634 -0.970 6.625 265 HG SER 32 HG SER 32 -10.114 -0.004 7.617 266 H VAL 33 H VAL 33 -10.596 -2.426 7.915 267 HA VAL 33 HA VAL 33 -13.283 -1.725 6.932 268 HB VAL 33 HB VAL 33 -13.282 -3.934 8.841 269 1HG1 VAL 33 1HG1 VAL 33 -14.467 -3.600 6.089 270 2HG1 VAL 33 2HG1 VAL 33 -15.251 -3.184 7.613 271 3HG1 VAL 33 3HG1 VAL 33 -14.874 -4.867 7.245 272 1HG2 VAL 33 1HG2 VAL 33 -11.194 -4.457 7.595 273 2HG2 VAL 33 2HG2 VAL 33 -12.140 -4.492 6.107 274 3HG2 VAL 33 3HG2 VAL 33 -12.466 -5.661 7.386 275 H ILE 34 H ILE 34 -14.570 -0.624 8.302 276 HA ILE 34 HA ILE 34 -13.430 0.249 10.805 277 HB ILE 34 HB ILE 34 -15.798 1.433 10.885 278 1HG1 ILE 34 1HG1 ILE 34 -15.397 1.265 7.911 279 2HG1 ILE 34 2HG1 ILE 34 -16.489 0.176 8.761 280 1HG2 ILE 34 1HG2 ILE 34 -13.276 2.208 10.391 281 2HG2 ILE 34 2HG2 ILE 34 -14.660 3.305 10.431 282 3HG2 ILE 34 3HG2 ILE 34 -14.063 2.692 8.886 283 1HD1 ILE 34 1HD1 ILE 34 -18.056 1.752 9.003 284 2HD1 ILE 34 2HD1 ILE 34 -17.187 2.580 7.710 285 3HD1 ILE 34 3HD1 ILE 34 -16.878 3.004 9.394 286 H GLN 35 H GLN 35 -13.647 -0.948 12.551 287 HA GLN 35 HA GLN 35 -16.241 -2.246 13.041 288 1HB GLN 35 1HB GLN 35 -14.487 -3.907 12.476 289 2HB GLN 35 2HB GLN 35 -13.527 -3.325 13.831 290 1HG GLN 35 1HG GLN 35 -14.601 -5.287 14.565 291 2HG GLN 35 2HG GLN 35 -15.454 -3.943 15.321 292 1HE2 GLN 35 1HE2 GLN 35 -17.527 -3.384 14.559 293 2HE2 GLN 35 2HE2 GLN 35 -18.491 -4.511 13.673 294 H GLY 36 H GLY 36 -16.988 -0.559 14.298 295 1HA GLY 36 1HA GLY 36 -17.390 0.472 16.315 296 2HA GLY 36 2HA GLY 36 -16.215 -0.617 17.038 297 H ASN 37 H ASN 37 -13.898 -0.084 16.619 298 HA ASN 37 HA ASN 37 -13.286 2.655 15.948 299 1HB ASN 37 1HB ASN 37 -13.840 2.007 18.648 300 2HB ASN 37 2HB ASN 37 -12.096 2.220 18.529 301 1HD2 ASN 37 1HD2 ASN 37 -14.734 3.809 16.784 302 2HD2 ASN 37 2HD2 ASN 37 -14.340 5.410 17.298 303 H ARG 38 H ARG 38 -12.564 -0.052 15.066 304 HA ARG 38 HA ARG 38 -9.658 0.281 15.228 305 1HB ARG 38 1HB ARG 38 -10.008 -2.494 15.202 306 2HB ARG 38 2HB ARG 38 -9.397 -1.520 16.525 307 1HG ARG 38 1HG ARG 38 -11.936 -1.225 17.090 308 2HG ARG 38 2HG ARG 38 -12.104 -2.693 16.126 309 1HD ARG 38 1HD ARG 38 -10.047 -3.417 17.682 310 2HD ARG 38 2HD ARG 38 -10.843 -2.280 18.770 311 HE ARG 38 HE ARG 38 -11.733 -4.891 18.092 312 1HH1 ARG 38 1HH1 ARG 38 -12.868 -1.685 18.875 313 2HH1 ARG 38 2HH1 ARG 38 -14.397 -2.236 19.472 314 1HH2 ARG 38 1HH2 ARG 38 -13.748 -5.617 18.874 315 2HH2 ARG 38 2HH2 ARG 38 -14.897 -4.467 19.471 316 H THR 39 H THR 39 -8.497 -0.775 13.544 317 HA THR 39 HA THR 39 -10.125 -1.174 11.134 318 HB THR 39 HB THR 39 -7.884 0.478 11.627 319 HG1 THR 39 HG1 THR 39 -9.015 -0.235 9.140 320 1HG2 THR 39 1HG2 THR 39 -7.150 -1.240 9.311 321 2HG2 THR 39 2HG2 THR 39 -6.593 -1.695 10.921 322 3HG2 THR 39 3HG2 THR 39 -6.161 -0.123 10.255 323 H PHE 40 H PHE 40 -10.290 -3.181 10.383 324 HA PHE 40 HA PHE 40 -8.464 -5.218 11.412 325 1HB PHE 40 1HB PHE 40 -11.147 -5.375 10.044 326 2HB PHE 40 2HB PHE 40 -10.145 -6.796 10.314 327 HD1 PHE 40 HD1 PHE 40 -10.983 -3.840 12.439 328 HD2 PHE 40 HD2 PHE 40 -11.031 -8.069 11.976 329 HE1 PHE 40 HE1 PHE 40 -11.893 -4.073 14.711 330 HE2 PHE 40 HE2 PHE 40 -11.942 -8.312 14.247 331 HZ PHE 40 HZ PHE 40 -12.374 -6.312 15.619 332 H ILE 41 H ILE 41 -6.735 -4.346 10.017 333 HA ILE 41 HA ILE 41 -6.905 -4.461 7.211 334 HB ILE 41 HB ILE 41 -4.850 -3.929 9.179 335 1HG1 ILE 41 1HG1 ILE 41 -4.591 -3.149 6.334 336 2HG1 ILE 41 2HG1 ILE 41 -6.018 -2.580 7.203 337 1HG2 ILE 41 1HG2 ILE 41 -3.959 -6.075 8.087 338 2HG2 ILE 41 2HG2 ILE 41 -2.907 -4.660 8.136 339 3HG2 ILE 41 3HG2 ILE 41 -3.753 -5.081 6.643 340 1HD1 ILE 41 1HD1 ILE 41 -4.813 -0.946 8.072 341 2HD1 ILE 41 2HD1 ILE 41 -3.374 -1.555 7.254 342 3HD1 ILE 41 3HD1 ILE 41 -3.783 -2.137 8.867 343 H GLN 42 H GLN 42 -6.770 -6.087 5.807 344 HA GLN 42 HA GLN 42 -6.091 -8.760 6.844 345 1HB GLN 42 1HB GLN 42 -8.226 -7.781 5.085 346 2HB GLN 42 2HB GLN 42 -7.396 -9.201 4.462 347 1HG GLN 42 1HG GLN 42 -8.837 -10.352 5.708 348 2HG GLN 42 2HG GLN 42 -7.803 -9.897 7.062 349 1HE2 GLN 42 1HE2 GLN 42 -10.531 -8.679 5.158 350 2HE2 GLN 42 2HE2 GLN 42 -11.363 -7.957 6.489 351 H ASN 43 H ASN 43 -5.608 -6.474 4.220 352 HA ASN 43 HA ASN 43 -3.529 -8.232 3.107 353 1HB ASN 43 1HB ASN 43 -4.651 -5.835 1.683 354 2HB ASN 43 2HB ASN 43 -3.857 -7.249 1.000 355 1HD2 ASN 43 1HD2 ASN 43 -6.432 -6.039 0.352 356 2HD2 ASN 43 2HD2 ASN 43 -7.612 -7.283 0.567 357 H PHE 44 H PHE 44 -2.825 -6.903 5.396 358 HA PHE 44 HA PHE 44 -1.803 -4.382 5.340 359 1HB PHE 44 1HB PHE 44 0.090 -5.312 6.802 360 2HB PHE 44 2HB PHE 44 -1.552 -5.577 7.364 361 HD1 PHE 44 HD1 PHE 44 -2.097 -7.672 8.127 362 HD2 PHE 44 HD2 PHE 44 1.029 -7.275 5.266 363 HE1 PHE 44 HE1 PHE 44 -1.656 -10.086 8.282 364 HE2 PHE 44 HE2 PHE 44 1.473 -9.689 5.411 365 HZ PHE 44 HZ PHE 44 0.131 -11.099 6.922 366 H ARG 45 H ARG 45 -0.589 -7.148 3.614 367 HA ARG 45 HA ARG 45 1.975 -6.053 3.024 368 1HB ARG 45 1HB ARG 45 1.490 -8.470 2.984 369 2HB ARG 45 2HB ARG 45 0.455 -8.224 1.583 370 1HG ARG 45 1HG ARG 45 2.368 -8.863 0.542 371 2HG ARG 45 2HG ARG 45 2.638 -7.119 0.603 372 1HD ARG 45 1HD ARG 45 4.648 -8.115 1.344 373 2HD ARG 45 2HD ARG 45 3.836 -7.512 2.789 374 HE ARG 45 HE ARG 45 3.431 -10.308 2.054 375 1HH1 ARG 45 1HH1 ARG 45 4.959 -7.980 4.167 376 2HH1 ARG 45 2HH1 ARG 45 5.319 -9.149 5.390 377 1HH2 ARG 45 1HH2 ARG 45 3.906 -11.835 3.663 378 2HH2 ARG 45 2HH2 ARG 45 4.723 -11.335 5.106 379 H GLU 46 H GLU 46 -0.967 -6.446 1.085 380 HA GLU 46 HA GLU 46 0.097 -4.925 -1.111 381 1HB GLU 46 1HB GLU 46 -1.607 -6.829 -1.229 382 2HB GLU 46 2HB GLU 46 -2.785 -5.638 -0.704 383 1HG GLU 46 1HG GLU 46 -2.384 -4.303 -2.663 384 2HG GLU 46 2HG GLU 46 -1.082 -5.381 -3.167 385 H VAL 47 H VAL 47 -2.319 -4.398 1.415 386 HA VAL 47 HA VAL 47 -3.144 -1.845 0.598 387 HB VAL 47 HB VAL 47 -3.030 -2.901 3.426 388 1HG1 VAL 47 1HG1 VAL 47 -4.857 -1.334 3.857 389 2HG1 VAL 47 2HG1 VAL 47 -4.746 -0.743 2.199 390 3HG1 VAL 47 3HG1 VAL 47 -3.405 -0.491 3.317 391 1HG2 VAL 47 1HG2 VAL 47 -5.625 -2.991 2.185 392 2HG2 VAL 47 2HG2 VAL 47 -4.704 -4.280 2.959 393 3HG2 VAL 47 3HG2 VAL 47 -4.453 -3.920 1.251 394 H ALA 48 H ALA 48 -0.451 -2.922 2.609 395 HA ALA 48 HA ALA 48 0.278 -0.340 3.491 396 1HB ALA 48 1HB ALA 48 2.417 -1.354 4.144 397 2HB ALA 48 2HB ALA 48 1.949 -2.835 3.309 398 3HB ALA 48 3HB ALA 48 1.027 -2.279 4.708 399 H ASP 49 H ASP 49 1.590 -2.411 0.917 400 HA ASP 49 HA ASP 49 3.590 -0.757 -0.013 401 1HB ASP 49 1HB ASP 49 2.785 -3.115 -0.821 402 2HB ASP 49 2HB ASP 49 1.842 -2.192 -1.987 403 H ALA 50 H ALA 50 0.370 -0.881 -1.594 404 HA ALA 50 HA ALA 50 0.684 1.394 -3.113 405 1HB ALA 50 1HB ALA 50 -1.496 1.160 -3.710 406 2HB ALA 50 2HB ALA 50 -2.033 0.813 -2.067 407 3HB ALA 50 3HB ALA 50 -1.208 -0.429 -3.003 408 H LEU 51 H LEU 51 -0.679 1.239 0.196 409 HA LEU 51 HA LEU 51 -1.327 3.984 0.341 410 1HB LEU 51 1HB LEU 51 -2.406 2.776 1.993 411 2HB LEU 51 2HB LEU 51 -1.010 1.766 2.311 412 HG LEU 51 HG LEU 51 0.066 3.623 3.493 413 1HD1 LEU 51 1HD1 LEU 51 -0.723 5.725 3.573 414 2HD1 LEU 51 2HD1 LEU 51 -2.409 5.209 3.565 415 3HD1 LEU 51 3HD1 LEU 51 -1.486 5.232 2.064 416 1HD2 LEU 51 1HD2 LEU 51 -1.420 3.703 5.464 417 2HD2 LEU 51 2HD2 LEU 51 -1.249 2.067 4.820 418 3HD2 LEU 51 3HD2 LEU 51 -2.714 2.993 4.495 419 H ASN 52 H ASN 52 1.601 2.199 0.719 420 HA ASN 52 HA ASN 52 3.269 4.454 0.616 421 1HB ASN 52 1HB ASN 52 2.211 4.326 3.076 422 2HB ASN 52 2HB ASN 52 3.549 3.205 3.301 423 1HD2 ASN 52 1HD2 ASN 52 2.888 5.991 4.261 424 2HD2 ASN 52 2HD2 ASN 52 4.332 6.889 3.960 425 H ARG 53 H ARG 53 4.636 3.423 -0.732 426 HA ARG 53 HA ARG 53 5.285 0.801 -0.963 427 1HB ARG 53 1HB ARG 53 6.279 3.211 -1.974 428 2HB ARG 53 2HB ARG 53 7.681 2.399 -1.294 429 1HG ARG 53 1HG ARG 53 6.168 0.495 -2.767 430 2HG ARG 53 2HG ARG 53 6.397 1.930 -3.768 431 1HD ARG 53 1HD ARG 53 8.542 0.313 -2.397 432 2HD ARG 53 2HD ARG 53 8.225 0.397 -4.130 433 HE ARG 53 HE ARG 53 8.761 2.968 -3.026 434 1HH1 ARG 53 1HH1 ARG 53 10.295 0.026 -4.111 435 2HH1 ARG 53 2HH1 ARG 53 11.791 0.804 -4.503 436 1HH2 ARG 53 1HH2 ARG 53 10.725 3.989 -3.537 437 2HH2 ARG 53 2HH2 ARG 53 12.036 3.056 -4.178 438 H ASP 54 H ASP 54 6.925 3.143 1.140 439 HA ASP 54 HA ASP 54 8.641 1.139 2.288 440 1HB ASP 54 1HB ASP 54 8.332 4.053 2.445 441 2HB ASP 54 2HB ASP 54 8.776 3.308 3.977 442 HA PRO 55 HA PRO 55 5.552 -0.120 5.265 443 1HB PRO 55 1HB PRO 55 7.098 -1.828 6.685 444 2HB PRO 55 2HB PRO 55 6.453 -2.232 5.089 445 1HG PRO 55 1HG PRO 55 9.186 -1.268 5.840 446 2HG PRO 55 2HG PRO 55 8.723 -2.542 4.696 447 1HD PRO 55 1HD PRO 55 9.419 -0.033 3.916 448 2HD PRO 55 2HD PRO 55 8.266 -1.039 3.016 449 H GLN 56 H GLN 56 8.763 1.042 6.140 450 HA GLN 56 HA GLN 56 8.348 1.393 8.891 451 1HB GLN 56 1HB GLN 56 10.076 3.214 7.240 452 2HB GLN 56 2HB GLN 56 10.323 2.665 8.890 453 1HG GLN 56 1HG GLN 56 10.367 0.309 7.574 454 2HG GLN 56 2HG GLN 56 11.030 1.387 6.346 455 1HE2 GLN 56 1HE2 GLN 56 12.159 -0.769 8.162 456 2HE2 GLN 56 2HE2 GLN 56 13.561 -0.035 8.854 457 H HIS 57 H HIS 57 7.682 3.491 6.144 458 HA HIS 57 HA HIS 57 6.925 5.747 7.731 459 1HB HIS 57 1HB HIS 57 7.403 5.302 5.016 460 2HB HIS 57 2HB HIS 57 5.691 5.709 5.099 461 HD2 HIS 57 HD2 HIS 57 5.547 8.164 7.054 462 HE1 HIS 57 HE1 HIS 57 8.857 9.784 4.948 463 HE2 HIS 57 HE2 HIS 57 7.029 10.241 6.621 464 H LEU 58 H LEU 58 5.003 3.564 5.696 465 HA LEU 58 HA LEU 58 2.468 4.297 6.324 466 1HB LEU 58 1HB LEU 58 3.387 2.336 4.893 467 2HB LEU 58 2HB LEU 58 3.206 1.397 6.358 468 HG LEU 58 HG LEU 58 0.801 2.910 5.670 469 1HD1 LEU 58 1HD1 LEU 58 0.189 1.482 3.777 470 2HD1 LEU 58 2HD1 LEU 58 1.808 0.779 3.800 471 3HD1 LEU 58 3HD1 LEU 58 1.592 2.482 3.412 472 1HD2 LEU 58 1HD2 LEU 58 0.065 1.308 7.036 473 2HD2 LEU 58 2HD2 LEU 58 1.585 0.423 6.909 474 3HD2 LEU 58 3HD2 LEU 58 0.309 0.157 5.722 475 H LEU 59 H LEU 59 4.538 2.144 8.212 476 HA LEU 59 HA LEU 59 2.644 1.592 10.212 477 1HB LEU 59 1HB LEU 59 5.647 1.441 10.270 478 2HB LEU 59 2HB LEU 59 4.601 0.792 11.520 479 HG LEU 59 HG LEU 59 4.568 -0.103 8.635 480 1HD1 LEU 59 1HD1 LEU 59 6.110 -1.019 10.996 481 2HD1 LEU 59 2HD1 LEU 59 6.558 -0.987 9.290 482 3HD1 LEU 59 3HD1 LEU 59 5.473 -2.239 9.894 483 1HD2 LEU 59 1HD2 LEU 59 2.497 -0.318 10.219 484 2HD2 LEU 59 2HD2 LEU 59 3.422 -1.652 10.904 485 3HD2 LEU 59 3HD2 LEU 59 2.990 -1.663 9.194 486 H LYS 60 H LYS 60 5.222 4.018 10.023 487 HA LYS 60 HA LYS 60 4.888 5.032 12.631 488 1HB LYS 60 1HB LYS 60 6.389 5.716 10.276 489 2HB LYS 60 2HB LYS 60 5.666 7.170 10.952 490 1HG LYS 60 1HG LYS 60 7.508 7.201 12.223 491 2HG LYS 60 2HG LYS 60 6.634 6.011 13.190 492 1HD LYS 60 1HD LYS 60 8.435 4.714 12.874 493 2HD LYS 60 2HD LYS 60 7.773 4.448 11.259 494 1HE LYS 60 1HE LYS 60 9.350 5.715 10.263 495 2HE LYS 60 2HE LYS 60 9.380 6.892 11.575 496 1HZ LYS 60 1HZ LYS 60 10.522 4.938 12.839 497 2HZ LYS 60 2HZ LYS 60 11.421 5.923 11.799 498 3HZ LYS 60 3HZ LYS 60 10.900 4.401 11.279 499 H PHE 61 H PHE 61 3.072 5.437 9.708 500 HA PHE 61 HA PHE 61 1.752 7.836 10.547 501 1HB PHE 61 1HB PHE 61 2.083 6.573 8.126 502 2HB PHE 61 2HB PHE 61 0.384 6.281 8.478 503 HD1 PHE 61 HD1 PHE 61 2.836 9.093 8.674 504 HD2 PHE 61 HD2 PHE 61 -1.109 7.849 7.667 505 HE1 PHE 61 HE1 PHE 61 2.313 11.373 7.911 506 HE2 PHE 61 HE2 PHE 61 -1.635 10.126 6.905 507 HZ PHE 61 HZ PHE 61 0.075 11.892 7.024 508 H LEU 62 H LEU 62 0.835 4.363 10.487 509 HA LEU 62 HA LEU 62 -1.800 4.738 11.357 510 1HB LEU 62 1HB LEU 62 -1.855 2.438 11.992 511 2HB LEU 62 2HB LEU 62 -0.922 2.575 10.518 512 HG LEU 62 HG LEU 62 1.089 2.621 12.311 513 1HD1 LEU 62 1HD1 LEU 62 -0.857 2.225 14.051 514 2HD1 LEU 62 2HD1 LEU 62 0.727 1.495 14.245 515 3HD1 LEU 62 3HD1 LEU 62 -0.605 0.548 13.576 516 1HD2 LEU 62 1HD2 LEU 62 1.501 0.985 10.857 517 2HD2 LEU 62 2HD2 LEU 62 -0.206 0.618 10.644 518 3HD2 LEU 62 3HD2 LEU 62 0.688 -0.083 11.996 519 H LEU 63 H LEU 63 1.204 4.463 13.217 520 HA LEU 63 HA LEU 63 -0.128 4.515 15.751 521 1HB LEU 63 1HB LEU 63 2.205 3.613 15.226 522 2HB LEU 63 2HB LEU 63 2.737 5.283 15.269 523 HG LEU 63 HG LEU 63 1.214 4.678 17.640 524 1HD1 LEU 63 1HD1 LEU 63 2.916 3.112 18.618 525 2HD1 LEU 63 2HD1 LEU 63 3.491 2.828 16.975 526 3HD1 LEU 63 3HD1 LEU 63 1.838 2.400 17.417 527 1HD2 LEU 63 1HD2 LEU 63 3.298 5.438 18.727 528 2HD2 LEU 63 2HD2 LEU 63 2.742 6.539 17.466 529 3HD2 LEU 63 3HD2 LEU 63 4.089 5.445 17.150 530 H ARG 64 H ARG 64 1.255 6.910 13.627 531 HA ARG 64 HA ARG 64 1.335 9.087 15.403 532 1HB ARG 64 1HB ARG 64 1.263 8.805 12.437 533 2HB ARG 64 2HB ARG 64 0.957 10.394 13.124 534 1HG ARG 64 1HG ARG 64 3.263 9.207 14.362 535 2HG ARG 64 2HG ARG 64 3.434 9.200 12.606 536 1HD ARG 64 1HD ARG 64 3.683 11.425 12.512 537 2HD ARG 64 2HD ARG 64 2.375 11.708 13.659 538 HE ARG 64 HE ARG 64 3.934 11.922 15.312 539 1HH1 ARG 64 1HH1 ARG 64 5.415 10.283 12.610 540 2HH1 ARG 64 2HH1 ARG 64 7.001 10.306 13.304 541 1HH2 ARG 64 1HH2 ARG 64 6.021 11.952 16.227 542 2HH2 ARG 64 2HH2 ARG 64 7.345 11.253 15.357 543 H GLU 65 H GLU 65 -1.318 7.668 13.617 544 HA GLU 65 HA GLU 65 -3.083 9.840 14.517 545 1HB GLU 65 1HB GLU 65 -2.951 8.264 12.111 546 2HB GLU 65 2HB GLU 65 -4.531 8.075 12.860 547 1HG GLU 65 1HG GLU 65 -4.676 9.877 11.328 548 2HG GLU 65 2HG GLU 65 -4.699 10.563 12.952 549 H LEU 66 H LEU 66 -2.313 6.533 15.047 550 HA LEU 66 HA LEU 66 -4.788 5.646 16.105 551 1HB LEU 66 1HB LEU 66 -2.012 4.683 15.998 552 2HB LEU 66 2HB LEU 66 -2.923 4.118 17.382 553 HG LEU 66 HG LEU 66 -4.439 2.925 16.059 554 1HD1 LEU 66 1HD1 LEU 66 -3.653 3.528 13.372 555 2HD1 LEU 66 2HD1 LEU 66 -4.117 5.015 14.204 556 3HD1 LEU 66 3HD1 LEU 66 -5.245 3.659 14.126 557 1HD2 LEU 66 1HD2 LEU 66 -2.446 2.247 14.152 558 2HD2 LEU 66 2HD2 LEU 66 -2.963 1.354 15.579 559 3HD2 LEU 66 3HD2 LEU 66 -1.673 2.551 15.709 560 H GLY 67 H GLY 67 -5.700 6.833 17.715 561 1HA GLY 67 1HA GLY 67 -4.098 7.919 19.865 562 2HA GLY 67 2HA GLY 67 -5.843 8.047 19.696 563 H THR 68 H THR 68 -5.432 4.897 19.237 564 HA THR 68 HA THR 68 -5.732 4.290 22.090 565 HB THR 68 HB THR 68 -7.244 2.645 21.605 566 HG1 THR 68 HG1 THR 68 -5.582 2.095 19.530 567 1HG2 THR 68 1HG2 THR 68 -8.835 3.752 20.567 568 2HG2 THR 68 2HG2 THR 68 -8.035 3.524 19.012 569 3HG2 THR 68 3HG2 THR 68 -7.632 4.918 20.015 570 H ALA 69 H ALA 69 -5.070 1.977 22.635 571 HA ALA 69 HA ALA 69 -2.541 1.551 23.006 572 1HB ALA 69 1HB ALA 69 -2.840 -0.798 23.047 573 2HB ALA 69 2HB ALA 69 -4.143 -0.720 21.861 574 3HB ALA 69 3HB ALA 69 -4.386 -0.071 23.483 575 H GLY 70 H GLY 70 -3.862 0.223 19.954 576 1HA GLY 70 1HA GLY 70 -2.906 0.259 17.837 577 2HA GLY 70 2HA GLY 70 -1.547 1.154 18.497 578 H ASN 71 H ASN 71 -2.819 -1.957 17.713 579 HA ASN 71 HA ASN 71 -0.213 -3.109 17.640 580 1HB ASN 71 1HB ASN 71 -2.057 -3.806 19.895 581 2HB ASN 71 2HB ASN 71 -0.998 -5.044 19.226 582 1HD2 ASN 71 1HD2 ASN 71 -1.148 -3.440 21.815 583 2HD2 ASN 71 2HD2 ASN 71 0.476 -2.902 22.053 584 H LEU 72 H LEU 72 -0.378 -5.515 17.057 585 HA LEU 72 HA LEU 72 -2.374 -5.741 14.977 586 1HB LEU 72 1HB LEU 72 -0.496 -7.959 15.652 587 2HB LEU 72 2HB LEU 72 -1.092 -7.444 14.087 588 HG LEU 72 HG LEU 72 0.390 -5.272 14.848 589 1HD1 LEU 72 1HD1 LEU 72 2.372 -5.910 15.890 590 2HD1 LEU 72 2HD1 LEU 72 2.073 -7.627 15.620 591 3HD1 LEU 72 3HD1 LEU 72 1.128 -6.746 16.819 592 1HD2 LEU 72 1HD2 LEU 72 1.811 -7.478 13.462 593 2HD2 LEU 72 2HD2 LEU 72 1.656 -5.777 13.024 594 3HD2 LEU 72 3HD2 LEU 72 0.314 -6.886 12.742 595 H GLU 73 H GLU 73 -4.342 -6.537 15.377 596 HA GLU 73 HA GLU 73 -4.654 -8.473 17.566 597 1HB GLU 73 1HB GLU 73 -6.039 -6.222 17.268 598 2HB GLU 73 2HB GLU 73 -7.003 -7.236 16.207 599 1HG GLU 73 1HG GLU 73 -8.138 -7.633 18.101 600 2HG GLU 73 2HG GLU 73 -6.882 -8.850 18.328 601 H GLY 74 H GLY 74 -6.050 -10.319 17.216 602 1HA GLY 74 1HA GLY 74 -6.867 -12.099 16.008 603 2HA GLY 74 2HA GLY 74 -6.954 -11.037 14.612 604 H GLY 75 H GLY 75 -6.013 -12.192 13.015 605 1HA GLY 75 1HA GLY 75 -3.329 -13.302 13.568 606 2HA GLY 75 2HA GLY 75 -4.463 -14.024 12.439 607 H ARG 76 H ARG 76 -5.179 -11.191 11.554 608 HA ARG 76 HA ARG 76 -3.077 -11.023 9.549 609 1HB ARG 76 1HB ARG 76 -5.806 -9.756 9.795 610 2HB ARG 76 2HB ARG 76 -4.666 -9.295 8.538 611 1HG ARG 76 1HG ARG 76 -6.115 -10.873 7.562 612 2HG ARG 76 2HG ARG 76 -4.603 -11.729 7.871 613 1HD ARG 76 1HD ARG 76 -5.520 -13.055 9.468 614 2HD ARG 76 2HD ARG 76 -6.631 -11.803 10.023 615 HE ARG 76 HE ARG 76 -8.214 -12.727 8.677 616 1HH1 ARG 76 1HH1 ARG 76 -5.081 -13.607 7.416 617 2HH1 ARG 76 2HH1 ARG 76 -5.729 -14.585 6.143 618 1HH2 ARG 76 1HH2 ARG 76 -9.068 -14.019 7.005 619 2HH2 ARG 76 2HH2 ARG 76 -7.992 -14.818 5.908 620 H ALA 77 H ALA 77 -4.800 -8.124 10.447 621 HA ALA 77 HA ALA 77 -2.765 -7.111 12.185 622 1HB ALA 77 1HB ALA 77 -1.381 -6.621 10.439 623 2HB ALA 77 2HB ALA 77 -2.355 -5.149 10.459 624 3HB ALA 77 3HB ALA 77 -2.707 -6.425 9.299 625 H ILE 78 H ILE 78 -4.946 -7.069 13.227 626 HA ILE 78 HA ILE 78 -6.677 -4.899 12.356 627 HB ILE 78 HB ILE 78 -7.016 -6.628 14.791 628 1HG1 ILE 78 1HG1 ILE 78 -8.526 -7.188 12.292 629 2HG1 ILE 78 2HG1 ILE 78 -6.853 -7.730 12.372 630 1HG2 ILE 78 1HG2 ILE 78 -8.430 -4.767 14.953 631 2HG2 ILE 78 2HG2 ILE 78 -9.451 -6.065 14.333 632 3HG2 ILE 78 3HG2 ILE 78 -8.834 -4.827 13.239 633 1HD1 ILE 78 1HD1 ILE 78 -7.811 -8.603 14.754 634 2HD1 ILE 78 2HD1 ILE 78 -7.730 -9.569 13.280 635 3HD1 ILE 78 3HD1 ILE 78 -9.232 -8.757 13.722 636 H LEU 79 H LEU 79 -5.428 -3.055 12.767 637 HA LEU 79 HA LEU 79 -4.285 -2.636 15.376 638 1HB LEU 79 1HB LEU 79 -3.582 -0.469 14.535 639 2HB LEU 79 2HB LEU 79 -3.176 -1.741 13.400 640 HG LEU 79 HG LEU 79 -5.513 -0.992 12.343 641 1HD1 LEU 79 1HD1 LEU 79 -4.424 1.538 13.571 642 2HD1 LEU 79 2HD1 LEU 79 -5.908 0.720 14.067 643 3HD1 LEU 79 3HD1 LEU 79 -5.780 1.412 12.447 644 1HD2 LEU 79 1HD2 LEU 79 -4.235 -0.321 10.623 645 2HD2 LEU 79 2HD2 LEU 79 -2.892 -0.852 11.636 646 3HD2 LEU 79 3HD2 LEU 79 -3.355 0.850 11.606 647 H GLN 80 H GLN 80 -4.759 -0.346 16.384 648 HA GLN 80 HA GLN 80 -7.632 0.204 16.324 649 1HB GLN 80 1HB GLN 80 -6.496 -1.393 18.273 650 2HB GLN 80 2HB GLN 80 -6.571 0.182 19.042 651 1HG GLN 80 1HG GLN 80 -9.045 -0.054 17.870 652 2HG GLN 80 2HG GLN 80 -8.693 -1.694 18.415 653 1HE2 GLN 80 1HE2 GLN 80 -9.011 1.646 19.425 654 2HE2 GLN 80 2HE2 GLN 80 -9.327 1.311 21.091 655 H GLY 81 H GLY 81 -7.875 2.297 15.999 656 1HA GLY 81 1HA GLY 81 -6.948 4.327 17.646 657 2HA GLY 81 2HA GLY 81 -5.784 4.185 16.345 658 H LYS 82 H LYS 82 -6.131 5.414 14.614 659 HA LYS 82 HA LYS 82 -8.897 6.216 14.003 660 1HB LYS 82 1HB LYS 82 -7.088 7.933 15.040 661 2HB LYS 82 2HB LYS 82 -6.755 8.137 13.326 662 1HG LYS 82 1HG LYS 82 -9.466 8.281 13.357 663 2HG LYS 82 2HG LYS 82 -9.059 8.995 14.919 664 1HD LYS 82 1HD LYS 82 -8.586 10.899 13.873 665 2HD LYS 82 2HD LYS 82 -7.246 10.082 13.066 666 1HE LYS 82 1HE LYS 82 -8.888 9.321 11.326 667 2HE LYS 82 2HE LYS 82 -10.081 10.374 12.086 668 1HZ LYS 82 1HZ LYS 82 -9.192 11.666 10.398 669 2HZ LYS 82 2HZ LYS 82 -7.612 11.120 10.653 670 3HZ LYS 82 3HZ LYS 82 -8.325 12.187 11.754 671 H PHE 83 H PHE 83 -6.636 4.298 12.884 672 HA PHE 83 HA PHE 83 -6.473 5.261 10.138 673 1HB PHE 83 1HB PHE 83 -5.017 3.345 11.766 674 2HB PHE 83 2HB PHE 83 -5.444 2.670 10.195 675 HD1 PHE 83 HD1 PHE 83 -3.388 2.610 9.113 676 HD2 PHE 83 HD2 PHE 83 -4.678 6.202 10.991 677 HE1 PHE 83 HE1 PHE 83 -1.525 3.824 8.062 678 HE2 PHE 83 HE2 PHE 83 -2.819 7.424 9.945 679 HZ PHE 83 HZ PHE 83 -1.245 6.232 8.477 680 H THR 84 H THR 84 -9.034 4.981 10.739 681 HA THR 84 HA THR 84 -10.086 2.387 10.096 682 HB THR 84 HB THR 84 -12.260 3.587 10.184 683 HG1 THR 84 HG1 THR 84 -12.056 5.614 9.647 684 1HG2 THR 84 1HG2 THR 84 -12.117 3.120 12.345 685 2HG2 THR 84 2HG2 THR 84 -11.473 4.746 12.578 686 3HG2 THR 84 3HG2 THR 84 -10.374 3.386 12.345 687 H HIS 85 H HIS 85 -8.709 2.444 8.055 688 HA HIS 85 HA HIS 85 -8.439 2.666 5.802 689 1HB HIS 85 1HB HIS 85 -10.370 2.070 4.485 690 2HB HIS 85 2HB HIS 85 -10.413 1.139 5.978 691 HD2 HIS 85 HD2 HIS 85 -12.900 1.119 7.033 692 HE1 HIS 85 HE1 HIS 85 -14.233 4.857 5.526 693 HE2 HIS 85 HE2 HIS 85 -14.833 2.836 6.907 694 H PHE 86 H PHE 86 -8.492 5.117 7.205 695 HA PHE 86 HA PHE 86 -9.969 6.954 5.490 696 1HB PHE 86 1HB PHE 86 -8.775 7.086 8.166 697 2HB PHE 86 2HB PHE 86 -8.483 8.525 7.194 698 HD1 PHE 86 HD1 PHE 86 -11.434 6.270 7.305 699 HD2 PHE 86 HD2 PHE 86 -9.886 10.160 8.051 700 HE1 PHE 86 HE1 PHE 86 -13.700 7.060 7.837 701 HE2 PHE 86 HE2 PHE 86 -12.150 10.961 8.584 702 HZ PHE 86 HZ PHE 86 -14.061 9.410 8.479 703 H LEU 87 H LEU 87 -6.707 7.189 6.830 704 HA LEU 87 HA LEU 87 -5.675 8.571 4.592 705 1HB LEU 87 1HB LEU 87 -4.591 7.397 7.091 706 2HB LEU 87 2HB LEU 87 -3.446 7.637 5.786 707 HG LEU 87 HG LEU 87 -3.432 9.529 7.320 708 1HD1 LEU 87 1HD1 LEU 87 -4.353 11.253 5.469 709 2HD1 LEU 87 2HD1 LEU 87 -4.194 9.795 4.490 710 3HD1 LEU 87 3HD1 LEU 87 -2.798 10.430 5.358 711 1HD2 LEU 87 1HD2 LEU 87 -6.163 10.358 6.490 712 2HD2 LEU 87 2HD2 LEU 87 -5.263 10.732 7.960 713 3HD2 LEU 87 3HD2 LEU 87 -6.005 9.145 7.761 714 H ILE 88 H ILE 88 -5.778 5.185 5.519 715 HA ILE 88 HA ILE 88 -3.884 4.153 3.763 716 HB ILE 88 HB ILE 88 -6.450 2.793 4.584 717 1HG1 ILE 88 1HG1 ILE 88 -3.799 2.629 6.030 718 2HG1 ILE 88 2HG1 ILE 88 -5.050 3.778 6.489 719 1HG2 ILE 88 1HG2 ILE 88 -4.364 1.958 2.907 720 2HG2 ILE 88 2HG2 ILE 88 -5.672 0.979 3.572 721 3HG2 ILE 88 3HG2 ILE 88 -4.137 1.100 4.431 722 1HD1 ILE 88 1HD1 ILE 88 -6.600 1.827 6.775 723 2HD1 ILE 88 2HD1 ILE 88 -5.254 1.898 7.913 724 3HD1 ILE 88 3HD1 ILE 88 -5.201 0.777 6.552 725 H ASN 89 H ASN 89 -7.423 4.088 3.248 726 HA ASN 89 HA ASN 89 -7.308 3.300 0.584 727 1HB ASN 89 1HB ASN 89 -9.345 3.530 2.227 728 2HB ASN 89 2HB ASN 89 -9.516 5.113 1.475 729 1HD2 ASN 89 1HD2 ASN 89 -11.418 4.675 0.452 730 2HD2 ASN 89 2HD2 ASN 89 -11.555 3.566 -0.866 731 H GLU 90 H GLU 90 -7.318 6.593 1.919 732 HA GLU 90 HA GLU 90 -7.645 8.036 -0.432 733 1HB GLU 90 1HB GLU 90 -7.558 8.912 1.954 734 2HB GLU 90 2HB GLU 90 -5.806 8.862 1.809 735 1HG GLU 90 1HG GLU 90 -6.339 11.061 1.319 736 2HG GLU 90 2HG GLU 90 -6.117 10.320 -0.266 737 H ARG 91 H ARG 91 -4.561 7.211 1.144 738 HA ARG 91 HA ARG 91 -2.900 8.195 -0.884 739 1HB ARG 91 1HB ARG 91 -2.620 6.536 1.517 740 2HB ARG 91 2HB ARG 91 -1.403 6.227 0.287 741 1HG ARG 91 1HG ARG 91 -1.947 9.057 0.959 742 2HG ARG 91 2HG ARG 91 -1.125 8.080 2.178 743 1HD ARG 91 1HD ARG 91 0.583 9.055 0.878 744 2HD ARG 91 2HD ARG 91 0.470 7.378 0.349 745 HE ARG 91 HE ARG 91 -0.834 9.558 -1.141 746 1HH1 ARG 91 1HH1 ARG 91 1.298 6.786 -1.045 747 2HH1 ARG 91 2HH1 ARG 91 1.499 6.733 -2.762 748 1HH2 ARG 91 1HH2 ARG 91 -0.568 9.479 -3.392 749 2HH2 ARG 91 2HH2 ARG 91 0.444 8.261 -4.094 750 H ILE 92 H ILE 92 -3.969 4.845 -0.253 751 HA ILE 92 HA ILE 92 -2.599 3.645 -2.365 752 HB ILE 92 HB ILE 92 -5.233 2.859 -1.118 753 1HG1 ILE 92 1HG1 ILE 92 -2.467 1.702 -0.785 754 2HG1 ILE 92 2HG1 ILE 92 -3.179 2.870 0.317 755 1HG2 ILE 92 1HG2 ILE 92 -4.412 0.560 -2.135 756 2HG2 ILE 92 2HG2 ILE 92 -3.644 1.627 -3.310 757 3HG2 ILE 92 3HG2 ILE 92 -5.394 1.687 -3.076 758 1HD1 ILE 92 1HD1 ILE 92 -3.832 0.001 -0.101 759 2HD1 ILE 92 2HD1 ILE 92 -5.100 1.100 0.449 760 3HD1 ILE 92 3HD1 ILE 92 -3.623 0.908 1.400 761 H GLU 93 H GLU 93 -6.013 4.699 -2.281 762 HA GLU 93 HA GLU 93 -6.665 4.177 -4.921 763 1HB GLU 93 1HB GLU 93 -7.671 6.393 -3.124 764 2HB GLU 93 2HB GLU 93 -8.436 5.907 -4.632 765 1HG GLU 93 1HG GLU 93 -8.016 3.641 -2.894 766 2HG GLU 93 2HG GLU 93 -8.941 4.907 -2.088 767 H ASP 94 H ASP 94 -4.737 6.716 -3.587 768 HA ASP 94 HA ASP 94 -4.880 8.543 -5.746 769 1HB ASP 94 1HB ASP 94 -4.028 9.056 -3.435 770 2HB ASP 94 2HB ASP 94 -2.576 8.143 -3.829 771 H TYR 95 H TYR 95 -2.668 5.879 -4.960 772 HA TYR 95 HA TYR 95 -1.186 6.296 -7.418 773 1HB TYR 95 1HB TYR 95 0.103 5.669 -5.479 774 2HB TYR 95 2HB TYR 95 -0.883 4.231 -5.232 775 HD1 TYR 95 HD1 TYR 95 1.210 5.797 -7.910 776 HD2 TYR 95 HD2 TYR 95 -0.019 2.216 -5.967 777 HE1 TYR 95 HE1 TYR 95 2.750 4.506 -9.328 778 HE2 TYR 95 HE2 TYR 95 1.520 0.916 -7.378 779 HH TYR 95 HH TYR 95 3.619 1.327 -8.681 780 H VAL 96 H VAL 96 -2.920 3.473 -6.018 781 HA VAL 96 HA VAL 96 -2.842 1.876 -8.260 782 HB VAL 96 HB VAL 96 -4.924 0.774 -7.425 783 1HG1 VAL 96 1HG1 VAL 96 -2.783 1.313 -5.370 784 2HG1 VAL 96 2HG1 VAL 96 -2.749 0.064 -6.614 785 3HG1 VAL 96 3HG1 VAL 96 -3.940 -0.016 -5.315 786 1HG2 VAL 96 1HG2 VAL 96 -6.313 1.729 -5.970 787 2HG2 VAL 96 2HG2 VAL 96 -5.422 3.228 -6.230 788 3HG2 VAL 96 3HG2 VAL 96 -4.990 2.172 -4.891 789 H ASN 97 H ASN 97 -5.253 4.355 -7.455 790 HA ASN 97 HA ASN 97 -6.290 4.102 -10.197 791 1HB ASN 97 1HB ASN 97 -7.602 4.644 -7.601 792 2HB ASN 97 2HB ASN 97 -8.172 5.609 -8.959 793 1HD2 ASN 97 1HD2 ASN 97 -9.595 3.580 -7.477 794 2HD2 ASN 97 2HD2 ASN 97 -10.044 2.361 -8.617 795 H LYS 98 H LYS 98 -3.975 5.444 -10.059 796 HA LYS 98 HA LYS 98 -4.414 8.268 -9.642 797 1HB LYS 98 1HB LYS 98 -2.205 7.074 -9.259 798 2HB LYS 98 2HB LYS 98 -2.045 7.014 -11.010 799 1HG LYS 98 1HG LYS 98 -1.695 9.258 -11.202 800 2HG LYS 98 2HG LYS 98 -2.622 9.638 -9.751 801 1HD LYS 98 1HD LYS 98 -0.809 9.543 -8.446 802 2HD LYS 98 2HD LYS 98 -0.251 8.044 -9.191 803 1HE LYS 98 1HE LYS 98 -0.004 10.638 -10.659 804 2HE LYS 98 2HE LYS 98 1.175 10.207 -9.420 805 1HZ LYS 98 1HZ LYS 98 0.748 9.059 -12.057 806 2HZ LYS 98 2HZ LYS 98 1.121 7.962 -10.825 807 3HZ LYS 98 3HZ LYS 98 2.179 9.236 -11.170 808 H PHE 99 H PHE 99 -5.077 6.127 -12.145 809 HA PHE 99 HA PHE 99 -4.526 7.898 -14.327 810 1HB PHE 99 1HB PHE 99 -6.060 5.315 -14.112 811 2HB PHE 99 2HB PHE 99 -5.933 6.217 -15.620 812 HD1 PHE 99 HD1 PHE 99 -3.258 7.094 -15.813 813 HD2 PHE 99 HD2 PHE 99 -4.724 3.454 -14.167 814 HE1 PHE 99 HE1 PHE 99 -1.094 6.020 -16.272 815 HE2 PHE 99 HE2 PHE 99 -2.562 2.372 -14.624 816 HZ PHE 99 HZ PHE 99 -0.743 3.656 -15.677 817 H VAL 100 H VAL 100 -7.540 6.777 -12.779 818 HA VAL 100 HA VAL 100 -9.128 8.633 -14.288 819 HB VAL 100 HB VAL 100 -10.045 6.468 -13.612 820 1HG1 VAL 100 1HG1 VAL 100 -10.858 6.474 -11.107 821 2HG1 VAL 100 2HG1 VAL 100 -9.445 7.507 -10.890 822 3HG1 VAL 100 3HG1 VAL 100 -9.256 5.882 -11.548 823 1HG2 VAL 100 1HG2 VAL 100 -12.153 7.268 -13.457 824 2HG2 VAL 100 2HG2 VAL 100 -11.349 8.811 -13.748 825 3HG2 VAL 100 3HG2 VAL 100 -11.768 8.331 -12.103 826 H ILE 101 H ILE 101 -7.413 8.792 -11.308 827 HA ILE 101 HA ILE 101 -9.019 11.038 -10.354 828 HB ILE 101 HB ILE 101 -8.190 9.252 -8.778 829 1HG1 ILE 101 1HG1 ILE 101 -7.227 12.049 -8.138 830 2HG1 ILE 101 2HG1 ILE 101 -8.910 11.539 -8.057 831 1HG2 ILE 101 1HG2 ILE 101 -5.928 9.160 -8.121 832 2HG2 ILE 101 2HG2 ILE 101 -5.533 10.632 -9.019 833 3HG2 ILE 101 3HG2 ILE 101 -5.932 9.146 -9.888 834 1HD1 ILE 101 1HD1 ILE 101 -6.724 10.225 -6.469 835 2HD1 ILE 101 2HD1 ILE 101 -8.468 10.067 -6.259 836 3HD1 ILE 101 3HD1 ILE 101 -7.668 11.592 -5.877 837 H CYS 102 H CYS 102 -5.694 10.333 -11.423 838 HA CYS 102 HA CYS 102 -4.933 13.108 -11.250 839 1HB CYS 102 1HB CYS 102 -3.379 11.084 -10.912 840 2HB CYS 102 2HB CYS 102 -3.344 10.992 -12.671 841 H HIS 103 H HIS 103 -6.708 11.361 -13.451 842 HA HIS 103 HA HIS 103 -7.508 11.813 -15.524 843 1HB HIS 103 1HB HIS 103 -6.330 14.413 -14.731 844 2HB HIS 103 2HB HIS 103 -6.631 14.184 -16.450 845 HD2 HIS 103 HD2 HIS 103 -8.650 14.482 -13.110 846 HE1 HIS 103 HE1 HIS 103 -11.354 14.730 -16.372 847 HE2 HIS 103 HE2 HIS 103 -11.099 14.832 -13.867 848 H GLU 104 H GLU 104 -5.504 10.102 -15.545 849 HA GLU 104 HA GLU 104 -3.729 9.228 -16.694 850 1HB GLU 104 1HB GLU 104 -5.675 9.326 -18.332 851 2HB GLU 104 2HB GLU 104 -4.893 10.738 -19.028 852 1HG GLU 104 1HG GLU 104 -2.830 9.207 -19.247 853 2HG GLU 104 2HG GLU 104 -3.981 7.892 -19.018 854 H CYS 105 H CYS 105 -2.237 10.649 -15.503 855 HA CYS 105 HA CYS 105 -1.235 13.022 -16.750 856 1HB CYS 105 1HB CYS 105 -1.135 12.061 -14.223 857 2HB CYS 105 2HB CYS 105 0.465 11.596 -14.789 858 H ASN 106 H ASN 106 -1.060 11.526 -18.846 859 HA ASN 106 HA ASN 106 1.289 9.917 -19.026 860 1HB ASN 106 1HB ASN 106 -0.659 9.517 -20.464 861 2HB ASN 106 2HB ASN 106 -0.453 11.099 -21.205 862 1HD2 ASN 106 1HD2 ASN 106 1.892 8.588 -20.355 863 2HD2 ASN 106 2HD2 ASN 106 2.509 8.377 -21.954 864 H ARG 107 H ARG 107 0.807 12.443 -21.431 865 HA ARG 107 HA ARG 107 3.474 13.480 -20.757 866 1HB ARG 107 1HB ARG 107 2.121 14.021 -23.373 867 2HB ARG 107 2HB ARG 107 3.837 13.976 -23.000 868 1HG ARG 107 1HG ARG 107 3.281 11.432 -22.509 869 2HG ARG 107 2HG ARG 107 1.972 11.769 -23.643 870 1HD ARG 107 1HD ARG 107 4.569 12.803 -24.500 871 2HD ARG 107 2HD ARG 107 4.525 11.049 -24.323 872 HE ARG 107 HE ARG 107 2.355 12.253 -25.834 873 1HH1 ARG 107 1HH1 ARG 107 5.452 10.638 -25.919 874 2HH1 ARG 107 2HH1 ARG 107 5.263 10.099 -27.552 875 1HH2 ARG 107 1HH2 ARG 107 2.111 11.546 -27.980 876 2HH2 ARG 107 2HH2 ARG 107 3.368 10.615 -28.724 877 HA PRO 108 HA PRO 108 0.231 16.856 -19.723 878 1HB PRO 108 1HB PRO 108 2.231 17.201 -17.549 879 2HB PRO 108 2HB PRO 108 0.469 17.288 -17.480 880 1HG PRO 108 1HG PRO 108 1.802 15.169 -16.534 881 2HG PRO 108 2HG PRO 108 0.228 15.002 -17.329 882 1HD PRO 108 1HD PRO 108 2.942 14.333 -18.347 883 2HD PRO 108 2HD PRO 108 1.374 13.584 -18.705 884 H ASP 109 H ASP 109 0.526 18.763 -20.720 885 HA ASP 109 HA ASP 109 3.170 19.564 -21.576 886 1HB ASP 109 1HB ASP 109 0.521 20.981 -21.960 887 2HB ASP 109 2HB ASP 109 2.024 21.335 -22.806 888 H THR 110 H THR 110 3.132 19.556 -18.869 889 HA THR 110 HA THR 110 3.477 22.373 -18.230 890 HB THR 110 HB THR 110 2.380 20.947 -15.952 891 HG1 THR 110 HG1 THR 110 0.787 19.999 -16.905 892 1HG2 THR 110 1HG2 THR 110 1.001 23.225 -17.270 893 2HG2 THR 110 2HG2 THR 110 2.573 23.496 -16.518 894 3HG2 THR 110 3HG2 THR 110 1.232 22.880 -15.556 895 H ARG 111 H ARG 111 4.461 22.424 -15.836 896 HA ARG 111 HA ARG 111 6.838 20.766 -16.026 897 1HB ARG 111 1HB ARG 111 6.091 23.045 -14.188 898 2HB ARG 111 2HB ARG 111 7.622 22.185 -14.106 899 1HG ARG 111 1HG ARG 111 7.692 22.838 -16.674 900 2HG ARG 111 2HG ARG 111 6.645 24.140 -16.102 901 1HD ARG 111 1HD ARG 111 8.505 24.298 -14.221 902 2HD ARG 111 2HD ARG 111 9.496 23.572 -15.485 903 HE ARG 111 HE ARG 111 8.580 26.263 -15.366 904 1HH1 ARG 111 1HH1 ARG 111 9.328 23.675 -17.583 905 2HH1 ARG 111 2HH1 ARG 111 9.728 24.741 -18.888 906 1HH2 ARG 111 1HH2 ARG 111 9.100 27.666 -17.079 907 2HH2 ARG 111 2HH2 ARG 111 9.599 27.009 -18.602 908 H ILE 112 H ILE 112 6.541 18.761 -15.297 909 HA ILE 112 HA ILE 112 5.201 18.369 -12.709 910 HB ILE 112 HB ILE 112 5.584 15.842 -13.729 911 1HG1 ILE 112 1HG1 ILE 112 4.697 17.584 -16.035 912 2HG1 ILE 112 2HG1 ILE 112 6.306 16.883 -15.894 913 1HG2 ILE 112 1HG2 ILE 112 3.199 17.665 -13.961 914 2HG2 ILE 112 2HG2 ILE 112 3.576 16.554 -12.644 915 3HG2 ILE 112 3HG2 ILE 112 3.148 15.923 -14.235 916 1HD1 ILE 112 1HD1 ILE 112 3.697 15.432 -16.214 917 2HD1 ILE 112 2HD1 ILE 112 5.220 14.633 -15.826 918 3HD1 ILE 112 3HD1 ILE 112 5.044 15.505 -17.349 919 H ILE 113 H ILE 113 6.199 17.259 -11.068 920 HA ILE 113 HA ILE 113 8.939 16.314 -11.503 921 HB ILE 113 HB ILE 113 8.146 18.243 -9.312 922 1HG1 ILE 113 1HG1 ILE 113 8.508 19.268 -11.545 923 2HG1 ILE 113 2HG1 ILE 113 9.699 19.786 -10.357 924 1HG2 ILE 113 1HG2 ILE 113 10.832 16.972 -9.828 925 2HG2 ILE 113 2HG2 ILE 113 9.721 16.511 -8.538 926 3HG2 ILE 113 3HG2 ILE 113 10.438 18.122 -8.550 927 1HD1 ILE 113 1HD1 ILE 113 10.795 17.534 -11.606 928 2HD1 ILE 113 2HD1 ILE 113 11.279 19.220 -11.792 929 3HD1 ILE 113 3HD1 ILE 113 10.091 18.517 -12.891 930 H ARG 114 H ARG 114 9.435 14.508 -10.362 931 HA ARG 114 HA ARG 114 7.559 13.654 -8.261 932 1HB ARG 114 1HB ARG 114 7.561 12.511 -10.711 933 2HB ARG 114 2HB ARG 114 8.781 11.524 -9.913 934 1HG ARG 114 1HG ARG 114 7.071 11.230 -8.044 935 2HG ARG 114 2HG ARG 114 5.892 11.873 -9.188 936 1HD ARG 114 1HD ARG 114 7.577 9.400 -9.504 937 2HD ARG 114 2HD ARG 114 5.834 9.482 -9.280 938 HE ARG 114 HE ARG 114 5.674 10.457 -11.489 939 1HH1 ARG 114 1HH1 ARG 114 8.742 8.978 -10.692 940 2HH1 ARG 114 2HH1 ARG 114 9.165 8.689 -12.344 941 1HH2 ARG 114 1HH2 ARG 114 6.233 10.080 -13.647 942 2HH2 ARG 114 2HH2 ARG 114 7.741 9.316 -14.025 943 H GLU 115 H GLU 115 8.515 13.121 -6.402 944 HA GLU 115 HA GLU 115 11.336 12.280 -6.448 945 1HB GLU 115 1HB GLU 115 11.618 13.611 -4.336 946 2HB GLU 115 2HB GLU 115 11.356 14.577 -5.783 947 1HG GLU 115 1HG GLU 115 8.916 13.858 -4.333 948 2HG GLU 115 2HG GLU 115 10.029 14.895 -3.442 949 H GLY 116 H GLY 116 11.945 10.761 -4.904 950 1HA GLY 116 1HA GLY 116 11.618 9.465 -2.937 951 2HA GLY 116 2HA GLY 116 9.909 9.871 -2.988 952 H ARG 117 H ARG 117 11.261 8.930 -5.989 953 HA ARG 117 HA ARG 117 11.018 7.083 -7.293 954 1HB ARG 117 1HB ARG 117 10.663 5.438 -4.800 955 2HB ARG 117 2HB ARG 117 11.338 4.943 -6.345 956 1HG ARG 117 1HG ARG 117 12.637 6.958 -4.528 957 2HG ARG 117 2HG ARG 117 13.001 5.231 -4.505 958 1HD ARG 117 1HD ARG 117 14.464 5.541 -6.146 959 2HD ARG 117 2HD ARG 117 13.149 6.064 -7.196 960 HE ARG 117 HE ARG 117 13.787 8.254 -6.878 961 1HH1 ARG 117 1HH1 ARG 117 15.534 6.196 -4.662 962 2HH1 ARG 117 2HH1 ARG 117 16.652 7.434 -4.201 963 1HH2 ARG 117 1HH2 ARG 117 15.252 9.883 -6.265 964 2HH2 ARG 117 2HH2 ARG 117 16.493 9.527 -5.111 965 H ILE 118 H ILE 118 8.928 8.248 -7.688 966 HA ILE 118 HA ILE 118 6.692 8.231 -8.073 967 HB ILE 118 HB ILE 118 6.931 5.257 -7.622 968 1HG1 ILE 118 1HG1 ILE 118 6.947 6.450 -10.344 969 2HG1 ILE 118 2HG1 ILE 118 8.417 6.624 -9.390 970 1HG2 ILE 118 1HG2 ILE 118 4.677 6.826 -8.071 971 2HG2 ILE 118 2HG2 ILE 118 4.803 5.076 -8.250 972 3HG2 ILE 118 3HG2 ILE 118 5.059 6.126 -9.644 973 1HD1 ILE 118 1HD1 ILE 118 7.345 4.306 -10.756 974 2HD1 ILE 118 2HD1 ILE 118 7.776 3.970 -9.079 975 3HD1 ILE 118 3HD1 ILE 118 8.980 4.633 -10.184 976 H SER 119 H SER 119 7.166 9.102 -5.621 977 HA SER 119 HA SER 119 5.051 7.851 -4.001 978 1HB SER 119 1HB SER 119 7.835 8.299 -3.318 979 2HB SER 119 2HB SER 119 6.760 9.129 -2.192 980 HG SER 119 HG SER 119 6.518 6.397 -2.921 981 H LEU 120 H LEU 120 6.792 10.810 -4.838 982 HA LEU 120 HA LEU 120 4.406 12.351 -4.080 983 1HB LEU 120 1HB LEU 120 7.187 13.394 -3.617 984 2HB LEU 120 2HB LEU 120 5.674 14.024 -2.997 985 HG LEU 120 HG LEU 120 6.256 11.285 -2.119 986 1HD1 LEU 120 1HD1 LEU 120 8.541 12.221 -2.197 987 2HD1 LEU 120 2HD1 LEU 120 7.995 11.864 -0.558 988 3HD1 LEU 120 3HD1 LEU 120 8.009 13.528 -1.140 989 1HD2 LEU 120 1HD2 LEU 120 5.497 13.854 -0.743 990 2HD2 LEU 120 2HD2 LEU 120 5.648 12.293 0.064 991 3HD2 LEU 120 3HD2 LEU 120 4.426 12.525 -1.186 992 H LEU 121 H LEU 121 4.257 14.460 -5.181 993 HA LEU 121 HA LEU 121 5.977 15.335 -7.189 994 1HB LEU 121 1HB LEU 121 4.682 14.651 -9.212 995 2HB LEU 121 2HB LEU 121 5.536 13.346 -8.414 996 HG LEU 121 HG LEU 121 2.681 13.783 -7.692 997 1HD1 LEU 121 1HD1 LEU 121 1.798 13.234 -9.658 998 2HD1 LEU 121 2HD1 LEU 121 2.974 11.946 -9.915 999 3HD1 LEU 121 3HD1 LEU 121 3.372 13.605 -10.362 1000 1HD2 LEU 121 1HD2 LEU 121 3.218 11.947 -6.548 1001 2HD2 LEU 121 2HD2 LEU 121 4.707 11.708 -7.467 1002 3HD2 LEU 121 3HD2 LEU 121 3.174 11.102 -8.097 1003 H LYS 122 H LYS 122 4.803 16.806 -8.826 1004 HA LYS 122 HA LYS 122 2.538 18.125 -7.468 1005 1HB LYS 122 1HB LYS 122 4.940 19.244 -7.750 1006 2HB LYS 122 2HB LYS 122 4.283 19.654 -9.327 1007 1HG LYS 122 1HG LYS 122 3.012 21.268 -8.484 1008 2HG LYS 122 2HG LYS 122 2.407 20.225 -7.195 1009 1HD LYS 122 1HD LYS 122 3.532 21.874 -6.017 1010 2HD LYS 122 2HD LYS 122 4.744 20.598 -6.143 1011 1HE LYS 122 1HE LYS 122 6.061 22.270 -6.874 1012 2HE LYS 122 2HE LYS 122 5.250 21.965 -8.409 1013 1HZ LYS 122 1HZ LYS 122 5.313 24.336 -7.737 1014 2HZ LYS 122 2HZ LYS 122 4.320 23.962 -6.420 1015 3HZ LYS 122 3HZ LYS 122 3.748 23.747 -7.997 1016 H CYS 123 H CYS 123 0.797 18.810 -8.694 1017 HA CYS 123 HA CYS 123 0.890 18.440 -11.592 1018 1HB CYS 123 1HB CYS 123 -0.944 16.966 -9.720 1019 2HB CYS 123 2HB CYS 123 -1.426 17.295 -11.376 1020 H GLU 124 H GLU 124 0.915 20.859 -10.385 1021 HA GLU 124 HA GLU 124 -1.482 22.056 -9.702 1022 1HB GLU 124 1HB GLU 124 0.930 23.181 -11.124 1023 2HB GLU 124 2HB GLU 124 -0.421 24.181 -10.610 1024 1HG GLU 124 1HG GLU 124 0.473 22.539 -8.433 1025 2HG GLU 124 2HG GLU 124 1.827 23.432 -9.122 1026 H ALA 125 H ALA 125 -0.390 20.993 -12.812 1027 HA ALA 125 HA ALA 125 -2.171 22.599 -14.369 1028 1HB ALA 125 1HB ALA 125 -1.532 21.166 -16.228 1029 2HB ALA 125 2HB ALA 125 -0.766 20.035 -15.112 1030 3HB ALA 125 3HB ALA 125 -0.113 21.659 -15.309 1031 H CYS 126 H CYS 126 -2.137 19.046 -14.136 1032 HA CYS 126 HA CYS 126 -4.966 18.941 -14.669 1033 1HB CYS 126 1HB CYS 126 -4.689 16.534 -14.678 1034 2HB CYS 126 2HB CYS 126 -3.380 17.270 -15.595 1035 H GLY 127 H GLY 127 -4.736 20.365 -12.396 1036 1HA GLY 127 1HA GLY 127 -6.279 20.123 -10.528 1037 2HA GLY 127 2HA GLY 127 -5.689 18.477 -10.341 1038 H ALA 128 H ALA 128 -4.445 18.238 -8.622 1039 HA ALA 128 HA ALA 128 -2.285 20.089 -8.116 1040 1HB ALA 128 1HB ALA 128 -4.738 20.223 -6.603 1041 2HB ALA 128 2HB ALA 128 -3.332 21.286 -6.567 1042 3HB ALA 128 3HB ALA 128 -3.367 19.838 -5.562 1043 H LYS 129 H LYS 129 -0.624 19.196 -6.909 1044 HA LYS 129 HA LYS 129 -0.971 16.506 -5.823 1045 1HB LYS 129 1HB LYS 129 0.088 16.921 -8.357 1046 2HB LYS 129 2HB LYS 129 1.499 16.728 -7.345 1047 1HG LYS 129 1HG LYS 129 0.676 14.635 -8.407 1048 2HG LYS 129 2HG LYS 129 0.820 14.567 -6.651 1049 1HD LYS 129 1HD LYS 129 -1.808 15.465 -7.482 1050 2HD LYS 129 2HD LYS 129 -1.405 13.891 -8.167 1051 1HE LYS 129 1HE LYS 129 -1.109 14.572 -5.249 1052 2HE LYS 129 2HE LYS 129 -2.546 13.812 -5.935 1053 1HZ LYS 129 1HZ LYS 129 0.132 12.636 -6.339 1054 2HZ LYS 129 2HZ LYS 129 -1.380 11.885 -6.437 1055 3HZ LYS 129 3HZ LYS 129 -0.749 12.319 -4.929 1056 H ALA 130 H ALA 130 0.658 15.929 -4.280 1057 HA ALA 130 HA ALA 130 1.872 18.258 -3.026 1058 1HB ALA 130 1HB ALA 130 2.241 16.797 -1.112 1059 2HB ALA 130 2HB ALA 130 1.670 15.416 -2.048 1060 3HB ALA 130 3HB ALA 130 0.563 16.731 -1.651 1061 HA PRO 131 HA PRO 131 5.785 17.078 -4.963 1062 1HB PRO 131 1HB PRO 131 7.153 19.290 -4.172 1063 2HB PRO 131 2HB PRO 131 6.063 19.272 -5.561 1064 1HG PRO 131 1HG PRO 131 5.582 20.274 -2.787 1065 2HG PRO 131 2HG PRO 131 5.087 20.978 -4.333 1066 1HD PRO 131 1HD PRO 131 3.401 19.559 -2.741 1067 2HD PRO 131 2HD PRO 131 3.245 19.619 -4.508 1068 H LEU 132 H LEU 132 6.142 18.838 -1.868 1069 HA LEU 132 HA LEU 132 6.921 16.693 -0.285 1070 1HB LEU 132 1HB LEU 132 8.861 17.121 -2.162 1071 2HB LEU 132 2HB LEU 132 9.441 18.111 -0.838 1072 HG LEU 132 HG LEU 132 8.776 15.177 -0.607 1073 1HD1 LEU 132 1HD1 LEU 132 10.951 14.637 -0.981 1074 2HD1 LEU 132 2HD1 LEU 132 11.553 16.200 -0.424 1075 3HD1 LEU 132 3HD1 LEU 132 10.834 16.053 -2.029 1076 1HD2 LEU 132 1HD2 LEU 132 8.682 16.820 1.421 1077 2HD2 LEU 132 2HD2 LEU 132 10.441 16.730 1.320 1078 3HD2 LEU 132 3HD2 LEU 132 9.496 15.263 1.575 1079 H LYS 133 H LYS 133 8.571 19.817 -0.757 1080 HA LYS 133 HA LYS 133 7.632 20.614 1.919 1081 1HB LYS 133 1HB LYS 133 10.066 21.664 0.469 1082 2HB LYS 133 2HB LYS 133 9.617 21.959 2.142 1083 1HG LYS 133 1HG LYS 133 9.921 19.129 1.451 1084 2HG LYS 133 2HG LYS 133 11.396 20.087 1.312 1085 1HD LYS 133 1HD LYS 133 10.103 20.836 3.725 1086 2HD LYS 133 2HD LYS 133 10.139 19.073 3.660 1087 1HE LYS 133 1HE LYS 133 12.132 19.906 4.757 1088 2HE LYS 133 2HE LYS 133 12.555 19.154 3.220 1089 1HZ LYS 133 1HZ LYS 133 13.192 21.709 4.079 1090 2HZ LYS 133 2HZ LYS 133 12.055 21.911 2.843 1091 3HZ LYS 133 3HZ LYS 133 13.474 21.039 2.551 1092 H ASN 134 H ASN 134 7.410 23.004 2.211 1093 HA ASN 134 HA ASN 134 6.200 24.185 -0.201 1094 1HB ASN 134 1HB ASN 134 4.889 25.582 1.442 1095 2HB ASN 134 2HB ASN 134 4.523 23.860 1.473 1096 1HD2 ASN 134 1HD2 ASN 134 4.809 26.379 3.403 1097 2HD2 ASN 134 2HD2 ASN 134 5.431 25.638 4.834 1098 H VAL 135 H VAL 135 7.592 25.565 -1.107 1099 HA VAL 135 HA VAL 135 9.314 27.206 0.602 1100 HB VAL 135 HB VAL 135 10.443 26.022 -1.200 1101 1HG1 VAL 135 1HG1 VAL 135 8.453 27.439 -2.947 1102 2HG1 VAL 135 2HG1 VAL 135 8.786 25.711 -2.835 1103 3HG1 VAL 135 3HG1 VAL 135 9.967 26.791 -3.577 1104 1HG2 VAL 135 1HG2 VAL 135 11.452 28.090 -0.594 1105 2HG2 VAL 135 2HG2 VAL 135 10.288 29.011 -1.547 1106 3HG2 VAL 135 3HG2 VAL 135 11.484 27.997 -2.355 Start of MODEL 2 1 H MET 1 H MET 1 -51.785 -20.063 -24.591 2 HA MET 1 HA MET 1 -52.035 -21.044 -27.353 3 1HB MET 1 1HB MET 1 -54.043 -20.494 -25.483 4 2HB MET 1 2HB MET 1 -53.953 -19.049 -26.479 5 1HG MET 1 1HG MET 1 -55.238 -20.087 -27.948 6 2HG MET 1 2HG MET 1 -53.873 -21.145 -28.295 7 1HE MET 1 1HE MET 1 -57.545 -22.392 -28.077 8 2HE MET 1 2HE MET 1 -57.148 -20.713 -27.709 9 3HE MET 1 3HE MET 1 -57.777 -21.768 -26.443 10 H ASP 2 H ASP 2 -51.641 -18.301 -25.120 11 HA ASP 2 HA ASP 2 -50.538 -16.750 -27.369 12 1HB ASP 2 1HB ASP 2 -52.473 -16.069 -25.333 13 2HB ASP 2 2HB ASP 2 -51.094 -14.976 -25.266 14 H ASP 3 H ASP 3 -49.178 -14.802 -26.199 15 HA ASP 3 HA ASP 3 -46.927 -16.201 -25.024 16 1HB ASP 3 1HB ASP 3 -47.363 -13.507 -26.241 17 2HB ASP 3 2HB ASP 3 -46.002 -13.721 -25.144 18 H TYR 4 H TYR 4 -46.631 -16.365 -22.903 19 HA TYR 4 HA TYR 4 -47.960 -14.418 -21.139 20 1HB TYR 4 1HB TYR 4 -46.931 -17.154 -20.374 21 2HB TYR 4 2HB TYR 4 -47.975 -16.101 -19.425 22 HD1 TYR 4 HD1 TYR 4 -47.862 -18.806 -21.717 23 HD2 TYR 4 HD2 TYR 4 -50.297 -15.558 -20.443 24 HE1 TYR 4 HE1 TYR 4 -49.837 -19.921 -22.666 25 HE2 TYR 4 HE2 TYR 4 -52.279 -16.665 -21.389 26 HH TYR 4 HH TYR 4 -52.694 -18.405 -23.265 27 H GLU 5 H GLU 5 -46.496 -12.831 -20.773 28 HA GLU 5 HA GLU 5 -43.714 -13.529 -20.251 29 1HB GLU 5 1HB GLU 5 -45.127 -10.887 -20.607 30 2HB GLU 5 2HB GLU 5 -43.437 -11.008 -20.136 31 1HG GLU 5 1HG GLU 5 -42.764 -11.706 -22.193 32 2HG GLU 5 2HG GLU 5 -44.306 -12.479 -22.560 33 H LYS 6 H LYS 6 -42.819 -13.594 -18.292 34 HA LYS 6 HA LYS 6 -44.435 -12.666 -16.009 35 1HB LYS 6 1HB LYS 6 -42.465 -14.948 -16.211 36 2HB LYS 6 2HB LYS 6 -43.139 -14.377 -14.692 37 1HG LYS 6 1HG LYS 6 -45.077 -15.056 -16.810 38 2HG LYS 6 2HG LYS 6 -44.179 -16.396 -16.095 39 1HD LYS 6 1HD LYS 6 -45.314 -14.411 -14.220 40 2HD LYS 6 2HD LYS 6 -46.465 -15.445 -15.065 41 1HE LYS 6 1HE LYS 6 -46.055 -16.987 -13.512 42 2HE LYS 6 2HE LYS 6 -44.465 -17.182 -14.247 43 1HZ LYS 6 1HZ LYS 6 -44.945 -15.100 -12.212 44 2HZ LYS 6 2HZ LYS 6 -43.483 -15.815 -12.672 45 3HZ LYS 6 3HZ LYS 6 -44.601 -16.693 -11.755 46 H LEU 7 H LEU 7 -42.656 -12.674 -13.995 47 HA LEU 7 HA LEU 7 -40.457 -10.933 -14.883 48 1HB LEU 7 1HB LEU 7 -42.330 -10.484 -12.563 49 2HB LEU 7 2HB LEU 7 -40.830 -9.603 -12.786 50 HG LEU 7 HG LEU 7 -41.958 -9.118 -15.171 51 1HD1 LEU 7 1HD1 LEU 7 -44.420 -8.499 -14.251 52 2HD1 LEU 7 2HD1 LEU 7 -44.128 -10.018 -13.405 53 3HD1 LEU 7 3HD1 LEU 7 -44.043 -9.958 -15.165 54 1HD2 LEU 7 1HD2 LEU 7 -42.762 -6.981 -14.183 55 2HD2 LEU 7 2HD2 LEU 7 -41.115 -7.406 -13.718 56 3HD2 LEU 7 3HD2 LEU 7 -42.443 -7.651 -12.583 57 H LEU 8 H LEU 8 -39.439 -13.153 -14.682 58 HA LEU 8 HA LEU 8 -38.747 -13.780 -11.899 59 1HB LEU 8 1HB LEU 8 -39.473 -15.423 -14.003 60 2HB LEU 8 2HB LEU 8 -37.730 -15.597 -13.945 61 HG LEU 8 HG LEU 8 -38.060 -16.054 -11.428 62 1HD1 LEU 8 1HD1 LEU 8 -40.762 -15.632 -12.231 63 2HD1 LEU 8 2HD1 LEU 8 -40.123 -15.987 -10.627 64 3HD1 LEU 8 3HD1 LEU 8 -40.577 -17.305 -11.706 65 1HD2 LEU 8 1HD2 LEU 8 -39.012 -18.457 -12.221 66 2HD2 LEU 8 2HD2 LEU 8 -37.338 -17.940 -12.419 67 3HD2 LEU 8 3HD2 LEU 8 -38.471 -17.795 -13.763 68 H GLU 9 H GLU 9 -36.500 -14.319 -11.423 69 HA GLU 9 HA GLU 9 -34.674 -12.548 -12.883 70 1HB GLU 9 1HB GLU 9 -34.051 -13.883 -10.261 71 2HB GLU 9 2HB GLU 9 -33.373 -12.405 -10.928 72 1HG GLU 9 1HG GLU 9 -34.779 -11.300 -9.623 73 2HG GLU 9 2HG GLU 9 -36.070 -11.850 -10.690 74 H ARG 10 H ARG 10 -33.824 -13.685 -14.550 75 HA ARG 10 HA ARG 10 -32.788 -16.373 -13.987 76 1HB ARG 10 1HB ARG 10 -32.575 -16.465 -16.543 77 2HB ARG 10 2HB ARG 10 -34.189 -16.529 -15.852 78 1HG ARG 10 1HG ARG 10 -34.368 -14.064 -16.286 79 2HG ARG 10 2HG ARG 10 -32.852 -14.190 -17.184 80 1HD ARG 10 1HD ARG 10 -33.864 -15.097 -18.959 81 2HD ARG 10 2HD ARG 10 -34.797 -16.211 -17.960 82 HE ARG 10 HE ARG 10 -35.756 -13.861 -19.156 83 1HH1 ARG 10 1HH1 ARG 10 -35.922 -15.578 -16.122 84 2HH1 ARG 10 2HH1 ARG 10 -37.477 -14.942 -15.706 85 1HH2 ARG 10 1HH2 ARG 10 -37.804 -13.027 -18.608 86 2HH2 ARG 10 2HH2 ARG 10 -38.546 -13.497 -17.115 87 H ALA 11 H ALA 11 -30.714 -16.974 -14.854 88 HA ALA 11 HA ALA 11 -28.497 -16.709 -15.253 89 1HB ALA 11 1HB ALA 11 -29.372 -13.950 -16.060 90 2HB ALA 11 2HB ALA 11 -28.876 -15.289 -17.091 91 3HB ALA 11 3HB ALA 11 -27.686 -14.457 -16.092 92 H ILE 12 H ILE 12 -29.544 -16.501 -12.645 93 HA ILE 12 HA ILE 12 -27.750 -14.534 -11.391 94 HB ILE 12 HB ILE 12 -30.293 -15.820 -10.422 95 1HG1 ILE 12 1HG1 ILE 12 -30.775 -13.406 -9.839 96 2HG1 ILE 12 2HG1 ILE 12 -29.283 -12.984 -10.670 97 1HG2 ILE 12 1HG2 ILE 12 -28.269 -14.384 -8.708 98 2HG2 ILE 12 2HG2 ILE 12 -28.670 -16.099 -8.617 99 3HG2 ILE 12 3HG2 ILE 12 -29.879 -14.887 -8.199 100 1HD1 ILE 12 1HD1 ILE 12 -31.259 -12.650 -12.064 101 2HD1 ILE 12 2HD1 ILE 12 -31.638 -14.366 -11.925 102 3HD1 ILE 12 3HD1 ILE 12 -30.163 -13.852 -12.745 103 H ASP 13 H ASP 13 -25.849 -15.517 -11.157 104 HA ASP 13 HA ASP 13 -24.247 -16.828 -10.238 105 1HB ASP 13 1HB ASP 13 -26.580 -18.022 -8.736 106 2HB ASP 13 2HB ASP 13 -24.918 -18.553 -8.515 107 H GLN 14 H GLN 14 -27.111 -18.517 -11.473 108 HA GLN 14 HA GLN 14 -25.633 -20.891 -12.108 109 1HB GLN 14 1HB GLN 14 -28.429 -19.965 -12.740 110 2HB GLN 14 2HB GLN 14 -27.770 -21.457 -13.399 111 1HG GLN 14 1HG GLN 14 -28.704 -22.346 -11.558 112 2HG GLN 14 2HG GLN 14 -27.192 -21.832 -10.814 113 1HE2 GLN 14 1HE2 GLN 14 -30.567 -21.045 -11.272 114 2HE2 GLN 14 2HE2 GLN 14 -30.704 -19.984 -9.916 115 H LEU 15 H LEU 15 -27.372 -18.579 -14.243 116 HA LEU 15 HA LEU 15 -25.566 -19.357 -16.402 117 1HB LEU 15 1HB LEU 15 -27.878 -17.437 -16.604 118 2HB LEU 15 2HB LEU 15 -27.052 -18.258 -17.909 119 HG LEU 15 HG LEU 15 -28.118 -20.229 -16.132 120 1HD1 LEU 15 1HD1 LEU 15 -29.766 -18.753 -15.341 121 2HD1 LEU 15 2HD1 LEU 15 -30.552 -19.681 -16.618 122 3HD1 LEU 15 3HD1 LEU 15 -30.006 -18.034 -16.934 123 1HD2 LEU 15 1HD2 LEU 15 -28.720 -19.402 -18.966 124 2HD2 LEU 15 2HD2 LEU 15 -29.375 -20.850 -18.201 125 3HD2 LEU 15 3HD2 LEU 15 -27.632 -20.683 -18.428 126 HA PRO 16 HA PRO 16 -22.799 -15.949 -16.010 127 1HB PRO 16 1HB PRO 16 -22.496 -15.413 -18.738 128 2HB PRO 16 2HB PRO 16 -21.538 -16.555 -17.793 129 1HG PRO 16 1HG PRO 16 -23.881 -17.056 -19.569 130 2HG PRO 16 2HG PRO 16 -22.429 -18.043 -19.314 131 1HD PRO 16 1HD PRO 16 -24.772 -18.715 -18.211 132 2HD PRO 16 2HD PRO 16 -23.244 -18.949 -17.334 133 HA PRO 17 HA PRO 17 -24.976 -12.134 -16.240 134 1HB PRO 17 1HB PRO 17 -23.030 -10.448 -17.263 135 2HB PRO 17 2HB PRO 17 -23.181 -10.908 -15.565 136 1HG PRO 17 1HG PRO 17 -21.372 -12.002 -17.673 137 2HG PRO 17 2HG PRO 17 -21.045 -11.697 -15.958 138 1HD PRO 17 1HD PRO 17 -21.509 -14.174 -16.892 139 2HD PRO 17 2HD PRO 17 -22.065 -13.662 -15.284 140 H GLU 18 H GLU 18 -22.779 -11.773 -19.004 141 HA GLU 18 HA GLU 18 -23.137 -11.443 -21.221 142 1HB GLU 18 1HB GLU 18 -24.691 -13.542 -20.695 143 2HB GLU 18 2HB GLU 18 -25.954 -12.392 -21.108 144 1HG GLU 18 1HG GLU 18 -25.617 -12.964 -23.219 145 2HG GLU 18 2HG GLU 18 -24.109 -12.057 -23.124 146 H VAL 19 H VAL 19 -26.464 -10.942 -20.028 147 HA VAL 19 HA VAL 19 -26.569 -8.400 -21.405 148 HB VAL 19 HB VAL 19 -28.908 -8.308 -20.374 149 1HG1 VAL 19 1HG1 VAL 19 -27.999 -9.352 -22.684 150 2HG1 VAL 19 2HG1 VAL 19 -29.707 -9.272 -22.247 151 3HG1 VAL 19 3HG1 VAL 19 -28.801 -10.765 -21.995 152 1HG2 VAL 19 1HG2 VAL 19 -28.659 -11.245 -19.955 153 2HG2 VAL 19 2HG2 VAL 19 -29.793 -10.095 -19.248 154 3HG2 VAL 19 3HG2 VAL 19 -28.126 -10.157 -18.672 155 H PHE 20 H PHE 20 -27.640 -6.526 -20.183 156 HA PHE 20 HA PHE 20 -25.911 -5.803 -18.036 157 1HB PHE 20 1HB PHE 20 -27.028 -4.279 -19.811 158 2HB PHE 20 2HB PHE 20 -28.424 -4.309 -18.739 159 HD1 PHE 20 HD1 PHE 20 -28.564 -2.820 -16.970 160 HD2 PHE 20 HD2 PHE 20 -24.787 -3.551 -18.788 161 HE1 PHE 20 HE1 PHE 20 -27.571 -1.014 -15.625 162 HE2 PHE 20 HE2 PHE 20 -23.787 -1.747 -17.448 163 HZ PHE 20 HZ PHE 20 -25.180 -0.475 -15.864 164 H GLU 21 H GLU 21 -26.219 -7.140 -16.289 165 HA GLU 21 HA GLU 21 -28.676 -6.671 -14.775 166 1HB GLU 21 1HB GLU 21 -28.896 -9.053 -14.222 167 2HB GLU 21 2HB GLU 21 -29.066 -8.777 -15.950 168 1HG GLU 21 1HG GLU 21 -27.396 -10.153 -16.403 169 2HG GLU 21 2HG GLU 21 -26.321 -9.300 -15.299 170 H THR 22 H THR 22 -28.284 -6.296 -12.674 171 HA THR 22 HA THR 22 -25.563 -6.832 -11.706 172 HB THR 22 HB THR 22 -26.257 -4.465 -11.690 173 HG1 THR 22 HG1 THR 22 -26.100 -4.479 -9.119 174 1HG2 THR 22 1HG2 THR 22 -28.569 -4.440 -11.314 175 2HG2 THR 22 2HG2 THR 22 -27.849 -3.775 -9.849 176 3HG2 THR 22 3HG2 THR 22 -28.430 -5.438 -9.868 177 H LYS 23 H LYS 23 -25.294 -8.438 -10.355 178 HA LYS 23 HA LYS 23 -27.591 -9.642 -9.035 179 1HB LYS 23 1HB LYS 23 -24.946 -10.513 -9.899 180 2HB LYS 23 2HB LYS 23 -25.339 -11.077 -8.285 181 1HG LYS 23 1HG LYS 23 -27.365 -12.116 -9.105 182 2HG LYS 23 2HG LYS 23 -27.048 -11.494 -10.726 183 1HD LYS 23 1HD LYS 23 -24.904 -13.083 -9.435 184 2HD LYS 23 2HD LYS 23 -26.344 -13.952 -9.971 185 1HE LYS 23 1HE LYS 23 -24.979 -14.045 -11.841 186 2HE LYS 23 2HE LYS 23 -26.001 -12.652 -12.185 187 1HZ LYS 23 1HZ LYS 23 -23.649 -12.240 -12.657 188 2HZ LYS 23 2HZ LYS 23 -23.268 -12.513 -11.032 189 3HZ LYS 23 3HZ LYS 23 -24.239 -11.198 -11.464 190 H ARG 24 H ARG 24 -26.551 -10.728 -6.788 191 HA ARG 24 HA ARG 24 -26.187 -8.378 -5.098 192 1HB ARG 24 1HB ARG 24 -26.996 -11.223 -4.555 193 2HB ARG 24 2HB ARG 24 -26.531 -10.139 -3.250 194 1HG ARG 24 1HG ARG 24 -28.337 -8.675 -3.700 195 2HG ARG 24 2HG ARG 24 -28.697 -9.483 -5.227 196 1HD ARG 24 1HD ARG 24 -30.274 -10.083 -3.426 197 2HD ARG 24 2HD ARG 24 -29.392 -11.471 -4.058 198 HE ARG 24 HE ARG 24 -28.643 -10.121 -1.546 199 1HH1 ARG 24 1HH1 ARG 24 -29.274 -13.036 -3.375 200 2HH1 ARG 24 2HH1 ARG 24 -28.796 -14.088 -2.088 201 1HH2 ARG 24 1HH2 ARG 24 -28.017 -11.515 0.139 202 2HH2 ARG 24 2HH2 ARG 24 -28.085 -13.229 -0.099 203 H PHE 25 H PHE 25 -24.024 -9.522 -6.776 204 HA PHE 25 HA PHE 25 -22.162 -10.564 -4.785 205 1HB PHE 25 1HB PHE 25 -22.302 -10.550 -7.751 206 2HB PHE 25 2HB PHE 25 -20.693 -10.500 -7.038 207 HD1 PHE 25 HD1 PHE 25 -22.596 -12.679 -8.591 208 HD2 PHE 25 HD2 PHE 25 -20.955 -12.190 -4.695 209 HE1 PHE 25 HE1 PHE 25 -22.675 -15.116 -8.256 210 HE2 PHE 25 HE2 PHE 25 -21.030 -14.625 -4.353 211 HZ PHE 25 HZ PHE 25 -21.891 -16.091 -6.134 212 H GLU 26 H GLU 26 -21.925 -8.622 -3.579 213 HA GLU 26 HA GLU 26 -19.868 -6.890 -4.645 214 1HB GLU 26 1HB GLU 26 -21.992 -5.808 -5.352 215 2HB GLU 26 2HB GLU 26 -22.474 -5.711 -3.664 216 1HG GLU 26 1HG GLU 26 -21.146 -3.953 -3.247 217 2HG GLU 26 2HG GLU 26 -19.847 -4.554 -4.276 218 H VAL 27 H VAL 27 -18.391 -7.024 -3.099 219 HA VAL 27 HA VAL 27 -19.095 -6.331 -0.365 220 HB VAL 27 HB VAL 27 -17.643 -8.916 -0.938 221 1HG1 VAL 27 1HG1 VAL 27 -18.456 -9.169 1.576 222 2HG1 VAL 27 2HG1 VAL 27 -18.346 -7.410 1.515 223 3HG1 VAL 27 3HG1 VAL 27 -16.928 -8.395 1.155 224 1HG2 VAL 27 1HG2 VAL 27 -19.745 -9.971 -0.008 225 2HG2 VAL 27 2HG2 VAL 27 -19.871 -9.295 -1.633 226 3HG2 VAL 27 3HG2 VAL 27 -20.528 -8.411 -0.256 227 HA PRO 28 HA PRO 28 -15.270 -4.083 -0.801 228 1HB PRO 28 1HB PRO 28 -15.140 -4.517 2.147 229 2HB PRO 28 2HB PRO 28 -14.966 -3.022 1.221 230 1HG PRO 28 1HG PRO 28 -17.214 -3.527 2.543 231 2HG PRO 28 2HG PRO 28 -17.259 -2.776 0.937 232 1HD PRO 28 1HD PRO 28 -17.867 -5.587 1.735 233 2HD PRO 28 2HD PRO 28 -18.635 -4.574 0.496 234 H LYS 29 H LYS 29 -13.153 -4.599 -1.030 235 HA LYS 29 HA LYS 29 -11.753 -6.518 0.479 236 1HB LYS 29 1HB LYS 29 -13.375 -7.951 -0.923 237 2HB LYS 29 2HB LYS 29 -12.362 -7.518 -2.294 238 1HG LYS 29 1HG LYS 29 -10.436 -8.531 -1.226 239 2HG LYS 29 2HG LYS 29 -11.404 -8.908 0.200 240 1HD LYS 29 1HD LYS 29 -12.559 -10.589 -0.863 241 2HD LYS 29 2HD LYS 29 -12.321 -9.885 -2.463 242 1HE LYS 29 1HE LYS 29 -10.017 -10.969 -0.879 243 2HE LYS 29 2HE LYS 29 -11.029 -12.028 -1.859 244 1HZ LYS 29 1HZ LYS 29 -10.502 -10.661 -3.792 245 2HZ LYS 29 2HZ LYS 29 -9.101 -11.300 -3.095 246 3HZ LYS 29 3HZ LYS 29 -9.505 -9.677 -2.844 247 H ALA 30 H ALA 30 -10.907 -4.124 0.005 248 HA ALA 30 HA ALA 30 -8.777 -4.465 -1.985 249 1HB ALA 30 1HB ALA 30 -9.364 -2.709 -3.226 250 2HB ALA 30 2HB ALA 30 -9.653 -1.701 -1.809 251 3HB ALA 30 3HB ALA 30 -10.921 -2.773 -2.402 252 H TYR 31 H TYR 31 -9.748 -1.801 0.165 253 HA TYR 31 HA TYR 31 -7.041 -1.764 1.261 254 1HB TYR 31 1HB TYR 31 -7.773 0.425 2.255 255 2HB TYR 31 2HB TYR 31 -7.830 0.372 0.498 256 HD1 TYR 31 HD1 TYR 31 -9.967 0.392 -0.682 257 HD2 TYR 31 HD2 TYR 31 -9.808 0.556 3.567 258 HE1 TYR 31 HE1 TYR 31 -12.319 1.107 -0.627 259 HE2 TYR 31 HE2 TYR 31 -12.160 1.269 3.634 260 HH TYR 31 HH TYR 31 -13.781 2.499 1.139 261 H SER 32 H SER 32 -7.508 -0.629 3.749 262 HA SER 32 HA SER 32 -8.010 -2.899 5.329 263 1HB SER 32 1HB SER 32 -8.211 -0.126 6.450 264 2HB SER 32 2HB SER 32 -7.471 -1.564 7.156 265 HG SER 32 HG SER 32 -5.733 -1.322 5.836 266 H VAL 33 H VAL 33 -9.567 -2.400 7.399 267 HA VAL 33 HA VAL 33 -12.175 -1.530 6.405 268 HB VAL 33 HB VAL 33 -12.590 -3.861 8.029 269 1HG1 VAL 33 1HG1 VAL 33 -14.100 -4.451 6.326 270 2HG1 VAL 33 2HG1 VAL 33 -13.221 -3.519 5.113 271 3HG1 VAL 33 3HG1 VAL 33 -14.114 -2.689 6.387 272 1HG2 VAL 33 1HG2 VAL 33 -10.284 -4.235 6.585 273 2HG2 VAL 33 2HG2 VAL 33 -11.521 -4.881 5.508 274 3HG2 VAL 33 3HG2 VAL 33 -11.362 -5.510 7.146 275 H ILE 34 H ILE 34 -13.604 -0.808 7.956 276 HA ILE 34 HA ILE 34 -12.395 -0.160 10.533 277 HB ILE 34 HB ILE 34 -15.009 0.844 9.416 278 1HG1 ILE 34 1HG1 ILE 34 -12.493 2.444 9.344 279 2HG1 ILE 34 2HG1 ILE 34 -12.775 1.260 8.077 280 1HG2 ILE 34 1HG2 ILE 34 -15.074 1.440 11.617 281 2HG2 ILE 34 2HG2 ILE 34 -14.178 2.814 10.968 282 3HG2 ILE 34 3HG2 ILE 34 -13.318 1.498 11.768 283 1HD1 ILE 34 1HD1 ILE 34 -15.107 2.892 8.501 284 2HD1 ILE 34 2HD1 ILE 34 -14.174 2.617 7.030 285 3HD1 ILE 34 3HD1 ILE 34 -13.684 3.879 8.162 286 H GLN 35 H GLN 35 -13.707 -0.264 12.497 287 HA GLN 35 HA GLN 35 -16.101 -1.739 12.668 288 1HB GLN 35 1HB GLN 35 -13.803 -3.359 12.427 289 2HB GLN 35 2HB GLN 35 -14.286 -3.441 14.115 290 1HG GLN 35 1HG GLN 35 -15.966 -4.797 13.635 291 2HG GLN 35 2HG GLN 35 -16.590 -3.676 12.427 292 1HE2 GLN 35 1HE2 GLN 35 -13.509 -5.391 12.485 293 2HE2 GLN 35 2HE2 GLN 35 -13.775 -6.289 11.034 294 H GLY 36 H GLY 36 -16.803 -0.191 14.070 295 1HA GLY 36 1HA GLY 36 -17.172 0.734 16.146 296 2HA GLY 36 2HA GLY 36 -16.060 -0.455 16.808 297 H ASN 37 H ASN 37 -13.701 0.004 16.413 298 HA ASN 37 HA ASN 37 -12.938 2.713 15.875 299 1HB ASN 37 1HB ASN 37 -13.868 2.485 18.357 300 2HB ASN 37 2HB ASN 37 -12.234 1.900 18.657 301 1HD2 ASN 37 1HD2 ASN 37 -11.116 3.476 19.547 302 2HD2 ASN 37 2HD2 ASN 37 -11.080 5.121 19.021 303 H ARG 38 H ARG 38 -12.278 -0.080 15.099 304 HA ARG 38 HA ARG 38 -9.372 0.167 15.410 305 1HB ARG 38 1HB ARG 38 -10.300 -2.622 15.388 306 2HB ARG 38 2HB ARG 38 -9.056 -1.861 16.363 307 1HG ARG 38 1HG ARG 38 -10.502 -2.412 18.008 308 2HG ARG 38 2HG ARG 38 -11.167 -0.832 17.591 309 1HD ARG 38 1HD ARG 38 -13.087 -2.044 17.513 310 2HD ARG 38 2HD ARG 38 -12.534 -2.306 15.861 311 HE ARG 38 HE ARG 38 -12.358 -4.512 16.347 312 1HH1 ARG 38 1HH1 ARG 38 -12.141 -2.742 19.348 313 2HH1 ARG 38 2HH1 ARG 38 -12.047 -4.167 20.325 314 1HH2 ARG 38 1HH2 ARG 38 -12.232 -6.386 17.629 315 2HH2 ARG 38 2HH2 ARG 38 -12.097 -6.238 19.349 316 H THR 39 H THR 39 -8.157 -0.861 13.707 317 HA THR 39 HA THR 39 -9.750 -1.167 11.255 318 HB THR 39 HB THR 39 -7.473 0.377 11.797 319 HG1 THR 39 HG1 THR 39 -8.257 -0.276 9.177 320 1HG2 THR 39 1HG2 THR 39 -5.732 -0.321 10.408 321 2HG2 THR 39 2HG2 THR 39 -6.697 -1.613 9.695 322 3HG2 THR 39 3HG2 THR 39 -6.142 -1.743 11.364 323 H PHE 40 H PHE 40 -9.926 -3.082 10.329 324 HA PHE 40 HA PHE 40 -8.343 -5.304 11.379 325 1HB PHE 40 1HB PHE 40 -10.970 -5.044 9.995 326 2HB PHE 40 2HB PHE 40 -10.084 -6.555 9.817 327 HD1 PHE 40 HD1 PHE 40 -10.326 -4.310 12.765 328 HD2 PHE 40 HD2 PHE 40 -11.286 -8.080 11.048 329 HE1 PHE 40 HE1 PHE 40 -11.195 -5.072 14.935 330 HE2 PHE 40 HE2 PHE 40 -12.159 -8.852 13.213 331 HZ PHE 40 HZ PHE 40 -12.116 -7.346 15.161 332 H ILE 41 H ILE 41 -6.394 -4.757 10.239 333 HA ILE 41 HA ILE 41 -6.349 -4.615 7.398 334 HB ILE 41 HB ILE 41 -4.393 -4.395 9.528 335 1HG1 ILE 41 1HG1 ILE 41 -3.860 -3.526 6.740 336 2HG1 ILE 41 2HG1 ILE 41 -5.290 -2.862 7.522 337 1HG2 ILE 41 1HG2 ILE 41 -3.583 -6.545 8.545 338 2HG2 ILE 41 2HG2 ILE 41 -2.440 -5.215 8.396 339 3HG2 ILE 41 3HG2 ILE 41 -3.400 -5.710 7.003 340 1HD1 ILE 41 1HD1 ILE 41 -2.416 -2.501 8.230 341 2HD1 ILE 41 2HD1 ILE 41 -3.665 -2.297 9.459 342 3HD1 ILE 41 3HD1 ILE 41 -3.681 -1.291 8.010 343 H GLN 42 H GLN 42 -6.534 -6.186 6.005 344 HA GLN 42 HA GLN 42 -6.040 -8.950 6.880 345 1HB GLN 42 1HB GLN 42 -7.752 -7.886 4.630 346 2HB GLN 42 2HB GLN 42 -7.521 -9.589 5.001 347 1HG GLN 42 1HG GLN 42 -8.359 -8.855 7.373 348 2HG GLN 42 2HG GLN 42 -9.066 -7.520 6.464 349 1HE2 GLN 42 1HE2 GLN 42 -11.024 -7.836 5.745 350 2HE2 GLN 42 2HE2 GLN 42 -11.762 -9.362 5.417 351 H ASN 43 H ASN 43 -5.506 -6.640 4.269 352 HA ASN 43 HA ASN 43 -3.492 -8.456 3.122 353 1HB ASN 43 1HB ASN 43 -4.819 -6.106 1.766 354 2HB ASN 43 2HB ASN 43 -3.812 -7.339 1.014 355 1HD2 ASN 43 1HD2 ASN 43 -6.846 -6.815 2.716 356 2HD2 ASN 43 2HD2 ASN 43 -7.697 -8.127 1.983 357 H PHE 44 H PHE 44 -2.562 -7.222 5.289 358 HA PHE 44 HA PHE 44 -1.596 -4.681 5.266 359 1HB PHE 44 1HB PHE 44 -1.255 -6.487 7.036 360 2HB PHE 44 2HB PHE 44 0.136 -7.011 6.089 361 HD1 PHE 44 HD1 PHE 44 2.173 -6.250 6.832 362 HD2 PHE 44 HD2 PHE 44 -1.268 -3.804 7.357 363 HE1 PHE 44 HE1 PHE 44 3.558 -4.544 7.941 364 HE2 PHE 44 HE2 PHE 44 0.107 -2.094 8.465 365 HZ PHE 44 HZ PHE 44 2.525 -2.461 8.757 366 H ARG 45 H ARG 45 -0.543 -7.311 3.245 367 HA ARG 45 HA ARG 45 1.934 -6.138 2.453 368 1HB ARG 45 1HB ARG 45 1.029 -8.613 2.283 369 2HB ARG 45 2HB ARG 45 0.485 -8.066 0.704 370 1HG ARG 45 1HG ARG 45 2.507 -8.422 -0.103 371 2HG ARG 45 2HG ARG 45 3.150 -7.202 0.999 372 1HD ARG 45 1HD ARG 45 2.834 -9.357 2.649 373 2HD ARG 45 2HD ARG 45 3.295 -10.118 1.128 374 HE ARG 45 HE ARG 45 4.893 -7.980 2.378 375 1HH1 ARG 45 1HH1 ARG 45 4.655 -11.117 0.852 376 2HH1 ARG 45 2HH1 ARG 45 6.369 -11.342 0.779 377 1HH2 ARG 45 1HH2 ARG 45 7.140 -8.285 2.280 378 2HH2 ARG 45 2HH2 ARG 45 7.777 -9.740 1.587 379 H GLU 46 H GLU 46 -1.172 -6.542 0.735 380 HA GLU 46 HA GLU 46 -0.378 -4.866 -1.429 381 1HB GLU 46 1HB GLU 46 -2.076 -6.666 -1.635 382 2HB GLU 46 2HB GLU 46 -3.160 -5.703 -0.645 383 1HG GLU 46 1HG GLU 46 -3.906 -4.718 -2.475 384 2HG GLU 46 2HG GLU 46 -2.305 -4.021 -2.718 385 H VAL 47 H VAL 47 -2.321 -4.404 1.473 386 HA VAL 47 HA VAL 47 -3.219 -1.796 0.865 387 HB VAL 47 HB VAL 47 -2.791 -3.016 3.600 388 1HG1 VAL 47 1HG1 VAL 47 -4.157 -1.356 4.488 389 2HG1 VAL 47 2HG1 VAL 47 -4.811 -0.911 2.912 390 3HG1 VAL 47 3HG1 VAL 47 -3.157 -0.471 3.335 391 1HG2 VAL 47 1HG2 VAL 47 -5.349 -2.939 2.021 392 2HG2 VAL 47 2HG2 VAL 47 -5.011 -3.822 3.511 393 3HG2 VAL 47 3HG2 VAL 47 -4.246 -4.315 1.999 394 H ALA 48 H ALA 48 -0.368 -3.007 2.588 395 HA ALA 48 HA ALA 48 0.543 -0.508 3.484 396 1HB ALA 48 1HB ALA 48 2.806 -1.694 3.580 397 2HB ALA 48 2HB ALA 48 1.938 -3.121 3.021 398 3HB ALA 48 3HB ALA 48 1.490 -2.359 4.547 399 H ASP 49 H ASP 49 1.353 -2.364 0.593 400 HA ASP 49 HA ASP 49 3.277 -0.617 -0.458 401 1HB ASP 49 1HB ASP 49 2.431 -2.981 -1.278 402 2HB ASP 49 2HB ASP 49 1.393 -2.014 -2.319 403 H ALA 50 H ALA 50 -0.087 -0.861 -1.652 404 HA ALA 50 HA ALA 50 -0.114 1.469 -3.097 405 1HB ALA 50 1HB ALA 50 -2.700 1.112 -1.932 406 2HB ALA 50 2HB ALA 50 -2.004 -0.458 -2.332 407 3HB ALA 50 3HB ALA 50 -2.158 0.782 -3.575 408 H LEU 51 H LEU 51 -1.091 1.126 0.328 409 HA LEU 51 HA LEU 51 -1.807 3.825 0.667 410 1HB LEU 51 1HB LEU 51 -2.678 2.502 2.339 411 2HB LEU 51 2HB LEU 51 -1.230 1.529 2.468 412 HG LEU 51 HG LEU 51 -0.116 3.247 3.737 413 1HD1 LEU 51 1HD1 LEU 51 -0.669 5.364 3.412 414 2HD1 LEU 51 2HD1 LEU 51 -2.137 5.079 4.347 415 3HD1 LEU 51 3HD1 LEU 51 -2.154 4.888 2.596 416 1HD2 LEU 51 1HD2 LEU 51 -2.494 3.437 5.321 417 2HD2 LEU 51 2HD2 LEU 51 -1.061 2.449 5.589 418 3HD2 LEU 51 3HD2 LEU 51 -2.389 1.829 4.609 419 H ASN 52 H ASN 52 1.257 2.176 0.727 420 HA ASN 52 HA ASN 52 2.727 4.558 0.539 421 1HB ASN 52 1HB ASN 52 1.974 3.912 3.202 422 2HB ASN 52 2HB ASN 52 3.701 3.603 3.056 423 1HD2 ASN 52 1HD2 ASN 52 2.286 5.656 4.553 424 2HD2 ASN 52 2HD2 ASN 52 2.898 7.169 3.986 425 H ARG 53 H ARG 53 3.842 3.534 -1.029 426 HA ARG 53 HA ARG 53 4.760 1.073 -1.402 427 1HB ARG 53 1HB ARG 53 5.264 3.146 -2.772 428 2HB ARG 53 2HB ARG 53 6.631 3.420 -1.702 429 1HG ARG 53 1HG ARG 53 7.879 1.909 -2.747 430 2HG ARG 53 2HG ARG 53 6.581 0.716 -2.745 431 1HD ARG 53 1HD ARG 53 5.714 2.543 -4.600 432 2HD ARG 53 2HD ARG 53 7.457 2.538 -4.850 433 HE ARG 53 HE ARG 53 5.642 0.493 -5.583 434 1HH1 ARG 53 1HH1 ARG 53 8.875 1.014 -4.377 435 2HH1 ARG 53 2HH1 ARG 53 9.500 -0.454 -5.052 436 1HH2 ARG 53 1HH2 ARG 53 6.460 -1.437 -6.477 437 2HH2 ARG 53 2HH2 ARG 53 8.127 -1.846 -6.246 438 H ASP 54 H ASP 54 6.199 3.345 0.890 439 HA ASP 54 HA ASP 54 8.225 1.434 1.690 440 1HB ASP 54 1HB ASP 54 7.816 4.276 1.962 441 2HB ASP 54 2HB ASP 54 8.158 3.565 3.537 442 HA PRO 55 HA PRO 55 5.699 -0.411 4.828 443 1HB PRO 55 1HB PRO 55 7.617 -1.635 6.287 444 2HB PRO 55 2HB PRO 55 7.142 -2.200 4.681 445 1HG PRO 55 1HG PRO 55 9.486 -0.512 5.474 446 2HG PRO 55 2HG PRO 55 9.428 -1.889 4.356 447 1HD PRO 55 1HD PRO 55 9.420 0.690 3.511 448 2HD PRO 55 2HD PRO 55 8.596 -0.612 2.629 449 H GLN 56 H GLN 56 8.639 1.275 5.955 450 HA GLN 56 HA GLN 56 7.748 1.665 8.588 451 1HB GLN 56 1HB GLN 56 9.939 2.694 6.913 452 2HB GLN 56 2HB GLN 56 9.430 3.776 8.203 453 1HG GLN 56 1HG GLN 56 9.966 0.905 8.804 454 2HG GLN 56 2HG GLN 56 11.306 2.038 8.630 455 1HE2 GLN 56 1HE2 GLN 56 8.125 1.903 10.216 456 2HE2 GLN 56 2HE2 GLN 56 8.652 2.584 11.713 457 H HIS 57 H HIS 57 7.311 3.572 5.663 458 HA HIS 57 HA HIS 57 6.317 5.908 6.840 459 1HB HIS 57 1HB HIS 57 6.778 5.038 4.258 460 2HB HIS 57 2HB HIS 57 5.030 5.210 4.306 461 HD2 HIS 57 HD2 HIS 57 8.173 7.379 4.013 462 HE1 HIS 57 HE1 HIS 57 4.869 10.003 4.453 463 HE2 HIS 57 HE2 HIS 57 7.286 9.797 3.778 464 H LEU 58 H LEU 58 4.880 2.808 6.381 465 HA LEU 58 HA LEU 58 2.161 3.706 6.735 466 1HB LEU 58 1HB LEU 58 3.461 1.336 5.880 467 2HB LEU 58 2HB LEU 58 2.515 0.910 7.292 468 HG LEU 58 HG LEU 58 0.750 2.410 5.774 469 1HD1 LEU 58 1HD1 LEU 58 0.849 1.680 3.531 470 2HD1 LEU 58 2HD1 LEU 58 2.103 0.492 3.903 471 3HD1 LEU 58 3HD1 LEU 58 2.485 2.207 3.935 472 1HD2 LEU 58 1HD2 LEU 58 -0.497 0.449 5.669 473 2HD2 LEU 58 2HD2 LEU 58 0.542 0.184 7.070 474 3HD2 LEU 58 3HD2 LEU 58 0.937 -0.568 5.523 475 H LEU 59 H LEU 59 4.700 2.239 8.668 476 HA LEU 59 HA LEU 59 3.095 1.819 10.981 477 1HB LEU 59 1HB LEU 59 6.093 1.970 10.666 478 2HB LEU 59 2HB LEU 59 5.265 1.430 12.117 479 HG LEU 59 HG LEU 59 4.698 0.061 9.521 480 1HD1 LEU 59 1HD1 LEU 59 6.997 -0.718 11.293 481 2HD1 LEU 59 2HD1 LEU 59 7.189 0.231 9.819 482 3HD1 LEU 59 3HD1 LEU 59 6.538 -1.404 9.736 483 1HD2 LEU 59 1HD2 LEU 59 3.595 -0.256 11.908 484 2HD2 LEU 59 2HD2 LEU 59 4.994 -1.305 12.137 485 3HD2 LEU 59 3HD2 LEU 59 3.868 -1.613 10.816 486 H LYS 60 H LYS 60 5.053 4.454 9.805 487 HA LYS 60 HA LYS 60 5.077 5.908 12.259 488 1HB LYS 60 1HB LYS 60 6.104 6.242 9.572 489 2HB LYS 60 2HB LYS 60 5.397 7.740 10.161 490 1HG LYS 60 1HG LYS 60 7.508 6.131 11.585 491 2HG LYS 60 2HG LYS 60 7.792 7.592 10.637 492 1HD LYS 60 1HD LYS 60 5.759 7.761 12.783 493 2HD LYS 60 2HD LYS 60 7.443 7.623 13.290 494 1HE LYS 60 1HE LYS 60 8.004 9.551 11.863 495 2HE LYS 60 2HE LYS 60 6.303 9.700 11.423 496 1HZ LYS 60 1HZ LYS 60 6.907 9.673 14.270 497 2HZ LYS 60 2HZ LYS 60 5.773 10.588 13.412 498 3HZ LYS 60 3HZ LYS 60 7.400 11.048 13.416 499 H PHE 61 H PHE 61 3.271 6.350 9.203 500 HA PHE 61 HA PHE 61 1.617 8.420 10.133 501 1HB PHE 61 1HB PHE 61 1.743 6.679 7.792 502 2HB PHE 61 2HB PHE 61 0.094 7.115 8.230 503 HD1 PHE 61 HD1 PHE 61 3.168 8.222 6.747 504 HD2 PHE 61 HD2 PHE 61 -0.504 9.532 8.449 505 HE1 PHE 61 HE1 PHE 61 3.469 10.426 5.695 506 HE2 PHE 61 HE2 PHE 61 -0.212 11.737 7.399 507 HZ PHE 61 HZ PHE 61 1.778 12.186 6.019 508 H LEU 62 H LEU 62 1.222 4.928 10.178 509 HA LEU 62 HA LEU 62 -1.421 4.747 11.005 510 1HB LEU 62 1HB LEU 62 -0.279 2.815 10.245 511 2HB LEU 62 2HB LEU 62 0.999 3.015 11.422 512 HG LEU 62 HG LEU 62 -1.773 2.446 12.387 513 1HD1 LEU 62 1HD1 LEU 62 0.122 0.505 11.096 514 2HD1 LEU 62 2HD1 LEU 62 -1.594 0.740 10.770 515 3HD1 LEU 62 3HD1 LEU 62 -1.077 -0.004 12.283 516 1HD2 LEU 62 1HD2 LEU 62 0.333 1.011 13.660 517 2HD2 LEU 62 2HD2 LEU 62 -0.690 2.285 14.321 518 3HD2 LEU 62 3HD2 LEU 62 0.813 2.697 13.500 519 H LEU 63 H LEU 63 1.507 4.653 13.077 520 HA LEU 63 HA LEU 63 0.014 4.775 15.491 521 1HB LEU 63 1HB LEU 63 2.923 5.309 14.909 522 2HB LEU 63 2HB LEU 63 2.243 5.312 16.526 523 HG LEU 63 HG LEU 63 1.842 2.897 14.830 524 1HD1 LEU 63 1HD1 LEU 63 4.127 2.330 16.249 525 2HD1 LEU 63 2HD1 LEU 63 4.430 3.942 15.602 526 3HD1 LEU 63 3HD1 LEU 63 4.019 2.618 14.513 527 1HD2 LEU 63 1HD2 LEU 63 0.745 2.729 16.870 528 2HD2 LEU 63 2HD2 LEU 63 2.052 3.524 17.748 529 3HD2 LEU 63 3HD2 LEU 63 2.262 1.877 17.154 530 H ARG 64 H ARG 64 1.390 7.193 13.384 531 HA ARG 64 HA ARG 64 1.308 9.402 15.132 532 1HB ARG 64 1HB ARG 64 2.165 9.106 12.594 533 2HB ARG 64 2HB ARG 64 0.628 9.900 12.286 534 1HG ARG 64 1HG ARG 64 2.598 11.018 14.249 535 2HG ARG 64 2HG ARG 64 2.712 11.359 12.523 536 1HD ARG 64 1HD ARG 64 0.687 12.506 12.488 537 2HD ARG 64 2HD ARG 64 0.138 11.776 13.991 538 HE ARG 64 HE ARG 64 1.826 14.100 13.695 539 1HH1 ARG 64 1HH1 ARG 64 0.713 11.583 15.848 540 2HH1 ARG 64 2HH1 ARG 64 1.061 12.487 17.283 541 1HH2 ARG 64 1HH2 ARG 64 2.276 15.290 15.581 542 2HH2 ARG 64 2HH2 ARG 64 1.948 14.591 17.133 543 H GLU 65 H GLU 65 -1.156 7.936 13.085 544 HA GLU 65 HA GLU 65 -3.108 9.942 13.902 545 1HB GLU 65 1HB GLU 65 -2.737 8.387 11.581 546 2HB GLU 65 2HB GLU 65 -4.239 7.834 12.307 547 1HG GLU 65 1HG GLU 65 -4.841 10.325 12.460 548 2HG GLU 65 2HG GLU 65 -3.526 10.564 11.310 549 H LEU 66 H LEU 66 -2.237 6.643 14.603 550 HA LEU 66 HA LEU 66 -4.691 5.747 15.658 551 1HB LEU 66 1HB LEU 66 -1.951 4.829 15.592 552 2HB LEU 66 2HB LEU 66 -2.668 4.523 17.164 553 HG LEU 66 HG LEU 66 -4.479 3.280 16.133 554 1HD1 LEU 66 1HD1 LEU 66 -4.825 4.342 14.063 555 2HD1 LEU 66 2HD1 LEU 66 -4.255 2.727 13.666 556 3HD1 LEU 66 3HD1 LEU 66 -3.154 4.092 13.565 557 1HD2 LEU 66 1HD2 LEU 66 -1.743 2.515 16.134 558 2HD2 LEU 66 2HD2 LEU 66 -2.539 1.770 14.749 559 3HD2 LEU 66 3HD2 LEU 66 -3.176 1.517 16.374 560 H GLY 67 H GLY 67 -5.765 6.967 17.107 561 1HA GLY 67 1HA GLY 67 -4.413 8.435 19.181 562 2HA GLY 67 2HA GLY 67 -6.151 8.294 18.966 563 H THR 68 H THR 68 -5.154 5.208 18.885 564 HA THR 68 HA THR 68 -5.325 4.875 21.804 565 HB THR 68 HB THR 68 -7.056 3.479 21.598 566 HG1 THR 68 HG1 THR 68 -5.564 2.153 19.598 567 1HG2 THR 68 1HG2 THR 68 -7.967 3.088 19.161 568 2HG2 THR 68 2HG2 THR 68 -6.919 4.459 18.812 569 3HG2 THR 68 3HG2 THR 68 -8.198 4.617 20.009 570 H ALA 69 H ALA 69 -4.492 2.665 22.484 571 HA ALA 69 HA ALA 69 -1.840 2.447 22.358 572 1HB ALA 69 1HB ALA 69 -3.301 1.039 23.747 573 2HB ALA 69 2HB ALA 69 -2.009 0.121 22.975 574 3HB ALA 69 3HB ALA 69 -3.651 0.039 22.336 575 H GLY 70 H GLY 70 -3.750 0.233 20.306 576 1HA GLY 70 1HA GLY 70 -3.409 -0.203 18.023 577 2HA GLY 70 2HA GLY 70 -1.936 0.751 18.085 578 H ASN 71 H ASN 71 -3.103 -2.295 17.724 579 HA ASN 71 HA ASN 71 -0.511 -3.483 17.912 580 1HB ASN 71 1HB ASN 71 -1.895 -3.484 20.299 581 2HB ASN 71 2HB ASN 71 -2.294 -5.059 19.623 582 1HD2 ASN 71 1HD2 ASN 71 -0.941 -6.636 20.044 583 2HD2 ASN 71 2HD2 ASN 71 0.714 -6.465 20.510 584 H LEU 72 H LEU 72 -0.608 -5.863 17.338 585 HA LEU 72 HA LEU 72 -2.626 -6.195 15.268 586 1HB LEU 72 1HB LEU 72 -0.357 -8.073 15.887 587 2HB LEU 72 2HB LEU 72 -1.269 -7.944 14.395 588 HG LEU 72 HG LEU 72 0.747 -6.935 13.852 589 1HD1 LEU 72 1HD1 LEU 72 0.303 -4.637 13.486 590 2HD1 LEU 72 2HD1 LEU 72 -0.796 -4.559 14.862 591 3HD1 LEU 72 3HD1 LEU 72 -1.251 -5.469 13.421 592 1HD2 LEU 72 1HD2 LEU 72 1.004 -5.071 16.097 593 2HD2 LEU 72 2HD2 LEU 72 2.220 -6.070 15.301 594 3HD2 LEU 72 3HD2 LEU 72 1.170 -6.772 16.532 595 H GLU 73 H GLU 73 -4.483 -7.140 15.752 596 HA GLU 73 HA GLU 73 -4.566 -9.163 17.885 597 1HB GLU 73 1HB GLU 73 -6.329 -7.023 17.098 598 2HB GLU 73 2HB GLU 73 -7.187 -8.552 17.027 599 1HG GLU 73 1HG GLU 73 -7.479 -7.500 19.178 600 2HG GLU 73 2HG GLU 73 -6.582 -9.008 19.342 601 H GLY 74 H GLY 74 -5.889 -11.081 17.553 602 1HA GLY 74 1HA GLY 74 -6.449 -12.964 16.361 603 2HA GLY 74 2HA GLY 74 -7.025 -11.851 15.129 604 H GLY 75 H GLY 75 -6.171 -14.023 14.053 605 1HA GLY 75 1HA GLY 75 -3.440 -14.449 13.665 606 2HA GLY 75 2HA GLY 75 -4.700 -14.904 12.530 607 H ARG 76 H ARG 76 -5.559 -12.074 12.258 608 HA ARG 76 HA ARG 76 -3.578 -11.316 10.255 609 1HB ARG 76 1HB ARG 76 -6.121 -9.797 10.739 610 2HB ARG 76 2HB ARG 76 -5.242 -10.034 9.237 611 1HG ARG 76 1HG ARG 76 -6.471 -12.407 10.544 612 2HG ARG 76 2HG ARG 76 -7.517 -11.260 9.705 613 1HD ARG 76 1HD ARG 76 -6.183 -11.519 7.678 614 2HD ARG 76 2HD ARG 76 -5.121 -12.651 8.513 615 HE ARG 76 HE ARG 76 -7.866 -13.147 7.635 616 1HH1 ARG 76 1HH1 ARG 76 -4.976 -14.331 9.210 617 2HH1 ARG 76 2HH1 ARG 76 -5.473 -15.987 9.141 618 1HH2 ARG 76 1HH2 ARG 76 -8.518 -15.323 7.561 619 2HH2 ARG 76 2HH2 ARG 76 -7.483 -16.551 8.209 620 H ALA 77 H ALA 77 -4.310 -8.471 10.341 621 HA ALA 77 HA ALA 77 -2.842 -7.737 12.792 622 1HB ALA 77 1HB ALA 77 -1.387 -6.669 11.501 623 2HB ALA 77 2HB ALA 77 -2.681 -5.637 10.892 624 3HB ALA 77 3HB ALA 77 -2.293 -7.145 10.065 625 H ILE 78 H ILE 78 -4.900 -7.621 13.913 626 HA ILE 78 HA ILE 78 -6.692 -5.474 13.083 627 HB ILE 78 HB ILE 78 -6.921 -7.684 15.105 628 1HG1 ILE 78 1HG1 ILE 78 -9.222 -7.656 13.706 629 2HG1 ILE 78 2HG1 ILE 78 -8.151 -6.920 12.522 630 1HG2 ILE 78 1HG2 ILE 78 -7.769 -5.710 16.263 631 2HG2 ILE 78 2HG2 ILE 78 -9.091 -6.784 15.819 632 3HG2 ILE 78 3HG2 ILE 78 -8.792 -5.325 14.880 633 1HD1 ILE 78 1HD1 ILE 78 -7.271 -8.879 12.005 634 2HD1 ILE 78 2HD1 ILE 78 -8.521 -9.622 13.003 635 3HD1 ILE 78 3HD1 ILE 78 -6.945 -9.251 13.696 636 H LEU 79 H LEU 79 -5.567 -3.614 13.536 637 HA LEU 79 HA LEU 79 -4.589 -3.192 16.252 638 1HB LEU 79 1HB LEU 79 -3.563 -1.193 15.431 639 2HB LEU 79 2HB LEU 79 -3.214 -2.499 14.311 640 HG LEU 79 HG LEU 79 -5.500 -1.410 13.244 641 1HD1 LEU 79 1HD1 LEU 79 -3.920 1.022 13.631 642 2HD1 LEU 79 2HD1 LEU 79 -4.780 0.465 15.066 643 3HD1 LEU 79 3HD1 LEU 79 -5.667 0.796 13.578 644 1HD2 LEU 79 1HD2 LEU 79 -4.182 -1.318 11.455 645 2HD2 LEU 79 2HD2 LEU 79 -2.866 -1.853 12.500 646 3HD2 LEU 79 3HD2 LEU 79 -3.116 -0.134 12.210 647 H GLN 80 H GLN 80 -4.984 -0.700 16.908 648 HA GLN 80 HA GLN 80 -7.830 -0.084 16.552 649 1HB GLN 80 1HB GLN 80 -6.787 -1.269 18.862 650 2HB GLN 80 2HB GLN 80 -6.964 0.430 19.270 651 1HG GLN 80 1HG GLN 80 -9.334 -0.149 18.014 652 2HG GLN 80 2HG GLN 80 -8.981 -1.624 18.913 653 1HE2 GLN 80 1HE2 GLN 80 -9.485 1.831 19.172 654 2HE2 GLN 80 2HE2 GLN 80 -9.904 1.837 20.848 655 H GLY 81 H GLY 81 -7.967 1.935 15.844 656 1HA GLY 81 1HA GLY 81 -6.666 4.090 17.210 657 2HA GLY 81 2HA GLY 81 -5.959 3.775 15.641 658 H LYS 82 H LYS 82 -6.928 4.466 13.847 659 HA LYS 82 HA LYS 82 -9.675 5.159 13.721 660 1HB LYS 82 1HB LYS 82 -9.153 7.640 13.259 661 2HB LYS 82 2HB LYS 82 -9.239 7.099 14.928 662 1HG LYS 82 1HG LYS 82 -7.270 8.079 15.212 663 2HG LYS 82 2HG LYS 82 -6.583 6.747 14.279 664 1HD LYS 82 1HD LYS 82 -5.796 8.669 13.208 665 2HD LYS 82 2HD LYS 82 -7.154 8.143 12.213 666 1HE LYS 82 1HE LYS 82 -8.270 9.820 14.141 667 2HE LYS 82 2HE LYS 82 -6.771 10.613 13.659 668 1HZ LYS 82 1HZ LYS 82 -8.125 9.653 11.374 669 2HZ LYS 82 2HZ LYS 82 -7.714 11.244 11.773 670 3HZ LYS 82 3HZ LYS 82 -9.185 10.594 12.298 671 H PHE 83 H PHE 83 -7.668 3.653 12.231 672 HA PHE 83 HA PHE 83 -7.135 5.094 9.812 673 1HB PHE 83 1HB PHE 83 -6.579 2.429 10.888 674 2HB PHE 83 2HB PHE 83 -6.981 2.394 9.177 675 HD1 PHE 83 HD1 PHE 83 -5.677 5.431 9.129 676 HD2 PHE 83 HD2 PHE 83 -4.392 1.485 10.079 677 HE1 PHE 83 HE1 PHE 83 -3.372 6.049 8.573 678 HE2 PHE 83 HE2 PHE 83 -2.081 2.103 9.510 679 HZ PHE 83 HZ PHE 83 -1.570 4.388 8.754 680 H THR 84 H THR 84 -9.691 5.554 10.314 681 HA THR 84 HA THR 84 -11.480 3.690 9.124 682 HB THR 84 HB THR 84 -13.131 5.531 9.343 683 HG1 THR 84 HG1 THR 84 -12.520 7.516 9.771 684 1HG2 THR 84 1HG2 THR 84 -11.440 5.343 11.825 685 2HG2 THR 84 2HG2 THR 84 -12.618 4.129 11.321 686 3HG2 THR 84 3HG2 THR 84 -13.150 5.762 11.720 687 H HIS 85 H HIS 85 -10.009 3.503 7.210 688 HA HIS 85 HA HIS 85 -9.381 3.955 5.061 689 1HB HIS 85 1HB HIS 85 -11.271 4.462 3.557 690 2HB HIS 85 2HB HIS 85 -11.691 3.212 4.724 691 HD2 HIS 85 HD2 HIS 85 -12.324 7.098 4.336 692 HE1 HIS 85 HE1 HIS 85 -15.516 5.339 6.507 693 HE2 HIS 85 HE2 HIS 85 -14.645 7.440 5.421 694 H PHE 86 H PHE 86 -8.742 5.991 6.896 695 HA PHE 86 HA PHE 86 -9.242 8.496 5.493 696 1HB PHE 86 1HB PHE 86 -8.647 7.775 8.217 697 2HB PHE 86 2HB PHE 86 -7.452 8.932 7.636 698 HD1 PHE 86 HD1 PHE 86 -8.474 10.985 6.322 699 HD2 PHE 86 HD2 PHE 86 -10.589 8.583 9.120 700 HE1 PHE 86 HE1 PHE 86 -10.084 12.814 6.668 701 HE2 PHE 86 HE2 PHE 86 -12.205 10.403 9.472 702 HZ PHE 86 HZ PHE 86 -11.955 12.523 8.244 703 H LEU 87 H LEU 87 -6.273 7.461 7.094 704 HA LEU 87 HA LEU 87 -4.621 8.617 5.102 705 1HB LEU 87 1HB LEU 87 -4.249 7.808 7.674 706 2HB LEU 87 2HB LEU 87 -3.459 6.508 6.803 707 HG LEU 87 HG LEU 87 -1.834 8.188 7.419 708 1HD1 LEU 87 1HD1 LEU 87 -0.953 8.734 5.167 709 2HD1 LEU 87 2HD1 LEU 87 -2.472 8.160 4.479 710 3HD1 LEU 87 3HD1 LEU 87 -1.421 7.043 5.350 711 1HD2 LEU 87 1HD2 LEU 87 -2.644 10.330 5.683 712 2HD2 LEU 87 2HD2 LEU 87 -2.270 10.366 7.406 713 3HD2 LEU 87 3HD2 LEU 87 -3.908 9.994 6.868 714 H ILE 88 H ILE 88 -5.350 5.242 5.951 715 HA ILE 88 HA ILE 88 -3.807 4.027 3.977 716 HB ILE 88 HB ILE 88 -6.417 2.864 4.915 717 1HG1 ILE 88 1HG1 ILE 88 -3.907 3.394 6.482 718 2HG1 ILE 88 2HG1 ILE 88 -5.587 3.502 6.994 719 1HG2 ILE 88 1HG2 ILE 88 -4.093 1.921 3.494 720 2HG2 ILE 88 2HG2 ILE 88 -5.647 1.132 3.751 721 3HG2 ILE 88 3HG2 ILE 88 -4.367 0.969 4.949 722 1HD1 ILE 88 1HD1 ILE 88 -5.058 0.786 6.401 723 2HD1 ILE 88 2HD1 ILE 88 -5.400 1.527 7.958 724 3HD1 ILE 88 3HD1 ILE 88 -3.737 1.395 7.391 725 H ASN 89 H ASN 89 -7.368 4.425 3.841 726 HA ASN 89 HA ASN 89 -7.644 3.664 1.191 727 1HB ASN 89 1HB ASN 89 -9.447 4.222 3.029 728 2HB ASN 89 2HB ASN 89 -9.479 5.784 2.212 729 1HD2 ASN 89 1HD2 ASN 89 -11.705 5.178 1.725 730 2HD2 ASN 89 2HD2 ASN 89 -12.020 4.186 0.344 731 H GLU 90 H GLU 90 -7.233 7.013 2.393 732 HA GLU 90 HA GLU 90 -7.477 8.268 -0.108 733 1HB GLU 90 1HB GLU 90 -7.075 9.121 2.478 734 2HB GLU 90 2HB GLU 90 -5.576 9.582 1.687 735 1HG GLU 90 1HG GLU 90 -7.881 10.262 0.085 736 2HG GLU 90 2HG GLU 90 -7.974 10.973 1.694 737 H ARG 91 H ARG 91 -4.463 7.482 1.654 738 HA ARG 91 HA ARG 91 -2.668 8.249 -0.319 739 1HB ARG 91 1HB ARG 91 -2.602 6.317 1.931 740 2HB ARG 91 2HB ARG 91 -1.325 6.192 0.732 741 1HG ARG 91 1HG ARG 91 -1.631 8.926 1.455 742 2HG ARG 91 2HG ARG 91 -1.527 7.957 2.920 743 1HD ARG 91 1HD ARG 91 0.678 7.925 2.656 744 2HD ARG 91 2HD ARG 91 0.432 6.924 1.227 745 HE ARG 91 HE ARG 91 1.133 8.685 -0.009 746 1HH1 ARG 91 1HH1 ARG 91 -0.213 9.920 2.964 747 2HH1 ARG 91 2HH1 ARG 91 0.062 11.578 2.548 748 1HH2 ARG 91 1HH2 ARG 91 1.492 10.859 -0.565 749 2HH2 ARG 91 2HH2 ARG 91 1.033 12.113 0.539 750 H ILE 92 H ILE 92 -4.079 5.037 0.257 751 HA ILE 92 HA ILE 92 -2.907 3.638 -1.811 752 HB ILE 92 HB ILE 92 -5.736 3.438 -0.761 753 1HG1 ILE 92 1HG1 ILE 92 -3.463 1.538 -0.258 754 2HG1 ILE 92 2HG1 ILE 92 -3.668 2.990 0.715 755 1HG2 ILE 92 1HG2 ILE 92 -5.104 0.973 -1.816 756 2HG2 ILE 92 2HG2 ILE 92 -4.455 2.099 -3.007 757 3HG2 ILE 92 3HG2 ILE 92 -6.158 2.179 -2.556 758 1HD1 ILE 92 1HD1 ILE 92 -5.242 2.034 1.930 759 2HD1 ILE 92 2HD1 ILE 92 -4.841 0.516 1.131 760 3HD1 ILE 92 3HD1 ILE 92 -6.139 1.529 0.499 761 H GLU 93 H GLU 93 -6.043 5.306 -1.851 762 HA GLU 93 HA GLU 93 -6.784 5.026 -4.469 763 1HB GLU 93 1HB GLU 93 -7.414 6.775 -2.255 764 2HB GLU 93 2HB GLU 93 -7.503 7.652 -3.774 765 1HG GLU 93 1HG GLU 93 -8.791 5.137 -4.102 766 2HG GLU 93 2HG GLU 93 -9.397 5.898 -2.631 767 H ASP 94 H ASP 94 -4.399 7.181 -3.126 768 HA ASP 94 HA ASP 94 -4.103 8.835 -5.419 769 1HB ASP 94 1HB ASP 94 -3.215 8.876 -2.789 770 2HB ASP 94 2HB ASP 94 -1.741 8.663 -3.726 771 H TYR 95 H TYR 95 -2.409 5.956 -4.252 772 HA TYR 95 HA TYR 95 -0.546 6.052 -6.465 773 1HB TYR 95 1HB TYR 95 -0.112 5.215 -4.012 774 2HB TYR 95 2HB TYR 95 -0.766 3.700 -4.628 775 HD1 TYR 95 HD1 TYR 95 0.285 3.330 -7.220 776 HD2 TYR 95 HD2 TYR 95 2.194 5.136 -3.873 777 HE1 TYR 95 HE1 TYR 95 2.479 2.759 -8.171 778 HE2 TYR 95 HE2 TYR 95 4.394 4.571 -4.816 779 HH TYR 95 HH TYR 95 4.979 3.870 -7.837 780 H VAL 96 H VAL 96 -2.875 3.625 -5.257 781 HA VAL 96 HA VAL 96 -2.776 1.969 -7.487 782 HB VAL 96 HB VAL 96 -3.865 1.344 -5.344 783 1HG1 VAL 96 1HG1 VAL 96 -6.388 2.650 -6.232 784 2HG1 VAL 96 2HG1 VAL 96 -5.192 3.623 -5.381 785 3HG1 VAL 96 3HG1 VAL 96 -5.866 2.188 -4.613 786 1HG2 VAL 96 1HG2 VAL 96 -6.034 0.453 -6.671 787 2HG2 VAL 96 2HG2 VAL 96 -4.425 -0.250 -6.839 788 3HG2 VAL 96 3HG2 VAL 96 -5.005 0.919 -8.024 789 H ASN 97 H ASN 97 -4.904 4.737 -6.824 790 HA ASN 97 HA ASN 97 -5.820 4.568 -9.608 791 1HB ASN 97 1HB ASN 97 -7.161 5.998 -7.311 792 2HB ASN 97 2HB ASN 97 -7.809 5.766 -8.931 793 1HD2 ASN 97 1HD2 ASN 97 -8.562 4.885 -6.109 794 2HD2 ASN 97 2HD2 ASN 97 -8.894 3.199 -6.286 795 H LYS 98 H LYS 98 -3.403 5.615 -9.447 796 HA LYS 98 HA LYS 98 -3.452 8.478 -9.091 797 1HB LYS 98 1HB LYS 98 -1.141 8.289 -10.193 798 2HB LYS 98 2HB LYS 98 -1.347 7.508 -8.634 799 1HG LYS 98 1HG LYS 98 -0.765 5.549 -9.477 800 2HG LYS 98 2HG LYS 98 -2.000 5.665 -10.731 801 1HD LYS 98 1HD LYS 98 -0.535 6.555 -12.269 802 2HD LYS 98 2HD LYS 98 0.534 7.214 -11.028 803 1HE LYS 98 1HE LYS 98 1.521 5.288 -12.227 804 2HE LYS 98 2HE LYS 98 1.349 5.006 -10.495 805 1HZ LYS 98 1HZ LYS 98 -0.478 4.000 -12.611 806 2HZ LYS 98 2HZ LYS 98 -0.678 3.753 -10.949 807 3HZ LYS 98 3HZ LYS 98 0.651 3.078 -11.749 808 H PHE 99 H PHE 99 -4.430 6.351 -11.494 809 HA PHE 99 HA PHE 99 -3.782 7.962 -13.767 810 1HB PHE 99 1HB PHE 99 -5.582 6.373 -14.836 811 2HB PHE 99 2HB PHE 99 -3.987 5.767 -14.414 812 HD1 PHE 99 HD1 PHE 99 -3.698 4.135 -12.683 813 HD2 PHE 99 HD2 PHE 99 -7.539 5.797 -13.473 814 HE1 PHE 99 HE1 PHE 99 -4.741 2.367 -11.325 815 HE2 PHE 99 HE2 PHE 99 -8.584 4.036 -12.111 816 HZ PHE 99 HZ PHE 99 -7.187 2.318 -11.035 817 H VAL 100 H VAL 100 -6.831 7.244 -12.037 818 HA VAL 100 HA VAL 100 -8.254 9.261 -13.520 819 HB VAL 100 HB VAL 100 -10.126 8.825 -11.940 820 1HG1 VAL 100 1HG1 VAL 100 -9.374 6.109 -12.769 821 2HG1 VAL 100 2HG1 VAL 100 -9.298 7.336 -14.035 822 3HG1 VAL 100 3HG1 VAL 100 -10.803 7.068 -13.157 823 1HG2 VAL 100 1HG2 VAL 100 -9.234 8.205 -9.910 824 2HG2 VAL 100 2HG2 VAL 100 -8.059 7.108 -10.634 825 3HG2 VAL 100 3HG2 VAL 100 -9.760 6.651 -10.556 826 H ILE 101 H ILE 101 -6.114 9.409 -10.953 827 HA ILE 101 HA ILE 101 -7.382 11.848 -9.906 828 HB ILE 101 HB ILE 101 -5.308 10.100 -8.577 829 1HG1 ILE 101 1HG1 ILE 101 -8.208 10.473 -7.816 830 2HG1 ILE 101 2HG1 ILE 101 -7.654 9.156 -8.845 831 1HG2 ILE 101 1HG2 ILE 101 -5.801 11.464 -6.579 832 2HG2 ILE 101 2HG2 ILE 101 -6.817 12.509 -7.571 833 3HG2 ILE 101 3HG2 ILE 101 -5.085 12.406 -7.888 834 1HD1 ILE 101 1HD1 ILE 101 -7.595 9.401 -5.981 835 2HD1 ILE 101 2HD1 ILE 101 -5.988 9.066 -6.626 836 3HD1 ILE 101 3HD1 ILE 101 -7.331 7.986 -6.998 837 H CYS 102 H CYS 102 -4.205 10.475 -10.762 838 HA CYS 102 HA CYS 102 -3.064 13.155 -10.824 839 1HB CYS 102 1HB CYS 102 -1.944 11.001 -9.861 840 2HB CYS 102 2HB CYS 102 -1.540 10.679 -11.544 841 H HIS 103 H HIS 103 -4.706 11.216 -12.945 842 HA HIS 103 HA HIS 103 -5.056 11.275 -15.181 843 1HB HIS 103 1HB HIS 103 -3.636 13.877 -14.746 844 2HB HIS 103 2HB HIS 103 -4.013 13.346 -16.383 845 HD2 HIS 103 HD2 HIS 103 -6.905 12.885 -16.750 846 HE1 HIS 103 HE1 HIS 103 -7.885 15.675 -13.705 847 HE2 HIS 103 HE2 HIS 103 -8.726 14.400 -15.709 848 H GLU 104 H GLU 104 -3.216 9.505 -14.488 849 HA GLU 104 HA GLU 104 -1.405 8.297 -15.117 850 1HB GLU 104 1HB GLU 104 -1.179 7.945 -17.500 851 2HB GLU 104 2HB GLU 104 -2.877 8.046 -17.067 852 1HG GLU 104 1HG GLU 104 -3.150 10.106 -18.097 853 2HG GLU 104 2HG GLU 104 -1.424 10.452 -18.088 854 H CYS 105 H CYS 105 -0.002 9.728 -13.873 855 HA CYS 105 HA CYS 105 1.452 11.829 -15.106 856 1HB CYS 105 1HB CYS 105 1.110 11.064 -12.545 857 2HB CYS 105 2HB CYS 105 2.704 10.380 -12.846 858 H ASN 106 H ASN 106 1.687 9.982 -17.009 859 HA ASN 106 HA ASN 106 3.993 8.326 -16.731 860 1HB ASN 106 1HB ASN 106 2.421 9.183 -19.168 861 2HB ASN 106 2HB ASN 106 3.730 8.004 -19.199 862 1HD2 ASN 106 1HD2 ASN 106 3.009 6.004 -19.260 863 2HD2 ASN 106 2HD2 ASN 106 1.602 5.403 -18.459 864 H ARG 107 H ARG 107 3.720 10.567 -19.440 865 HA ARG 107 HA ARG 107 6.406 11.573 -18.796 866 1HB ARG 107 1HB ARG 107 4.970 11.042 -21.358 867 2HB ARG 107 2HB ARG 107 6.183 12.314 -21.323 868 1HG ARG 107 1HG ARG 107 7.331 10.419 -22.040 869 2HG ARG 107 2HG ARG 107 7.749 10.568 -20.332 870 1HD ARG 107 1HD ARG 107 7.259 8.321 -20.503 871 2HD ARG 107 2HD ARG 107 5.719 8.988 -19.969 872 HE ARG 107 HE ARG 107 5.672 8.976 -22.742 873 1HH1 ARG 107 1HH1 ARG 107 5.898 6.635 -20.160 874 2HH1 ARG 107 2HH1 ARG 107 5.109 5.384 -21.059 875 1HH2 ARG 107 1HH2 ARG 107 4.636 7.330 -23.923 876 2HH2 ARG 107 2HH2 ARG 107 4.391 5.777 -23.194 877 HA PRO 108 HA PRO 108 3.169 15.115 -18.363 878 1HB PRO 108 1HB PRO 108 4.891 15.587 -15.989 879 2HB PRO 108 2HB PRO 108 3.138 15.729 -16.152 880 1HG PRO 108 1HG PRO 108 4.279 13.668 -14.870 881 2HG PRO 108 2HG PRO 108 2.792 13.480 -15.815 882 1HD PRO 108 1HD PRO 108 5.561 12.617 -16.453 883 2HD PRO 108 2HD PRO 108 4.007 11.915 -16.936 884 H ASP 109 H ASP 109 3.623 17.171 -19.034 885 HA ASP 109 HA ASP 109 6.372 17.742 -19.824 886 1HB ASP 109 1HB ASP 109 5.307 19.719 -20.963 887 2HB ASP 109 2HB ASP 109 4.690 18.161 -21.508 888 H THR 110 H THR 110 6.039 17.682 -17.093 889 HA THR 110 HA THR 110 6.395 20.489 -16.343 890 HB THR 110 HB THR 110 4.171 19.892 -15.621 891 HG1 THR 110 HG1 THR 110 4.440 20.570 -13.630 892 1HG2 THR 110 1HG2 THR 110 3.696 18.039 -14.145 893 2HG2 THR 110 2HG2 THR 110 5.386 17.535 -14.201 894 3HG2 THR 110 3HG2 THR 110 4.395 17.453 -15.655 895 H ARG 111 H ARG 111 7.291 20.468 -13.947 896 HA ARG 111 HA ARG 111 9.658 18.779 -14.042 897 1HB ARG 111 1HB ARG 111 9.093 21.389 -13.091 898 2HB ARG 111 2HB ARG 111 9.542 20.426 -11.690 899 1HG ARG 111 1HG ARG 111 11.665 20.724 -12.224 900 2HG ARG 111 2HG ARG 111 11.393 19.775 -13.687 901 1HD ARG 111 1HD ARG 111 10.438 22.088 -14.559 902 2HD ARG 111 2HD ARG 111 11.527 22.721 -13.324 903 HE ARG 111 HE ARG 111 13.104 21.008 -14.679 904 1HH1 ARG 111 1HH1 ARG 111 10.996 23.590 -15.720 905 2HH1 ARG 111 2HH1 ARG 111 11.949 23.975 -17.113 906 1HH2 ARG 111 1HH2 ARG 111 14.362 21.518 -16.507 907 2HH2 ARG 111 2HH2 ARG 111 13.861 22.799 -17.559 908 H ILE 112 H ILE 112 9.105 16.765 -13.418 909 HA ILE 112 HA ILE 112 7.575 16.381 -10.963 910 HB ILE 112 HB ILE 112 8.085 13.866 -11.744 911 1HG1 ILE 112 1HG1 ILE 112 7.908 15.355 -14.364 912 2HG1 ILE 112 2HG1 ILE 112 9.417 14.735 -13.705 913 1HG2 ILE 112 1HG2 ILE 112 5.930 15.710 -12.736 914 2HG2 ILE 112 2HG2 ILE 112 5.881 14.628 -11.344 915 3HG2 ILE 112 3HG2 ILE 112 5.895 13.964 -12.978 916 1HD1 ILE 112 1HD1 ILE 112 7.007 13.105 -14.467 917 2HD1 ILE 112 2HD1 ILE 112 8.492 12.467 -13.764 918 3HD1 ILE 112 3HD1 ILE 112 8.524 13.222 -15.358 919 H ILE 113 H ILE 113 8.427 15.603 -9.117 920 HA ILE 113 HA ILE 113 11.186 14.596 -9.118 921 HB ILE 113 HB ILE 113 10.214 16.717 -7.191 922 1HG1 ILE 113 1HG1 ILE 113 10.692 17.587 -9.482 923 2HG1 ILE 113 2HG1 ILE 113 11.765 18.233 -8.248 924 1HG2 ILE 113 1HG2 ILE 113 11.725 15.270 -6.070 925 2HG2 ILE 113 2HG2 ILE 113 12.625 16.727 -6.493 926 3HG2 ILE 113 3HG2 ILE 113 12.831 15.255 -7.443 927 1HD1 ILE 113 1HD1 ILE 113 12.356 16.503 -10.551 928 2HD1 ILE 113 2HD1 ILE 113 13.236 16.152 -9.065 929 3HD1 ILE 113 3HD1 ILE 113 13.329 17.758 -9.787 930 H ARG 114 H ARG 114 11.463 12.885 -7.788 931 HA ARG 114 HA ARG 114 9.455 12.404 -5.704 932 1HB ARG 114 1HB ARG 114 9.385 10.008 -6.315 933 2HB ARG 114 2HB ARG 114 8.748 11.047 -7.574 934 1HG ARG 114 1HG ARG 114 11.601 10.157 -7.646 935 2HG ARG 114 2HG ARG 114 10.320 9.081 -8.191 936 1HD ARG 114 1HD ARG 114 10.984 11.813 -9.293 937 2HD ARG 114 2HD ARG 114 11.260 10.261 -10.076 938 HE ARG 114 HE ARG 114 8.527 11.077 -9.432 939 1HH1 ARG 114 1HH1 ARG 114 10.943 10.285 -11.824 940 2HH1 ARG 114 2HH1 ARG 114 9.808 10.258 -13.130 941 1HH2 ARG 114 1HH2 ARG 114 7.044 11.055 -11.153 942 2HH2 ARG 114 2HH2 ARG 114 7.603 10.700 -12.755 943 H GLU 115 H GLU 115 10.232 11.669 -3.812 944 HA GLU 115 HA GLU 115 12.950 10.564 -3.711 945 1HB GLU 115 1HB GLU 115 13.240 12.904 -3.215 946 2HB GLU 115 2HB GLU 115 11.904 12.878 -2.075 947 1HG GLU 115 1HG GLU 115 13.216 12.229 -0.410 948 2HG GLU 115 2HG GLU 115 13.934 10.942 -1.376 949 H GLY 116 H GLY 116 13.348 9.151 -1.982 950 1HA GLY 116 1HA GLY 116 12.793 8.075 0.065 951 2HA GLY 116 2HA GLY 116 11.135 8.623 -0.127 952 H ARG 117 H ARG 117 13.041 7.040 -2.629 953 HA ARG 117 HA ARG 117 12.683 5.130 -3.819 954 1HB ARG 117 1HB ARG 117 12.453 4.403 -0.995 955 2HB ARG 117 2HB ARG 117 11.588 3.300 -2.054 956 1HG ARG 117 1HG ARG 117 14.104 3.758 -3.239 957 2HG ARG 117 2HG ARG 117 14.382 3.461 -1.521 958 1HD ARG 117 1HD ARG 117 13.587 1.322 -1.622 959 2HD ARG 117 2HD ARG 117 12.486 1.676 -2.949 960 HE ARG 117 HE ARG 117 14.424 1.626 -4.432 961 1HH1 ARG 117 1HH1 ARG 117 14.790 0.150 -1.279 962 2HH1 ARG 117 2HH1 ARG 117 16.099 -0.864 -1.778 963 1HH2 ARG 117 1HH2 ARG 117 16.142 0.288 -5.074 964 2HH2 ARG 117 2HH2 ARG 117 16.867 -0.786 -3.925 965 H ILE 118 H ILE 118 10.749 6.846 -4.366 966 HA ILE 118 HA ILE 118 8.658 6.982 -5.276 967 HB ILE 118 HB ILE 118 8.271 4.074 -4.614 968 1HG1 ILE 118 1HG1 ILE 118 9.612 5.249 -7.059 969 2HG1 ILE 118 2HG1 ILE 118 10.414 4.326 -5.790 970 1HG2 ILE 118 1HG2 ILE 118 6.409 5.658 -5.473 971 2HG2 ILE 118 2HG2 ILE 118 6.601 4.066 -6.204 972 3HG2 ILE 118 3HG2 ILE 118 7.228 5.493 -7.026 973 1HD1 ILE 118 1HD1 ILE 118 8.138 2.949 -6.989 974 2HD1 ILE 118 2HD1 ILE 118 9.771 2.374 -6.652 975 3HD1 ILE 118 3HD1 ILE 118 9.447 3.301 -8.118 976 H SER 119 H SER 119 8.527 8.169 -3.095 977 HA SER 119 HA SER 119 6.148 7.157 -1.721 978 1HB SER 119 1HB SER 119 8.645 6.918 -0.549 979 2HB SER 119 2HB SER 119 8.003 8.395 0.166 980 HG SER 119 HG SER 119 6.030 6.679 0.201 981 H LEU 120 H LEU 120 8.270 9.805 -2.538 982 HA LEU 120 HA LEU 120 6.074 11.665 -1.921 983 1HB LEU 120 1HB LEU 120 8.968 12.476 -1.876 984 2HB LEU 120 2HB LEU 120 7.587 13.315 -1.195 985 HG LEU 120 HG LEU 120 8.560 10.671 -0.129 986 1HD1 LEU 120 1HD1 LEU 120 10.280 11.654 0.858 987 2HD1 LEU 120 2HD1 LEU 120 9.204 12.835 1.604 988 3HD1 LEU 120 3HD1 LEU 120 9.901 13.156 0.016 989 1HD2 LEU 120 1HD2 LEU 120 6.197 11.789 0.302 990 2HD2 LEU 120 2HD2 LEU 120 7.127 12.710 1.485 991 3HD2 LEU 120 3HD2 LEU 120 7.077 10.950 1.578 992 H LEU 121 H LEU 121 5.742 13.357 -3.398 993 HA LEU 121 HA LEU 121 7.384 13.747 -5.687 994 1HB LEU 121 1HB LEU 121 6.475 11.613 -6.362 995 2HB LEU 121 2HB LEU 121 4.847 12.154 -6.010 996 HG LEU 121 HG LEU 121 5.569 13.997 -7.863 997 1HD1 LEU 121 1HD1 LEU 121 7.731 13.028 -8.279 998 2HD1 LEU 121 2HD1 LEU 121 6.696 12.776 -9.684 999 3HD1 LEU 121 3HD1 LEU 121 7.000 11.451 -8.562 1000 1HD2 LEU 121 1HD2 LEU 121 4.109 11.438 -7.911 1001 2HD2 LEU 121 2HD2 LEU 121 4.559 12.102 -9.480 1002 3HD2 LEU 121 3HD2 LEU 121 3.582 13.058 -8.367 1003 H LYS 122 H LYS 122 6.702 15.486 -6.993 1004 HA LYS 122 HA LYS 122 4.355 16.922 -5.923 1005 1HB LYS 122 1HB LYS 122 5.568 19.001 -6.789 1006 2HB LYS 122 2HB LYS 122 6.161 18.256 -5.315 1007 1HG LYS 122 1HG LYS 122 8.048 17.376 -6.381 1008 2HG LYS 122 2HG LYS 122 7.357 17.620 -7.989 1009 1HD LYS 122 1HD LYS 122 7.322 20.145 -7.165 1010 2HD LYS 122 2HD LYS 122 8.645 19.565 -6.152 1011 1HE LYS 122 1HE LYS 122 9.950 18.977 -8.005 1012 2HE LYS 122 2HE LYS 122 8.576 19.053 -9.109 1013 1HZ LYS 122 1HZ LYS 122 10.317 21.156 -8.191 1014 2HZ LYS 122 2HZ LYS 122 8.676 21.559 -8.115 1015 3HZ LYS 122 3HZ LYS 122 9.360 21.074 -9.584 1016 H CYS 123 H CYS 123 2.949 17.911 -7.337 1017 HA CYS 123 HA CYS 123 3.421 17.613 -10.214 1018 1HB CYS 123 1HB CYS 123 1.060 16.524 -8.681 1019 2HB CYS 123 2HB CYS 123 1.020 16.788 -10.422 1020 H GLU 124 H GLU 124 3.759 19.986 -9.669 1021 HA GLU 124 HA GLU 124 1.562 21.615 -8.951 1022 1HB GLU 124 1HB GLU 124 3.953 22.294 -8.785 1023 2HB GLU 124 2HB GLU 124 4.006 22.413 -10.537 1024 1HG GLU 124 1HG GLU 124 1.867 23.936 -9.195 1025 2HG GLU 124 2HG GLU 124 3.517 24.487 -8.913 1026 H ALA 125 H ALA 125 2.526 20.187 -11.962 1027 HA ALA 125 HA ALA 125 0.914 21.996 -13.545 1028 1HB ALA 125 1HB ALA 125 1.526 20.378 -15.410 1029 2HB ALA 125 2HB ALA 125 2.567 19.589 -14.226 1030 3HB ALA 125 3HB ALA 125 2.844 21.275 -14.657 1031 H CYS 126 H CYS 126 0.882 18.417 -13.486 1032 HA CYS 126 HA CYS 126 -1.886 18.375 -14.219 1033 1HB CYS 126 1HB CYS 126 -1.707 15.965 -14.149 1034 2HB CYS 126 2HB CYS 126 -0.273 16.619 -14.929 1035 H GLY 127 H GLY 127 -2.097 19.865 -12.121 1036 1HA GLY 127 1HA GLY 127 -3.712 19.803 -10.371 1037 2HA GLY 127 2HA GLY 127 -3.305 18.114 -10.098 1038 H ALA 128 H ALA 128 -2.352 17.826 -8.211 1039 HA ALA 128 HA ALA 128 -0.074 19.446 -7.473 1040 1HB ALA 128 1HB ALA 128 -1.043 20.735 -5.953 1041 2HB ALA 128 2HB ALA 128 -1.685 19.319 -5.121 1042 3HB ALA 128 3HB ALA 128 -2.612 20.076 -6.416 1043 H LYS 129 H LYS 129 1.211 18.500 -5.833 1044 HA LYS 129 HA LYS 129 0.435 15.924 -4.757 1045 1HB LYS 129 1HB LYS 129 2.034 16.153 -7.123 1046 2HB LYS 129 2HB LYS 129 3.014 15.480 -5.836 1047 1HG LYS 129 1HG LYS 129 0.303 14.362 -6.357 1048 2HG LYS 129 2HG LYS 129 1.652 13.923 -7.406 1049 1HD LYS 129 1HD LYS 129 2.809 13.555 -5.015 1050 2HD LYS 129 2HD LYS 129 1.132 13.224 -4.578 1051 1HE LYS 129 1HE LYS 129 2.925 11.771 -6.478 1052 2HE LYS 129 2HE LYS 129 1.935 11.133 -5.171 1053 1HZ LYS 129 1HZ LYS 129 0.175 10.919 -6.508 1054 2HZ LYS 129 2HZ LYS 129 1.286 11.030 -7.777 1055 3HZ LYS 129 3HZ LYS 129 0.429 12.398 -7.286 1056 H ALA 130 H ALA 130 1.832 15.215 -3.049 1057 HA ALA 130 HA ALA 130 3.030 17.413 -1.626 1058 1HB ALA 130 1HB ALA 130 2.984 16.062 0.244 1059 2HB ALA 130 2HB ALA 130 3.169 14.580 -0.695 1060 3HB ALA 130 3HB ALA 130 1.628 15.439 -0.697 1061 HA PRO 131 HA PRO 131 7.080 16.365 -3.410 1062 1HB PRO 131 1HB PRO 131 8.311 18.638 -2.549 1063 2HB PRO 131 2HB PRO 131 7.350 18.558 -4.026 1064 1HG PRO 131 1HG PRO 131 6.614 19.617 -1.337 1065 2HG PRO 131 2HG PRO 131 6.199 20.240 -2.941 1066 1HD PRO 131 1HD PRO 131 4.472 18.803 -1.400 1067 2HD PRO 131 2HD PRO 131 4.424 18.818 -3.172 1068 H LEU 132 H LEU 132 6.860 18.033 -0.261 1069 HA LEU 132 HA LEU 132 8.811 16.103 0.809 1070 1HB LEU 132 1HB LEU 132 9.282 18.698 0.573 1071 2HB LEU 132 2HB LEU 132 8.394 18.763 2.082 1072 HG LEU 132 HG LEU 132 10.613 16.801 1.916 1073 1HD1 LEU 132 1HD1 LEU 132 12.307 18.244 1.729 1074 2HD1 LEU 132 2HD1 LEU 132 11.510 19.454 2.734 1075 3HD1 LEU 132 3HD1 LEU 132 11.121 19.339 1.018 1076 1HD2 LEU 132 1HD2 LEU 132 9.020 17.325 3.889 1077 2HD2 LEU 132 2HD2 LEU 132 10.037 18.748 4.112 1078 3HD2 LEU 132 3HD2 LEU 132 10.745 17.136 4.204 1079 H LYS 133 H LYS 133 6.510 18.437 2.230 1080 HA LYS 133 HA LYS 133 4.759 16.523 3.305 1081 1HB LYS 133 1HB LYS 133 7.213 16.914 4.788 1082 2HB LYS 133 2HB LYS 133 5.822 17.385 5.756 1083 1HG LYS 133 1HG LYS 133 4.809 15.151 5.168 1084 2HG LYS 133 2HG LYS 133 6.383 14.712 4.504 1085 1HD LYS 133 1HD LYS 133 6.626 15.855 7.154 1086 2HD LYS 133 2HD LYS 133 5.551 14.456 7.149 1087 1HE LYS 133 1HE LYS 133 8.068 14.179 5.628 1088 2HE LYS 133 2HE LYS 133 8.226 14.281 7.381 1089 1HZ LYS 133 1HZ LYS 133 7.477 12.216 7.603 1090 2HZ LYS 133 2HZ LYS 133 7.614 12.043 5.927 1091 3HZ LYS 133 3HZ LYS 133 6.135 12.499 6.611 1092 H ASN 134 H ASN 134 6.318 19.533 4.433 1093 HA ASN 134 HA ASN 134 3.700 20.856 4.277 1094 1HB ASN 134 1HB ASN 134 4.556 20.083 6.670 1095 2HB ASN 134 2HB ASN 134 5.503 21.563 6.549 1096 1HD2 ASN 134 1HD2 ASN 134 2.363 20.195 6.925 1097 2HD2 ASN 134 2HD2 ASN 134 1.522 21.670 7.242 1098 H VAL 135 H VAL 135 3.831 23.201 4.170 1099 HA VAL 135 HA VAL 135 6.065 24.039 2.542 1100 HB VAL 135 HB VAL 135 3.769 24.705 1.952 1101 1HG1 VAL 135 1HG1 VAL 135 3.894 26.132 4.593 1102 2HG1 VAL 135 2HG1 VAL 135 2.680 24.990 4.015 1103 3HG1 VAL 135 3HG1 VAL 135 2.772 26.607 3.317 1104 1HG2 VAL 135 1HG2 VAL 135 5.600 26.998 2.648 1105 2HG2 VAL 135 2HG2 VAL 135 4.236 27.089 1.535 1106 3HG2 VAL 135 3HG2 VAL 135 5.616 26.057 1.157 Start of MODEL 3 1 H MET 1 H MET 1 -30.819 -1.731 -30.460 2 HA MET 1 HA MET 1 -30.196 -4.229 -29.867 3 1HB MET 1 1HB MET 1 -30.085 -2.434 -32.136 4 2HB MET 1 2HB MET 1 -28.845 -3.674 -32.263 5 1HG MET 1 1HG MET 1 -30.528 -4.788 -33.269 6 2HG MET 1 2HG MET 1 -30.891 -5.235 -31.603 7 1HE MET 1 1HE MET 1 -33.190 -5.896 -31.964 8 2HE MET 1 2HE MET 1 -34.523 -4.745 -31.878 9 3HE MET 1 3HE MET 1 -33.344 -4.827 -30.569 10 H ASP 2 H ASP 2 -27.801 -1.635 -30.005 11 HA ASP 2 HA ASP 2 -25.481 -3.157 -30.240 12 1HB ASP 2 1HB ASP 2 -26.124 -0.472 -29.123 13 2HB ASP 2 2HB ASP 2 -24.562 -1.172 -28.708 14 H ASP 3 H ASP 3 -25.541 -5.039 -29.040 15 HA ASP 3 HA ASP 3 -25.946 -4.919 -26.171 16 1HB ASP 3 1HB ASP 3 -25.267 -7.234 -27.998 17 2HB ASP 3 2HB ASP 3 -25.595 -7.380 -26.273 18 H TYR 4 H TYR 4 -24.244 -6.594 -25.029 19 HA TYR 4 HA TYR 4 -21.877 -5.125 -24.748 20 1HB TYR 4 1HB TYR 4 -22.866 -7.753 -23.786 21 2HB TYR 4 2HB TYR 4 -21.124 -7.505 -23.741 22 HD1 TYR 4 HD1 TYR 4 -21.040 -4.589 -23.088 23 HD2 TYR 4 HD2 TYR 4 -23.447 -7.727 -21.520 24 HE1 TYR 4 HE1 TYR 4 -21.274 -3.347 -20.980 25 HE2 TYR 4 HE2 TYR 4 -23.689 -6.493 -19.407 26 HH TYR 4 HH TYR 4 -23.067 -4.697 -18.230 27 H GLU 5 H GLU 5 -20.540 -4.822 -26.424 28 HA GLU 5 HA GLU 5 -20.082 -6.626 -28.520 29 1HB GLU 5 1HB GLU 5 -18.764 -4.161 -27.511 30 2HB GLU 5 2HB GLU 5 -17.834 -5.177 -28.603 31 1HG GLU 5 1HG GLU 5 -20.521 -4.754 -29.576 32 2HG GLU 5 2HG GLU 5 -19.680 -3.231 -29.294 33 H LYS 6 H LYS 6 -17.513 -7.095 -28.935 34 HA LYS 6 HA LYS 6 -16.707 -8.789 -26.663 35 1HB LYS 6 1HB LYS 6 -16.664 -9.190 -29.610 36 2HB LYS 6 2HB LYS 6 -15.329 -9.869 -28.690 37 1HG LYS 6 1HG LYS 6 -16.885 -11.138 -27.325 38 2HG LYS 6 2HG LYS 6 -18.246 -10.424 -28.192 39 1HD LYS 6 1HD LYS 6 -16.572 -11.464 -30.175 40 2HD LYS 6 2HD LYS 6 -16.596 -12.685 -28.900 41 1HE LYS 6 1HE LYS 6 -18.961 -12.859 -28.995 42 2HE LYS 6 2HE LYS 6 -19.094 -11.422 -30.007 43 1HZ LYS 6 1HZ LYS 6 -19.335 -13.596 -31.191 44 2HZ LYS 6 2HZ LYS 6 -17.699 -13.889 -30.879 45 3HZ LYS 6 3HZ LYS 6 -18.155 -12.567 -31.832 46 H LEU 7 H LEU 7 -15.430 -6.844 -29.342 47 HA LEU 7 HA LEU 7 -13.546 -5.475 -27.790 48 1HB LEU 7 1HB LEU 7 -11.472 -6.547 -28.762 49 2HB LEU 7 2HB LEU 7 -12.307 -7.460 -27.519 50 HG LEU 7 HG LEU 7 -13.458 -8.425 -29.821 51 1HD1 LEU 7 1HD1 LEU 7 -10.572 -8.532 -30.482 52 2HD1 LEU 7 2HD1 LEU 7 -11.447 -7.052 -30.878 53 3HD1 LEU 7 3HD1 LEU 7 -11.984 -8.597 -31.537 54 1HD2 LEU 7 1HD2 LEU 7 -11.679 -10.310 -29.428 55 2HD2 LEU 7 2HD2 LEU 7 -12.931 -9.987 -28.229 56 3HD2 LEU 7 3HD2 LEU 7 -11.300 -9.359 -27.993 57 H LEU 8 H LEU 8 -15.458 -5.146 -29.997 58 HA LEU 8 HA LEU 8 -13.762 -4.338 -32.232 59 1HB LEU 8 1HB LEU 8 -16.461 -5.228 -31.955 60 2HB LEU 8 2HB LEU 8 -16.483 -3.622 -32.660 61 HG LEU 8 HG LEU 8 -14.595 -5.590 -33.837 62 1HD1 LEU 8 1HD1 LEU 8 -16.941 -5.947 -35.281 63 2HD1 LEU 8 2HD1 LEU 8 -17.429 -6.097 -33.593 64 3HD1 LEU 8 3HD1 LEU 8 -16.149 -7.126 -34.235 65 1HD2 LEU 8 1HD2 LEU 8 -14.544 -3.464 -34.818 66 2HD2 LEU 8 2HD2 LEU 8 -16.302 -3.318 -34.803 67 3HD2 LEU 8 3HD2 LEU 8 -15.519 -4.438 -35.917 68 H GLU 9 H GLU 9 -13.692 -2.963 -29.641 69 HA GLU 9 HA GLU 9 -14.489 -0.276 -30.543 70 1HB GLU 9 1HB GLU 9 -14.572 0.206 -27.999 71 2HB GLU 9 2HB GLU 9 -15.920 -0.647 -28.738 72 1HG GLU 9 1HG GLU 9 -13.756 -2.345 -27.687 73 2HG GLU 9 2HG GLU 9 -14.681 -1.441 -26.487 74 H ARG 10 H ARG 10 -12.993 1.338 -30.346 75 HA ARG 10 HA ARG 10 -10.280 0.476 -29.695 76 1HB ARG 10 1HB ARG 10 -9.762 2.841 -30.652 77 2HB ARG 10 2HB ARG 10 -10.206 1.541 -31.748 78 1HG ARG 10 1HG ARG 10 -12.371 3.282 -30.698 79 2HG ARG 10 2HG ARG 10 -11.282 3.941 -31.920 80 1HD ARG 10 1HD ARG 10 -12.484 1.247 -32.346 81 2HD ARG 10 2HD ARG 10 -13.480 2.678 -32.610 82 HE ARG 10 HE ARG 10 -11.439 1.692 -34.315 83 1HH1 ARG 10 1HH1 ARG 10 -12.863 4.658 -33.153 84 2HH1 ARG 10 2HH1 ARG 10 -12.426 5.565 -34.561 85 1HH2 ARG 10 1HH2 ARG 10 -10.863 2.883 -36.166 86 2HH2 ARG 10 2HH2 ARG 10 -11.291 4.558 -36.273 87 H ALA 11 H ALA 11 -10.482 0.460 -27.425 88 HA ALA 11 HA ALA 11 -9.808 2.929 -26.179 89 1HB ALA 11 1HB ALA 11 -12.280 1.863 -24.951 90 2HB ALA 11 2HB ALA 11 -12.458 2.759 -26.459 91 3HB ALA 11 3HB ALA 11 -11.692 3.522 -25.066 92 H ILE 12 H ILE 12 -8.766 0.239 -26.434 93 HA ILE 12 HA ILE 12 -8.948 -0.769 -23.688 94 HB ILE 12 HB ILE 12 -7.616 -2.139 -26.021 95 1HG1 ILE 12 1HG1 ILE 12 -10.335 -2.888 -25.003 96 2HG1 ILE 12 2HG1 ILE 12 -10.173 -1.596 -26.188 97 1HG2 ILE 12 1HG2 ILE 12 -7.562 -2.659 -23.293 98 2HG2 ILE 12 2HG2 ILE 12 -7.094 -3.760 -24.589 99 3HG2 ILE 12 3HG2 ILE 12 -8.734 -3.808 -23.940 100 1HD1 ILE 12 1HD1 ILE 12 -9.873 -3.035 -27.846 101 2HD1 ILE 12 2HD1 ILE 12 -10.389 -4.289 -26.717 102 3HD1 ILE 12 3HD1 ILE 12 -8.671 -3.954 -26.939 103 H ASP 13 H ASP 13 -6.131 -1.570 -25.525 104 HA ASP 13 HA ASP 13 -4.534 0.258 -23.863 105 1HB ASP 13 1HB ASP 13 -4.525 -2.465 -23.642 106 2HB ASP 13 2HB ASP 13 -3.208 -2.206 -24.783 107 H GLN 14 H GLN 14 -4.114 -1.862 -26.699 108 HA GLN 14 HA GLN 14 -2.218 -0.064 -27.890 109 1HB GLN 14 1HB GLN 14 -2.750 -2.752 -28.130 110 2HB GLN 14 2HB GLN 14 -3.387 -2.110 -29.638 111 1HG GLN 14 1HG GLN 14 -1.104 -0.900 -29.800 112 2HG GLN 14 2HG GLN 14 -0.584 -2.094 -28.610 113 1HE2 GLN 14 1HE2 GLN 14 -0.847 -4.353 -29.173 114 2HE2 GLN 14 2HE2 GLN 14 -0.731 -4.833 -30.828 115 H LEU 15 H LEU 15 -5.637 -0.681 -28.171 116 HA LEU 15 HA LEU 15 -6.175 0.472 -30.651 117 1HB LEU 15 1HB LEU 15 -7.762 0.193 -28.123 118 2HB LEU 15 2HB LEU 15 -8.419 1.092 -29.474 119 HG LEU 15 HG LEU 15 -9.245 -1.211 -29.428 120 1HD1 LEU 15 1HD1 LEU 15 -7.652 -0.157 -31.684 121 2HD1 LEU 15 2HD1 LEU 15 -9.365 -0.562 -31.590 122 3HD1 LEU 15 3HD1 LEU 15 -8.165 -1.841 -31.782 123 1HD2 LEU 15 1HD2 LEU 15 -6.506 -2.201 -30.106 124 2HD2 LEU 15 2HD2 LEU 15 -7.909 -3.095 -29.518 125 3HD2 LEU 15 3HD2 LEU 15 -7.010 -2.046 -28.423 126 HA PRO 16 HA PRO 16 -5.338 4.776 -30.362 127 1HB PRO 16 1HB PRO 16 -7.753 5.778 -31.381 128 2HB PRO 16 2HB PRO 16 -6.310 5.375 -32.312 129 1HG PRO 16 1HG PRO 16 -8.798 3.814 -31.907 130 2HG PRO 16 2HG PRO 16 -7.710 3.858 -33.302 131 1HD PRO 16 1HD PRO 16 -7.771 1.780 -31.577 132 2HD PRO 16 2HD PRO 16 -6.281 2.290 -32.398 133 HA PRO 17 HA PRO 17 -7.231 5.600 -26.358 134 1HB PRO 17 1HB PRO 17 -5.951 8.017 -25.996 135 2HB PRO 17 2HB PRO 17 -5.263 6.445 -25.580 136 1HG PRO 17 1HG PRO 17 -4.817 8.129 -28.007 137 2HG PRO 17 2HG PRO 17 -3.648 7.180 -27.070 138 1HD PRO 17 1HD PRO 17 -4.617 6.300 -29.412 139 2HD PRO 17 2HD PRO 17 -4.277 5.185 -28.071 140 H GLU 18 H GLU 18 -9.180 6.428 -26.046 141 HA GLU 18 HA GLU 18 -9.857 9.055 -27.092 142 1HB GLU 18 1HB GLU 18 -10.489 7.195 -28.782 143 2HB GLU 18 2HB GLU 18 -11.761 6.794 -27.636 144 1HG GLU 18 1HG GLU 18 -12.952 8.672 -28.083 145 2HG GLU 18 2HG GLU 18 -11.518 9.628 -28.454 146 H VAL 19 H VAL 19 -10.926 6.198 -25.289 147 HA VAL 19 HA VAL 19 -12.743 7.829 -23.695 148 HB VAL 19 HB VAL 19 -12.206 4.875 -23.405 149 1HG1 VAL 19 1HG1 VAL 19 -13.511 5.124 -21.619 150 2HG1 VAL 19 2HG1 VAL 19 -14.836 5.461 -22.734 151 3HG1 VAL 19 3HG1 VAL 19 -13.901 6.790 -22.049 152 1HG2 VAL 19 1HG2 VAL 19 -14.337 6.221 -25.064 153 2HG2 VAL 19 2HG2 VAL 19 -14.145 4.485 -24.819 154 3HG2 VAL 19 3HG2 VAL 19 -12.916 5.393 -25.701 155 H PHE 20 H PHE 20 -12.281 8.574 -21.740 156 HA PHE 20 HA PHE 20 -9.661 8.227 -20.645 157 1HB PHE 20 1HB PHE 20 -10.557 9.699 -18.800 158 2HB PHE 20 2HB PHE 20 -10.643 10.387 -20.417 159 HD1 PHE 20 HD1 PHE 20 -12.520 9.246 -17.538 160 HD2 PHE 20 HD2 PHE 20 -12.814 10.544 -21.580 161 HE1 PHE 20 HE1 PHE 20 -14.926 9.654 -17.229 162 HE2 PHE 20 HE2 PHE 20 -15.220 10.954 -21.278 163 HZ PHE 20 HZ PHE 20 -16.280 10.509 -19.099 164 H GLU 21 H GLU 21 -10.329 5.748 -20.626 165 HA GLU 21 HA GLU 21 -10.831 5.119 -17.817 166 1HB GLU 21 1HB GLU 21 -12.264 3.771 -20.116 167 2HB GLU 21 2HB GLU 21 -12.319 3.240 -18.441 168 1HG GLU 21 1HG GLU 21 -13.055 6.036 -18.780 169 2HG GLU 21 2HG GLU 21 -14.102 4.922 -19.659 170 H THR 22 H THR 22 -10.194 2.869 -17.283 171 HA THR 22 HA THR 22 -7.775 2.171 -18.755 172 HB THR 22 HB THR 22 -7.667 2.382 -16.297 173 HG1 THR 22 HG1 THR 22 -6.285 0.898 -17.402 174 1HG2 THR 22 1HG2 THR 22 -9.838 0.380 -16.398 175 2HG2 THR 22 2HG2 THR 22 -9.539 1.682 -15.246 176 3HG2 THR 22 3HG2 THR 22 -8.611 0.185 -15.146 177 H LYS 23 H LYS 23 -7.536 -0.511 -18.253 178 HA LYS 23 HA LYS 23 -9.302 -1.602 -20.244 179 1HB LYS 23 1HB LYS 23 -7.244 -3.034 -18.553 180 2HB LYS 23 2HB LYS 23 -7.975 -3.623 -20.040 181 1HG LYS 23 1HG LYS 23 -6.371 -2.673 -21.222 182 2HG LYS 23 2HG LYS 23 -6.815 -1.091 -20.579 183 1HD LYS 23 1HD LYS 23 -5.441 -2.140 -18.485 184 2HD LYS 23 2HD LYS 23 -4.598 -2.880 -19.847 185 1HE LYS 23 1HE LYS 23 -4.604 -0.463 -20.811 186 2HE LYS 23 2HE LYS 23 -4.887 0.012 -19.137 187 1HZ LYS 23 1HZ LYS 23 -2.826 -0.662 -18.498 188 2HZ LYS 23 2HZ LYS 23 -2.473 -0.238 -20.098 189 3HZ LYS 23 3HZ LYS 23 -2.706 -1.862 -19.687 190 H ARG 24 H ARG 24 -9.753 -4.178 -19.463 191 HA ARG 24 HA ARG 24 -11.979 -3.862 -17.696 192 1HB ARG 24 1HB ARG 24 -11.289 -5.648 -19.702 193 2HB ARG 24 2HB ARG 24 -11.198 -6.618 -18.240 194 1HG ARG 24 1HG ARG 24 -13.397 -6.765 -19.263 195 2HG ARG 24 2HG ARG 24 -13.485 -6.010 -17.672 196 1HD ARG 24 1HD ARG 24 -14.900 -4.812 -19.219 197 2HD ARG 24 2HD ARG 24 -13.539 -3.795 -18.755 198 HE ARG 24 HE ARG 24 -12.767 -5.059 -21.075 199 1HH1 ARG 24 1HH1 ARG 24 -15.357 -2.931 -20.104 200 2HH1 ARG 24 2HH1 ARG 24 -15.514 -2.204 -21.667 201 1HH2 ARG 24 1HH2 ARG 24 -12.973 -4.102 -23.134 202 2HH2 ARG 24 2HH2 ARG 24 -14.162 -2.868 -23.386 203 H PHE 25 H PHE 25 -8.831 -3.956 -16.949 204 HA PHE 25 HA PHE 25 -8.851 -5.888 -14.818 205 1HB PHE 25 1HB PHE 25 -6.895 -3.936 -15.937 206 2HB PHE 25 2HB PHE 25 -6.650 -4.491 -14.284 207 HD1 PHE 25 HD1 PHE 25 -6.991 -7.158 -14.062 208 HD2 PHE 25 HD2 PHE 25 -5.761 -5.074 -17.562 209 HE1 PHE 25 HE1 PHE 25 -5.922 -9.208 -14.901 210 HE2 PHE 25 HE2 PHE 25 -4.691 -7.121 -18.410 211 HZ PHE 25 HZ PHE 25 -4.770 -9.192 -17.078 212 H GLU 26 H GLU 26 -10.152 -5.461 -13.136 213 HA GLU 26 HA GLU 26 -9.586 -3.172 -11.497 214 1HB GLU 26 1HB GLU 26 -12.248 -2.779 -11.479 215 2HB GLU 26 2HB GLU 26 -11.145 -1.862 -12.493 216 1HG GLU 26 1HG GLU 26 -12.344 -2.488 -14.241 217 2HG GLU 26 2HG GLU 26 -11.787 -4.138 -13.979 218 H VAL 27 H VAL 27 -9.379 -4.116 -9.594 219 HA VAL 27 HA VAL 27 -11.570 -5.690 -8.534 220 HB VAL 27 HB VAL 27 -9.896 -7.197 -9.744 221 1HG1 VAL 27 1HG1 VAL 27 -7.779 -7.398 -9.079 222 2HG1 VAL 27 2HG1 VAL 27 -8.215 -7.376 -7.370 223 3HG1 VAL 27 3HG1 VAL 27 -8.035 -5.860 -8.256 224 1HG2 VAL 27 1HG2 VAL 27 -10.314 -8.970 -8.267 225 2HG2 VAL 27 2HG2 VAL 27 -11.641 -7.838 -8.007 226 3HG2 VAL 27 3HG2 VAL 27 -10.304 -7.909 -6.858 227 HA PRO 28 HA PRO 28 -9.044 -2.696 -5.695 228 1HB PRO 28 1HB PRO 28 -11.840 -1.748 -5.311 229 2HB PRO 28 2HB PRO 28 -10.338 -0.822 -5.393 230 1HG PRO 28 1HG PRO 28 -12.027 -0.864 -7.452 231 2HG PRO 28 2HG PRO 28 -10.273 -0.878 -7.707 232 1HD PRO 28 1HD PRO 28 -12.243 -3.101 -7.954 233 2HD PRO 28 2HD PRO 28 -10.768 -2.783 -8.888 234 H LYS 29 H LYS 29 -8.586 -4.124 -4.098 235 HA LYS 29 HA LYS 29 -10.688 -4.633 -2.145 236 1HB LYS 29 1HB LYS 29 -9.852 -6.618 -3.959 237 2HB LYS 29 2HB LYS 29 -9.106 -7.026 -2.419 238 1HG LYS 29 1HG LYS 29 -11.089 -8.130 -2.223 239 2HG LYS 29 2HG LYS 29 -11.518 -6.585 -1.490 240 1HD LYS 29 1HD LYS 29 -13.060 -6.193 -3.051 241 2HD LYS 29 2HD LYS 29 -11.909 -6.512 -4.350 242 1HE LYS 29 1HE LYS 29 -13.537 -8.548 -2.834 243 2HE LYS 29 2HE LYS 29 -13.765 -8.052 -4.511 244 1HZ LYS 29 1HZ LYS 29 -11.201 -9.208 -3.614 245 2HZ LYS 29 2HZ LYS 29 -11.840 -9.135 -5.175 246 3HZ LYS 29 3HZ LYS 29 -12.495 -10.207 -4.043 247 H ALA 30 H ALA 30 -8.464 -2.872 -2.121 248 HA ALA 30 HA ALA 30 -6.844 -4.082 0.024 249 1HB ALA 30 1HB ALA 30 -5.049 -2.452 -0.673 250 2HB ALA 30 2HB ALA 30 -6.002 -2.155 -2.128 251 3HB ALA 30 3HB ALA 30 -5.369 -3.769 -1.801 252 H TYR 31 H TYR 31 -8.232 -3.333 1.635 253 HA TYR 31 HA TYR 31 -7.692 -0.714 2.576 254 1HB TYR 31 1HB TYR 31 -9.999 0.168 2.511 255 2HB TYR 31 2HB TYR 31 -9.330 -0.068 0.900 256 HD1 TYR 31 HD1 TYR 31 -11.726 -1.380 3.369 257 HD2 TYR 31 HD2 TYR 31 -10.301 -1.625 -0.629 258 HE1 TYR 31 HE1 TYR 31 -13.684 -2.737 2.765 259 HE2 TYR 31 HE2 TYR 31 -12.257 -2.983 -1.247 260 HH TYR 31 HH TYR 31 -14.926 -3.127 0.188 261 H SER 32 H SER 32 -8.053 -0.557 4.710 262 HA SER 32 HA SER 32 -8.569 -2.897 6.195 263 1HB SER 32 1HB SER 32 -8.940 -0.607 7.849 264 2HB SER 32 2HB SER 32 -7.537 -1.669 7.759 265 HG SER 32 HG SER 32 -6.830 -0.353 5.972 266 H VAL 33 H VAL 33 -10.189 -2.255 8.283 267 HA VAL 33 HA VAL 33 -12.761 -1.455 7.159 268 HB VAL 33 HB VAL 33 -13.558 -3.556 8.716 269 1HG1 VAL 33 1HG1 VAL 33 -14.543 -4.314 6.811 270 2HG1 VAL 33 2HG1 VAL 33 -13.078 -4.119 5.848 271 3HG1 VAL 33 3HG1 VAL 33 -14.060 -2.712 6.254 272 1HG2 VAL 33 1HG2 VAL 33 -10.877 -4.129 8.230 273 2HG2 VAL 33 2HG2 VAL 33 -11.776 -5.122 7.081 274 3HG2 VAL 33 3HG2 VAL 33 -12.122 -5.237 8.804 275 H ILE 34 H ILE 34 -14.087 -0.442 8.574 276 HA ILE 34 HA ILE 34 -12.941 0.295 11.122 277 HB ILE 34 HB ILE 34 -13.945 1.957 9.570 278 1HG1 ILE 34 1HG1 ILE 34 -13.749 2.174 12.130 279 2HG1 ILE 34 2HG1 ILE 34 -14.783 3.316 11.280 280 1HG2 ILE 34 1HG2 ILE 34 -15.874 0.371 8.975 281 2HG2 ILE 34 2HG2 ILE 34 -16.225 2.092 9.124 282 3HG2 ILE 34 3HG2 ILE 34 -16.647 0.990 10.433 283 1HD1 ILE 34 1HD1 ILE 34 -16.256 0.979 12.100 284 2HD1 ILE 34 2HD1 ILE 34 -16.556 2.682 12.441 285 3HD1 ILE 34 3HD1 ILE 34 -15.458 1.758 13.466 286 H GLN 35 H GLN 35 -13.436 -0.639 12.990 287 HA GLN 35 HA GLN 35 -16.084 -1.866 13.321 288 1HB GLN 35 1HB GLN 35 -13.501 -3.207 13.317 289 2HB GLN 35 2HB GLN 35 -14.373 -3.473 14.821 290 1HG GLN 35 1HG GLN 35 -14.791 -5.210 13.128 291 2HG GLN 35 2HG GLN 35 -16.255 -4.369 13.637 292 1HE2 GLN 35 1HE2 GLN 35 -13.729 -3.452 11.333 293 2HE2 GLN 35 2HE2 GLN 35 -14.787 -3.286 9.977 294 H GLY 36 H GLY 36 -16.918 -0.424 14.765 295 1HA GLY 36 1HA GLY 36 -17.240 0.628 16.786 296 2HA GLY 36 2HA GLY 36 -16.108 -0.535 17.464 297 H ASN 37 H ASN 37 -13.816 -0.066 17.278 298 HA ASN 37 HA ASN 37 -13.100 2.684 16.673 299 1HB ASN 37 1HB ASN 37 -13.767 2.108 19.257 300 2HB ASN 37 2HB ASN 37 -12.032 1.809 19.277 301 1HD2 ASN 37 1HD2 ASN 37 -13.911 4.175 17.436 302 2HD2 ASN 37 2HD2 ASN 37 -13.128 5.567 18.093 303 H ARG 38 H ARG 38 -12.493 -0.121 15.740 304 HA ARG 38 HA ARG 38 -9.573 0.175 15.766 305 1HB ARG 38 1HB ARG 38 -9.565 -2.437 15.714 306 2HB ARG 38 2HB ARG 38 -9.653 -1.590 17.247 307 1HG ARG 38 1HG ARG 38 -12.294 -2.017 16.268 308 2HG ARG 38 2HG ARG 38 -11.401 -3.533 16.208 309 1HD ARG 38 1HD ARG 38 -10.890 -3.418 18.523 310 2HD ARG 38 2HD ARG 38 -11.493 -1.764 18.637 311 HE ARG 38 HE ARG 38 -13.681 -3.069 17.841 312 1HH1 ARG 38 1HH1 ARG 38 -11.371 -3.807 20.357 313 2HH1 ARG 38 2HH1 ARG 38 -12.528 -4.632 21.346 314 1HH2 ARG 38 1HH2 ARG 38 -15.198 -4.152 19.140 315 2HH2 ARG 38 2HH2 ARG 38 -14.701 -4.827 20.656 316 H THR 39 H THR 39 -8.482 -0.760 13.984 317 HA THR 39 HA THR 39 -10.219 -1.104 11.636 318 HB THR 39 HB THR 39 -8.133 0.675 12.040 319 HG1 THR 39 HG1 THR 39 -9.025 -0.208 9.513 320 1HG2 THR 39 1HG2 THR 39 -6.256 0.152 10.908 321 2HG2 THR 39 2HG2 THR 39 -7.084 -0.959 9.818 322 3HG2 THR 39 3HG2 THR 39 -6.671 -1.471 11.449 323 H PHE 40 H PHE 40 -10.199 -2.994 10.535 324 HA PHE 40 HA PHE 40 -8.346 -5.069 11.489 325 1HB PHE 40 1HB PHE 40 -10.991 -5.246 10.055 326 2HB PHE 40 2HB PHE 40 -9.969 -6.641 10.351 327 HD1 PHE 40 HD1 PHE 40 -10.817 -7.971 11.998 328 HD2 PHE 40 HD2 PHE 40 -11.127 -3.746 12.404 329 HE1 PHE 40 HE1 PHE 40 -11.894 -8.265 14.190 330 HE2 PHE 40 HE2 PHE 40 -12.197 -4.032 14.595 331 HZ PHE 40 HZ PHE 40 -12.583 -6.293 15.493 332 H ILE 41 H ILE 41 -6.633 -4.126 10.131 333 HA ILE 41 HA ILE 41 -6.894 -4.113 7.292 334 HB ILE 41 HB ILE 41 -5.258 -2.746 8.702 335 1HG1 ILE 41 1HG1 ILE 41 -3.459 -3.566 6.699 336 2HG1 ILE 41 2HG1 ILE 41 -5.070 -3.853 6.050 337 1HG2 ILE 41 1HG2 ILE 41 -4.284 -5.304 9.346 338 2HG2 ILE 41 2HG2 ILE 41 -3.626 -3.743 9.820 339 3HG2 ILE 41 3HG2 ILE 41 -3.054 -4.533 8.352 340 1HD1 ILE 41 1HD1 ILE 41 -5.426 -1.391 7.036 341 2HD1 ILE 41 2HD1 ILE 41 -4.849 -1.711 5.400 342 3HD1 ILE 41 3HD1 ILE 41 -3.699 -1.324 6.680 343 H GLN 42 H GLN 42 -6.720 -5.724 5.893 344 HA GLN 42 HA GLN 42 -5.569 -8.267 6.837 345 1HB GLN 42 1HB GLN 42 -6.980 -9.042 4.688 346 2HB GLN 42 2HB GLN 42 -7.658 -8.971 6.308 347 1HG GLN 42 1HG GLN 42 -8.552 -6.740 5.823 348 2HG GLN 42 2HG GLN 42 -7.896 -6.846 4.190 349 1HE2 GLN 42 1HE2 GLN 42 -9.470 -9.359 6.098 350 2HE2 GLN 42 2HE2 GLN 42 -10.803 -9.590 5.025 351 H ASN 43 H ASN 43 -5.572 -5.872 4.304 352 HA ASN 43 HA ASN 43 -3.585 -7.408 2.794 353 1HB ASN 43 1HB ASN 43 -5.490 -5.227 2.119 354 2HB ASN 43 2HB ASN 43 -3.961 -5.255 1.247 355 1HD2 ASN 43 1HD2 ASN 43 -6.527 -7.474 2.274 356 2HD2 ASN 43 2HD2 ASN 43 -6.574 -8.373 0.800 357 H PHE 44 H PHE 44 -2.830 -6.365 5.278 358 HA PHE 44 HA PHE 44 -1.680 -3.905 5.438 359 1HB PHE 44 1HB PHE 44 0.052 -4.957 6.909 360 2HB PHE 44 2HB PHE 44 -1.604 -5.394 7.315 361 HD1 PHE 44 HD1 PHE 44 1.620 -6.586 6.156 362 HD2 PHE 44 HD2 PHE 44 -2.456 -7.641 6.787 363 HE1 PHE 44 HE1 PHE 44 2.217 -8.968 6.007 364 HE2 PHE 44 HE2 PHE 44 -1.864 -10.026 6.642 365 HZ PHE 44 HZ PHE 44 0.475 -10.691 6.252 366 H ARG 45 H ARG 45 -0.649 -6.527 3.395 367 HA ARG 45 HA ARG 45 1.952 -5.376 2.881 368 1HB ARG 45 1HB ARG 45 1.194 -7.890 2.770 369 2HB ARG 45 2HB ARG 45 0.707 -7.463 1.136 370 1HG ARG 45 1HG ARG 45 3.478 -7.124 2.264 371 2HG ARG 45 2HG ARG 45 2.950 -8.456 1.235 372 1HD ARG 45 1HD ARG 45 2.479 -6.905 -0.573 373 2HD ARG 45 2HD ARG 45 2.909 -5.542 0.457 374 HE ARG 45 HE ARG 45 4.698 -7.196 -0.999 375 1HH1 ARG 45 1HH1 ARG 45 4.377 -5.401 1.977 376 2HH1 ARG 45 2HH1 ARG 45 6.080 -5.142 2.151 377 1HH2 ARG 45 1HH2 ARG 45 6.941 -6.853 -0.771 378 2HH2 ARG 45 2HH2 ARG 45 7.534 -5.963 0.591 379 H GLU 46 H GLU 46 -0.947 -6.002 0.899 380 HA GLU 46 HA GLU 46 -0.101 -4.502 -1.333 381 1HB GLU 46 1HB GLU 46 -2.214 -6.136 -0.847 382 2HB GLU 46 2HB GLU 46 -3.002 -4.566 -0.796 383 1HG GLU 46 1HG GLU 46 -2.917 -4.339 -3.002 384 2HG GLU 46 2HG GLU 46 -1.220 -4.812 -3.066 385 H VAL 47 H VAL 47 -2.040 -3.686 1.486 386 HA VAL 47 HA VAL 47 -2.569 -1.005 0.731 387 HB VAL 47 HB VAL 47 -2.930 -2.655 3.165 388 1HG1 VAL 47 1HG1 VAL 47 -1.953 -0.967 4.401 389 2HG1 VAL 47 2HG1 VAL 47 -3.647 -0.477 4.385 390 3HG1 VAL 47 3HG1 VAL 47 -2.496 0.300 3.298 391 1HG2 VAL 47 1HG2 VAL 47 -4.673 -0.603 1.815 392 2HG2 VAL 47 2HG2 VAL 47 -5.173 -1.740 3.062 393 3HG2 VAL 47 3HG2 VAL 47 -4.683 -2.331 1.475 394 H ALA 48 H ALA 48 -0.042 -2.569 2.645 395 HA ALA 48 HA ALA 48 1.165 -0.322 3.730 396 1HB ALA 48 1HB ALA 48 1.974 -2.280 4.605 397 2HB ALA 48 2HB ALA 48 3.305 -1.789 3.560 398 3HB ALA 48 3HB ALA 48 2.177 -3.033 3.022 399 H ASP 49 H ASP 49 1.483 -1.694 0.524 400 HA ASP 49 HA ASP 49 3.695 0.017 -0.184 401 1HB ASP 49 1HB ASP 49 2.904 -2.343 -1.178 402 2HB ASP 49 2HB ASP 49 2.091 -1.278 -2.321 403 H ALA 50 H ALA 50 0.447 -0.275 -1.645 404 HA ALA 50 HA ALA 50 0.469 2.030 -3.095 405 1HB ALA 50 1HB ALA 50 -1.988 1.056 -1.672 406 2HB ALA 50 2HB ALA 50 -1.305 0.263 -3.086 407 3HB ALA 50 3HB ALA 50 -1.891 1.922 -3.202 408 H LEU 51 H LEU 51 -0.778 1.809 0.274 409 HA LEU 51 HA LEU 51 -1.299 4.566 0.453 410 1HB LEU 51 1HB LEU 51 -2.467 3.448 2.073 411 2HB LEU 51 2HB LEU 51 -1.164 2.319 2.391 412 HG LEU 51 HG LEU 51 0.042 4.075 3.615 413 1HD1 LEU 51 1HD1 LEU 51 -2.330 5.818 3.671 414 2HD1 LEU 51 2HD1 LEU 51 -1.314 5.840 2.229 415 3HD1 LEU 51 3HD1 LEU 51 -0.615 6.210 3.804 416 1HD2 LEU 51 1HD2 LEU 51 -1.226 3.996 5.603 417 2HD2 LEU 51 2HD2 LEU 51 -1.628 2.517 4.731 418 3HD2 LEU 51 3HD2 LEU 51 -2.745 3.880 4.721 419 H ASN 52 H ASN 52 1.574 2.618 1.238 420 HA ASN 52 HA ASN 52 3.122 5.066 1.162 421 1HB ASN 52 1HB ASN 52 2.304 4.106 3.654 422 2HB ASN 52 2HB ASN 52 3.980 3.593 3.500 423 1HD2 ASN 52 1HD2 ASN 52 2.683 5.641 5.193 424 2HD2 ASN 52 2HD2 ASN 52 3.547 7.103 4.873 425 H ARG 53 H ARG 53 4.095 4.215 -0.628 426 HA ARG 53 HA ARG 53 5.058 1.948 -1.451 427 1HB ARG 53 1HB ARG 53 6.799 4.411 -1.248 428 2HB ARG 53 2HB ARG 53 7.065 3.061 -2.343 429 1HG ARG 53 1HG ARG 53 5.624 3.867 -3.826 430 2HG ARG 53 2HG ARG 53 4.383 4.102 -2.594 431 1HD ARG 53 1HD ARG 53 5.826 6.164 -1.931 432 2HD ARG 53 2HD ARG 53 6.482 5.998 -3.559 433 HE ARG 53 HE ARG 53 4.539 6.884 -4.357 434 1HH1 ARG 53 1HH1 ARG 53 3.951 5.555 -1.206 435 2HH1 ARG 53 2HH1 ARG 53 2.339 6.171 -1.091 436 1HH2 ARG 53 1HH2 ARG 53 2.415 7.729 -4.217 437 2HH2 ARG 53 2HH2 ARG 53 1.471 7.422 -2.799 438 H ASP 54 H ASP 54 6.795 3.741 1.090 439 HA ASP 54 HA ASP 54 8.502 1.435 1.570 440 1HB ASP 54 1HB ASP 54 8.792 4.228 1.895 441 2HB ASP 54 2HB ASP 54 8.862 3.528 3.510 442 HA PRO 55 HA PRO 55 5.885 -0.087 4.796 443 1HB PRO 55 1HB PRO 55 7.644 -1.722 6.073 444 2HB PRO 55 2HB PRO 55 6.887 -2.124 4.530 445 1HG PRO 55 1HG PRO 55 9.633 -1.103 5.084 446 2HG PRO 55 2HG PRO 55 9.092 -2.284 3.878 447 1HD PRO 55 1HD PRO 55 9.667 0.338 3.312 448 2HD PRO 55 2HD PRO 55 8.557 -0.665 2.358 449 H GLN 56 H GLN 56 9.035 1.287 5.618 450 HA GLN 56 HA GLN 56 8.647 1.520 8.393 451 1HB GLN 56 1HB GLN 56 10.444 2.697 6.366 452 2HB GLN 56 2HB GLN 56 10.234 3.645 7.832 453 1HG GLN 56 1HG GLN 56 11.935 2.401 8.561 454 2HG GLN 56 2HG GLN 56 10.672 1.223 8.904 455 1HE2 GLN 56 1HE2 GLN 56 10.126 -0.182 6.953 456 2HE2 GLN 56 2HE2 GLN 56 11.473 -0.822 6.079 457 H HIS 57 H HIS 57 7.716 3.556 5.699 458 HA HIS 57 HA HIS 57 6.907 5.802 7.248 459 1HB HIS 57 1HB HIS 57 7.248 5.300 4.569 460 2HB HIS 57 2HB HIS 57 5.502 5.404 4.706 461 HD2 HIS 57 HD2 HIS 57 6.832 7.773 3.070 462 HE1 HIS 57 HE1 HIS 57 6.501 10.081 6.615 463 HE2 HIS 57 HE2 HIS 57 6.795 10.139 4.113 464 H LEU 58 H LEU 58 4.876 3.466 5.450 465 HA LEU 58 HA LEU 58 2.429 4.163 6.444 466 1HB LEU 58 1HB LEU 58 3.200 2.235 4.809 467 2HB LEU 58 2HB LEU 58 3.021 1.251 6.251 468 HG LEU 58 HG LEU 58 0.702 2.922 5.912 469 1HD1 LEU 58 1HD1 LEU 58 0.990 2.981 3.600 470 2HD1 LEU 58 2HD1 LEU 58 -0.087 1.613 3.850 471 3HD1 LEU 58 3HD1 LEU 58 1.627 1.350 3.543 472 1HD2 LEU 58 1HD2 LEU 58 0.386 1.069 7.224 473 2HD2 LEU 58 2HD2 LEU 58 1.349 0.025 6.180 474 3HD2 LEU 58 3HD2 LEU 58 -0.278 0.507 5.690 475 H LEU 59 H LEU 59 4.875 2.181 8.019 476 HA LEU 59 HA LEU 59 3.360 1.226 10.164 477 1HB LEU 59 1HB LEU 59 5.762 0.640 9.441 478 2HB LEU 59 2HB LEU 59 6.247 2.015 10.414 479 HG LEU 59 HG LEU 59 4.531 0.382 12.002 480 1HD1 LEU 59 1HD1 LEU 59 6.678 -1.108 10.517 481 2HD1 LEU 59 2HD1 LEU 59 4.972 -1.523 10.684 482 3HD1 LEU 59 3HD1 LEU 59 6.048 -1.641 12.076 483 1HD2 LEU 59 1HD2 LEU 59 6.614 0.165 13.367 484 2HD2 LEU 59 2HD2 LEU 59 6.174 1.824 12.959 485 3HD2 LEU 59 3HD2 LEU 59 7.475 1.016 12.084 486 H LYS 60 H LYS 60 5.576 4.037 10.152 487 HA LYS 60 HA LYS 60 4.861 4.981 12.680 488 1HB LYS 60 1HB LYS 60 5.683 7.233 11.780 489 2HB LYS 60 2HB LYS 60 6.824 5.896 11.771 490 1HG LYS 60 1HG LYS 60 6.565 5.589 9.429 491 2HG LYS 60 2HG LYS 60 5.198 6.701 9.376 492 1HD LYS 60 1HD LYS 60 7.641 7.862 10.496 493 2HD LYS 60 2HD LYS 60 7.785 7.362 8.809 494 1HE LYS 60 1HE LYS 60 7.023 9.540 8.623 495 2HE LYS 60 2HE LYS 60 5.536 8.601 8.501 496 1HZ LYS 60 1HZ LYS 60 5.504 10.594 10.028 497 2HZ LYS 60 2HZ LYS 60 6.488 9.702 11.076 498 3HZ LYS 60 3HZ LYS 60 4.941 9.139 10.684 499 H PHE 61 H PHE 61 3.272 5.312 9.599 500 HA PHE 61 HA PHE 61 1.586 7.494 10.295 501 1HB PHE 61 1HB PHE 61 2.117 6.015 7.984 502 2HB PHE 61 2HB PHE 61 0.419 5.706 8.327 503 HD1 PHE 61 HD1 PHE 61 -0.556 8.202 9.388 504 HD2 PHE 61 HD2 PHE 61 2.232 7.516 6.249 505 HE1 PHE 61 HE1 PHE 61 -1.155 10.368 8.387 506 HE2 PHE 61 HE2 PHE 61 1.639 9.681 5.241 507 HZ PHE 61 HZ PHE 61 -0.059 11.109 6.310 508 H LEU 62 H LEU 62 1.103 3.966 10.284 509 HA LEU 62 HA LEU 62 -1.563 3.920 11.064 510 1HB LEU 62 1HB LEU 62 0.678 2.034 11.052 511 2HB LEU 62 2HB LEU 62 -0.519 1.699 12.289 512 HG LEU 62 HG LEU 62 -2.267 1.518 10.616 513 1HD1 LEU 62 1HD1 LEU 62 -1.114 1.419 8.162 514 2HD1 LEU 62 2HD1 LEU 62 -0.229 2.749 8.907 515 3HD1 LEU 62 3HD1 LEU 62 -1.986 2.804 8.803 516 1HD2 LEU 62 1HD2 LEU 62 -1.732 -0.588 10.000 517 2HD2 LEU 62 2HD2 LEU 62 -0.368 -0.315 11.085 518 3HD2 LEU 62 3HD2 LEU 62 -0.164 -0.114 9.345 519 H LEU 63 H LEU 63 1.356 4.033 13.056 520 HA LEU 63 HA LEU 63 -0.187 4.040 15.498 521 1HB LEU 63 1HB LEU 63 2.713 4.123 14.818 522 2HB LEU 63 2HB LEU 63 2.210 4.672 16.405 523 HG LEU 63 HG LEU 63 2.932 2.303 16.371 524 1HD1 LEU 63 1HD1 LEU 63 1.394 1.654 17.924 525 2HD1 LEU 63 2HD1 LEU 63 0.023 2.222 16.971 526 3HD1 LEU 63 3HD1 LEU 63 1.027 3.377 17.845 527 1HD2 LEU 63 1HD2 LEU 63 1.012 0.772 15.408 528 2HD2 LEU 63 2HD2 LEU 63 2.339 1.329 14.391 529 3HD2 LEU 63 3HD2 LEU 63 0.777 2.142 14.327 530 H ARG 64 H ARG 64 1.007 6.381 13.284 531 HA ARG 64 HA ARG 64 1.270 8.597 15.019 532 1HB ARG 64 1HB ARG 64 1.797 8.200 12.390 533 2HB ARG 64 2HB ARG 64 0.318 9.136 12.270 534 1HG ARG 64 1HG ARG 64 2.320 10.199 14.139 535 2HG ARG 64 2HG ARG 64 2.795 10.197 12.440 536 1HD ARG 64 1HD ARG 64 0.147 11.281 13.361 537 2HD ARG 64 2HD ARG 64 1.602 12.274 13.332 538 HE ARG 64 HE ARG 64 -0.011 11.560 11.111 539 1HH1 ARG 64 1HH1 ARG 64 3.312 12.107 12.028 540 2HH1 ARG 64 2HH1 ARG 64 3.796 12.605 10.442 541 1HH2 ARG 64 1HH2 ARG 64 0.624 12.227 9.031 542 2HH2 ARG 64 2HH2 ARG 64 2.268 12.693 8.748 543 H GLU 65 H GLU 65 -1.451 7.452 13.044 544 HA GLU 65 HA GLU 65 -3.185 9.492 14.170 545 1HB GLU 65 1HB GLU 65 -3.208 8.715 11.730 546 2HB GLU 65 2HB GLU 65 -4.026 7.274 12.316 547 1HG GLU 65 1HG GLU 65 -5.530 9.048 11.426 548 2HG GLU 65 2HG GLU 65 -5.886 8.536 13.073 549 H LEU 66 H LEU 66 -2.268 6.306 14.888 550 HA LEU 66 HA LEU 66 -4.752 5.540 16.153 551 1HB LEU 66 1HB LEU 66 -2.146 4.290 15.597 552 2HB LEU 66 2HB LEU 66 -2.885 3.792 17.104 553 HG LEU 66 HG LEU 66 -4.845 2.990 15.953 554 1HD1 LEU 66 1HD1 LEU 66 -4.033 4.767 13.914 555 2HD1 LEU 66 2HD1 LEU 66 -5.493 3.782 13.992 556 3HD1 LEU 66 3HD1 LEU 66 -4.040 3.142 13.226 557 1HD2 LEU 66 1HD2 LEU 66 -3.748 1.090 15.676 558 2HD2 LEU 66 2HD2 LEU 66 -2.221 1.966 15.585 559 3HD2 LEU 66 3HD2 LEU 66 -3.148 1.655 14.118 560 H GLY 67 H GLY 67 -5.022 7.269 17.656 561 1HA GLY 67 1HA GLY 67 -3.022 7.821 19.640 562 2HA GLY 67 2HA GLY 67 -4.670 8.427 19.626 563 H THR 68 H THR 68 -4.266 5.021 19.354 564 HA THR 68 HA THR 68 -4.825 4.670 22.211 565 HB THR 68 HB THR 68 -6.542 3.094 21.781 566 HG1 THR 68 HG1 THR 68 -5.623 2.003 20.032 567 1HG2 THR 68 1HG2 THR 68 -8.177 4.253 20.397 568 2HG2 THR 68 2HG2 THR 68 -6.904 5.298 19.767 569 3HG2 THR 68 3HG2 THR 68 -7.337 5.367 21.475 570 H ALA 69 H ALA 69 -4.552 2.302 22.837 571 HA ALA 69 HA ALA 69 -2.146 1.378 23.017 572 1HB ALA 69 1HB ALA 69 -4.185 -0.591 22.028 573 2HB ALA 69 2HB ALA 69 -4.279 0.153 23.624 574 3HB ALA 69 3HB ALA 69 -2.888 -0.842 23.196 575 H GLY 70 H GLY 70 -3.956 0.499 20.056 576 1HA GLY 70 1HA GLY 70 -3.210 0.110 17.914 577 2HA GLY 70 2HA GLY 70 -1.733 0.955 18.354 578 H ASN 71 H ASN 71 -3.196 -2.075 17.755 579 HA ASN 71 HA ASN 71 -0.661 -3.396 17.712 580 1HB ASN 71 1HB ASN 71 -1.789 -3.390 20.194 581 2HB ASN 71 2HB ASN 71 -2.459 -4.874 19.523 582 1HD2 ASN 71 1HD2 ASN 71 -1.272 -6.635 19.671 583 2HD2 ASN 71 2HD2 ASN 71 0.425 -6.690 19.989 584 H LEU 72 H LEU 72 -0.910 -5.734 17.079 585 HA LEU 72 HA LEU 72 -2.999 -5.925 15.076 586 1HB LEU 72 1HB LEU 72 -0.479 -7.373 15.693 587 2HB LEU 72 2HB LEU 72 -1.720 -8.257 14.828 588 HG LEU 72 HG LEU 72 -1.703 -6.199 13.221 589 1HD1 LEU 72 1HD1 LEU 72 1.151 -6.004 14.052 590 2HD1 LEU 72 2HD1 LEU 72 -0.065 -5.062 14.913 591 3HD1 LEU 72 3HD1 LEU 72 0.148 -4.847 13.176 592 1HD2 LEU 72 1HD2 LEU 72 0.439 -7.277 12.145 593 2HD2 LEU 72 2HD2 LEU 72 -1.077 -8.172 12.237 594 3HD2 LEU 72 3HD2 LEU 72 0.201 -8.481 13.412 595 H GLU 73 H GLU 73 -4.935 -6.767 15.541 596 HA GLU 73 HA GLU 73 -5.131 -8.756 17.700 597 1HB GLU 73 1HB GLU 73 -7.014 -6.715 16.614 598 2HB GLU 73 2HB GLU 73 -7.700 -8.205 17.240 599 1HG GLU 73 1HG GLU 73 -7.568 -7.396 19.287 600 2HG GLU 73 2HG GLU 73 -5.816 -7.260 19.129 601 H GLY 74 H GLY 74 -6.329 -10.686 17.352 602 1HA GLY 74 1HA GLY 74 -7.057 -12.501 16.145 603 2HA GLY 74 2HA GLY 74 -7.531 -11.368 14.887 604 H GLY 75 H GLY 75 -6.766 -13.525 13.785 605 1HA GLY 75 1HA GLY 75 -4.046 -14.126 13.538 606 2HA GLY 75 2HA GLY 75 -5.273 -14.486 12.333 607 H ARG 76 H ARG 76 -5.992 -11.698 11.900 608 HA ARG 76 HA ARG 76 -3.808 -11.023 10.102 609 1HB ARG 76 1HB ARG 76 -5.346 -9.507 9.051 610 2HB ARG 76 2HB ARG 76 -6.184 -11.024 9.336 611 1HG ARG 76 1HG ARG 76 -6.706 -9.541 11.614 612 2HG ARG 76 2HG ARG 76 -6.784 -8.363 10.302 613 1HD ARG 76 1HD ARG 76 -8.831 -9.094 9.858 614 2HD ARG 76 2HD ARG 76 -8.115 -10.620 9.347 615 HE ARG 76 HE ARG 76 -8.652 -10.329 12.187 616 1HH1 ARG 76 1HH1 ARG 76 -9.711 -11.576 9.104 617 2HH1 ARG 76 2HH1 ARG 76 -10.780 -12.743 9.804 618 1HH2 ARG 76 1HH2 ARG 76 -10.073 -11.857 13.109 619 2HH2 ARG 76 2HH2 ARG 76 -10.988 -12.902 12.074 620 H ALA 77 H ALA 77 -4.352 -8.177 10.013 621 HA ALA 77 HA ALA 77 -2.996 -7.417 12.511 622 1HB ALA 77 1HB ALA 77 -1.498 -6.624 11.049 623 2HB ALA 77 2HB ALA 77 -2.633 -5.294 10.834 624 3HB ALA 77 3HB ALA 77 -2.643 -6.652 9.710 625 H ILE 78 H ILE 78 -5.089 -7.285 13.608 626 HA ILE 78 HA ILE 78 -6.832 -5.094 12.772 627 HB ILE 78 HB ILE 78 -7.141 -6.994 15.085 628 1HG1 ILE 78 1HG1 ILE 78 -8.692 -7.116 12.523 629 2HG1 ILE 78 2HG1 ILE 78 -7.167 -7.976 12.719 630 1HG2 ILE 78 1HG2 ILE 78 -8.486 -4.596 14.492 631 2HG2 ILE 78 2HG2 ILE 78 -8.867 -5.780 15.743 632 3HG2 ILE 78 3HG2 ILE 78 -9.605 -5.916 14.148 633 1HD1 ILE 78 1HD1 ILE 78 -9.596 -8.999 13.319 634 2HD1 ILE 78 2HD1 ILE 78 -9.090 -8.380 14.891 635 3HD1 ILE 78 3HD1 ILE 78 -8.079 -9.543 14.033 636 H LEU 79 H LEU 79 -5.641 -3.240 13.282 637 HA LEU 79 HA LEU 79 -4.542 -2.894 15.919 638 1HB LEU 79 1HB LEU 79 -4.008 -0.613 15.174 639 2HB LEU 79 2HB LEU 79 -3.398 -1.847 14.090 640 HG LEU 79 HG LEU 79 -5.699 -1.347 12.848 641 1HD1 LEU 79 1HD1 LEU 79 -5.542 0.732 14.795 642 2HD1 LEU 79 2HD1 LEU 79 -6.776 0.447 13.567 643 3HD1 LEU 79 3HD1 LEU 79 -5.365 1.432 13.185 644 1HD2 LEU 79 1HD2 LEU 79 -3.746 -1.208 11.613 645 2HD2 LEU 79 2HD2 LEU 79 -3.046 0.020 12.668 646 3HD2 LEU 79 3HD2 LEU 79 -4.354 0.447 11.563 647 H GLN 80 H GLN 80 -5.105 -0.515 16.851 648 HA GLN 80 HA GLN 80 -8.029 -0.243 16.964 649 1HB GLN 80 1HB GLN 80 -6.636 -1.552 18.932 650 2HB GLN 80 2HB GLN 80 -6.660 0.092 19.548 651 1HG GLN 80 1HG GLN 80 -8.904 0.085 19.888 652 2HG GLN 80 2HG GLN 80 -9.214 -1.052 18.581 653 1HE2 GLN 80 1HE2 GLN 80 -7.519 -0.921 21.690 654 2HE2 GLN 80 2HE2 GLN 80 -8.022 -2.483 22.230 655 H GLY 81 H GLY 81 -8.755 1.835 17.264 656 1HA GLY 81 1HA GLY 81 -8.119 4.049 18.316 657 2HA GLY 81 2HA GLY 81 -6.656 3.910 17.354 658 H LYS 82 H LYS 82 -6.675 4.548 15.243 659 HA LYS 82 HA LYS 82 -9.264 5.372 14.107 660 1HB LYS 82 1HB LYS 82 -7.552 7.183 15.073 661 2HB LYS 82 2HB LYS 82 -6.857 6.995 13.471 662 1HG LYS 82 1HG LYS 82 -8.365 8.837 13.416 663 2HG LYS 82 2HG LYS 82 -9.097 7.515 12.509 664 1HD LYS 82 1HD LYS 82 -10.144 7.007 14.917 665 2HD LYS 82 2HD LYS 82 -9.918 8.749 15.073 666 1HE LYS 82 1HE LYS 82 -11.062 8.031 12.507 667 2HE LYS 82 2HE LYS 82 -12.047 7.450 13.849 668 1HZ LYS 82 1HZ LYS 82 -12.402 9.588 14.621 669 2HZ LYS 82 2HZ LYS 82 -12.459 9.798 12.943 670 3HZ LYS 82 3HZ LYS 82 -11.068 10.233 13.802 671 H PHE 83 H PHE 83 -7.750 6.477 11.738 672 HA PHE 83 HA PHE 83 -7.114 5.783 9.670 673 1HB PHE 83 1HB PHE 83 -5.588 4.122 11.509 674 2HB PHE 83 2HB PHE 83 -5.901 3.294 9.988 675 HD1 PHE 83 HD1 PHE 83 -3.277 3.480 10.252 676 HD2 PHE 83 HD2 PHE 83 -5.856 6.716 9.251 677 HE1 PHE 83 HE1 PHE 83 -1.390 4.658 9.213 678 HE2 PHE 83 HE2 PHE 83 -3.975 7.897 8.199 679 HZ PHE 83 HZ PHE 83 -1.735 6.862 8.180 680 H THR 84 H THR 84 -9.674 5.355 10.220 681 HA THR 84 HA THR 84 -10.423 2.620 9.674 682 HB THR 84 HB THR 84 -12.697 3.408 9.843 683 HG1 THR 84 HG1 THR 84 -12.235 5.412 8.646 684 1HG2 THR 84 1HG2 THR 84 -10.995 3.564 11.925 685 2HG2 THR 84 2HG2 THR 84 -12.728 3.873 12.033 686 3HG2 THR 84 3HG2 THR 84 -11.601 5.218 11.873 687 H HIS 85 H HIS 85 -9.159 2.537 7.673 688 HA HIS 85 HA HIS 85 -8.800 2.740 5.417 689 1HB HIS 85 1HB HIS 85 -10.772 2.171 4.062 690 2HB HIS 85 2HB HIS 85 -10.662 1.149 5.491 691 HD2 HIS 85 HD2 HIS 85 -12.669 4.465 4.596 692 HE1 HIS 85 HE1 HIS 85 -15.048 1.954 7.052 693 HE2 HIS 85 HE2 HIS 85 -14.926 4.146 5.814 694 H PHE 86 H PHE 86 -8.986 5.249 6.747 695 HA PHE 86 HA PHE 86 -10.465 6.958 4.904 696 1HB PHE 86 1HB PHE 86 -10.142 7.191 7.573 697 2HB PHE 86 2HB PHE 86 -8.807 8.194 7.021 698 HD1 PHE 86 HD1 PHE 86 -12.298 7.649 5.830 699 HD2 PHE 86 HD2 PHE 86 -9.337 10.419 7.119 700 HE1 PHE 86 HE1 PHE 86 -13.859 9.504 5.416 701 HE2 PHE 86 HE2 PHE 86 -10.894 12.280 6.709 702 HZ PHE 86 HZ PHE 86 -13.159 11.824 5.858 703 H LEU 87 H LEU 87 -7.261 7.287 6.376 704 HA LEU 87 HA LEU 87 -6.221 8.726 4.151 705 1HB LEU 87 1HB LEU 87 -4.974 7.514 6.603 706 2HB LEU 87 2HB LEU 87 -4.004 8.283 5.363 707 HG LEU 87 HG LEU 87 -5.535 10.336 5.743 708 1HD1 LEU 87 1HD1 LEU 87 -6.758 10.503 7.676 709 2HD1 LEU 87 2HD1 LEU 87 -5.846 9.235 8.494 710 3HD1 LEU 87 3HD1 LEU 87 -7.026 8.815 7.257 711 1HD2 LEU 87 1HD2 LEU 87 -3.176 9.363 7.125 712 2HD2 LEU 87 2HD2 LEU 87 -4.095 10.509 8.100 713 3HD2 LEU 87 3HD2 LEU 87 -3.536 10.970 6.493 714 H ILE 88 H ILE 88 -5.899 5.417 5.330 715 HA ILE 88 HA ILE 88 -3.924 4.521 3.597 716 HB ILE 88 HB ILE 88 -6.287 2.847 4.431 717 1HG1 ILE 88 1HG1 ILE 88 -3.786 3.405 6.063 718 2HG1 ILE 88 2HG1 ILE 88 -5.388 4.050 6.414 719 1HG2 ILE 88 1HG2 ILE 88 -4.280 2.182 2.822 720 2HG2 ILE 88 2HG2 ILE 88 -5.035 1.034 3.926 721 3HG2 ILE 88 3HG2 ILE 88 -3.518 1.820 4.368 722 1HD1 ILE 88 1HD1 ILE 88 -5.652 2.270 7.718 723 2HD1 ILE 88 2HD1 ILE 88 -4.256 1.452 7.016 724 3HD1 ILE 88 3HD1 ILE 88 -5.827 1.344 6.228 725 H ASN 89 H ASN 89 -7.429 3.990 3.172 726 HA ASN 89 HA ASN 89 -7.362 3.048 0.581 727 1HB ASN 89 1HB ASN 89 -9.346 3.165 2.180 728 2HB ASN 89 2HB ASN 89 -9.576 4.815 1.611 729 1HD2 ASN 89 1HD2 ASN 89 -8.954 1.613 0.202 730 2HD2 ASN 89 2HD2 ASN 89 -10.157 1.736 -1.031 731 H GLU 90 H GLU 90 -7.523 6.414 1.665 732 HA GLU 90 HA GLU 90 -7.966 7.615 -0.823 733 1HB GLU 90 1HB GLU 90 -6.764 8.534 1.756 734 2HB GLU 90 2HB GLU 90 -6.654 9.573 0.341 735 1HG GLU 90 1HG GLU 90 -9.146 9.365 0.124 736 2HG GLU 90 2HG GLU 90 -9.139 8.573 1.698 737 H ARG 91 H ARG 91 -4.863 7.235 0.891 738 HA ARG 91 HA ARG 91 -3.206 8.216 -1.112 739 1HB ARG 91 1HB ARG 91 -2.868 6.428 1.223 740 2HB ARG 91 2HB ARG 91 -1.592 6.397 0.016 741 1HG ARG 91 1HG ARG 91 -2.171 9.106 0.516 742 2HG ARG 91 2HG ARG 91 -2.072 8.299 2.082 743 1HD ARG 91 1HD ARG 91 0.139 8.013 1.914 744 2HD ARG 91 2HD ARG 91 0.030 7.476 0.239 745 HE ARG 91 HE ARG 91 0.816 10.026 1.120 746 1HH1 ARG 91 1HH1 ARG 91 -1.142 8.516 -1.345 747 2HH1 ARG 91 2HH1 ARG 91 -0.940 9.813 -2.474 748 1HH2 ARG 91 1HH2 ARG 91 1.083 11.728 -0.362 749 2HH2 ARG 91 2HH2 ARG 91 0.324 11.637 -1.917 750 H ILE 92 H ILE 92 -4.191 4.854 -0.485 751 HA ILE 92 HA ILE 92 -2.731 3.606 -2.484 752 HB ILE 92 HB ILE 92 -5.506 2.858 -1.549 753 1HG1 ILE 92 1HG1 ILE 92 -2.970 1.641 -0.514 754 2HG1 ILE 92 2HG1 ILE 92 -3.529 3.168 0.150 755 1HG2 ILE 92 1HG2 ILE 92 -3.965 0.583 -2.152 756 2HG2 ILE 92 2HG2 ILE 92 -3.761 1.700 -3.501 757 3HG2 ILE 92 3HG2 ILE 92 -5.377 1.194 -3.013 758 1HD1 ILE 92 1HD1 ILE 92 -5.273 0.733 0.029 759 2HD1 ILE 92 2HD1 ILE 92 -5.494 2.195 0.988 760 3HD1 ILE 92 3HD1 ILE 92 -4.193 1.072 1.381 761 H GLU 93 H GLU 93 -6.147 4.627 -2.666 762 HA GLU 93 HA GLU 93 -6.647 4.066 -5.312 763 1HB GLU 93 1HB GLU 93 -7.795 5.830 -3.278 764 2HB GLU 93 2HB GLU 93 -8.061 6.403 -4.919 765 1HG GLU 93 1HG GLU 93 -9.891 4.994 -4.068 766 2HG GLU 93 2HG GLU 93 -9.135 4.344 -5.523 767 H ASP 94 H ASP 94 -4.803 6.683 -3.954 768 HA ASP 94 HA ASP 94 -4.734 8.284 -6.321 769 1HB ASP 94 1HB ASP 94 -4.315 9.124 -3.981 770 2HB ASP 94 2HB ASP 94 -2.759 8.303 -4.033 771 H TYR 95 H TYR 95 -2.795 5.672 -5.018 772 HA TYR 95 HA TYR 95 -0.736 6.008 -7.028 773 1HB TYR 95 1HB TYR 95 -0.169 5.299 -4.712 774 2HB TYR 95 2HB TYR 95 -1.053 3.800 -4.984 775 HD1 TYR 95 HD1 TYR 95 -0.247 2.268 -6.855 776 HD2 TYR 95 HD2 TYR 95 2.083 5.491 -5.343 777 HE1 TYR 95 HE1 TYR 95 1.776 1.242 -7.801 778 HE2 TYR 95 HE2 TYR 95 4.114 4.473 -6.287 779 HH TYR 95 HH TYR 95 4.493 2.732 -8.390 780 H VAL 96 H VAL 96 -2.901 3.300 -6.105 781 HA VAL 96 HA VAL 96 -2.398 1.758 -8.387 782 HB VAL 96 HB VAL 96 -4.501 0.569 -7.890 783 1HG1 VAL 96 1HG1 VAL 96 -2.208 0.650 -6.380 784 2HG1 VAL 96 2HG1 VAL 96 -3.481 -0.564 -6.261 785 3HG1 VAL 96 3HG1 VAL 96 -3.481 0.824 -5.175 786 1HG2 VAL 96 1HG2 VAL 96 -5.939 1.218 -6.087 787 2HG2 VAL 96 2HG2 VAL 96 -5.784 2.589 -7.183 788 3HG2 VAL 96 3HG2 VAL 96 -4.887 2.566 -5.667 789 H ASN 97 H ASN 97 -4.830 4.251 -7.775 790 HA ASN 97 HA ASN 97 -5.601 4.081 -10.611 791 1HB ASN 97 1HB ASN 97 -7.171 5.211 -8.282 792 2HB ASN 97 2HB ASN 97 -7.695 5.232 -9.962 793 1HD2 ASN 97 1HD2 ASN 97 -8.692 3.910 -7.436 794 2HD2 ASN 97 2HD2 ASN 97 -8.923 2.259 -7.892 795 H LYS 98 H LYS 98 -3.284 5.327 -10.271 796 HA LYS 98 HA LYS 98 -3.612 8.161 -9.846 797 1HB LYS 98 1HB LYS 98 -1.277 8.341 -10.238 798 2HB LYS 98 2HB LYS 98 -1.518 6.871 -9.305 799 1HG LYS 98 1HG LYS 98 -0.574 5.621 -10.878 800 2HG LYS 98 2HG LYS 98 -1.578 6.329 -12.145 801 1HD LYS 98 1HD LYS 98 0.058 7.711 -12.816 802 2HD LYS 98 2HD LYS 98 0.493 8.138 -11.161 803 1HE LYS 98 1HE LYS 98 1.919 6.289 -10.941 804 2HE LYS 98 2HE LYS 98 1.231 5.483 -12.350 805 1HZ LYS 98 1HZ LYS 98 2.153 7.410 -13.670 806 2HZ LYS 98 2HZ LYS 98 3.290 6.329 -13.037 807 3HZ LYS 98 3HZ LYS 98 3.040 7.827 -12.291 808 H PHE 99 H PHE 99 -4.225 6.084 -12.411 809 HA PHE 99 HA PHE 99 -3.516 7.867 -14.541 810 1HB PHE 99 1HB PHE 99 -4.914 6.247 -15.931 811 2HB PHE 99 2HB PHE 99 -3.482 5.591 -15.151 812 HD1 PHE 99 HD1 PHE 99 -3.712 4.121 -13.183 813 HD2 PHE 99 HD2 PHE 99 -7.094 5.496 -15.371 814 HE1 PHE 99 HE1 PHE 99 -5.087 2.355 -12.160 815 HE2 PHE 99 HE2 PHE 99 -8.476 3.737 -14.349 816 HZ PHE 99 HZ PHE 99 -7.474 2.163 -12.740 817 H VAL 100 H VAL 100 -6.612 6.794 -13.121 818 HA VAL 100 HA VAL 100 -8.023 8.833 -14.622 819 HB VAL 100 HB VAL 100 -9.045 6.627 -14.389 820 1HG1 VAL 100 1HG1 VAL 100 -8.850 7.249 -11.469 821 2HG1 VAL 100 2HG1 VAL 100 -8.400 5.778 -12.331 822 3HG1 VAL 100 3HG1 VAL 100 -10.102 6.166 -12.076 823 1HG2 VAL 100 1HG2 VAL 100 -10.324 8.915 -14.428 824 2HG2 VAL 100 2HG2 VAL 100 -10.816 8.427 -12.806 825 3HG2 VAL 100 3HG2 VAL 100 -11.197 7.401 -14.190 826 H ILE 101 H ILE 101 -6.357 8.837 -11.737 827 HA ILE 101 HA ILE 101 -8.177 10.795 -10.518 828 HB ILE 101 HB ILE 101 -7.307 8.854 -9.135 829 1HG1 ILE 101 1HG1 ILE 101 -6.838 10.313 -7.144 830 2HG1 ILE 101 2HG1 ILE 101 -6.808 11.699 -8.230 831 1HG2 ILE 101 1HG2 ILE 101 -5.102 8.784 -8.395 832 2HG2 ILE 101 2HG2 ILE 101 -4.781 10.442 -8.908 833 3HG2 ILE 101 3HG2 ILE 101 -4.959 9.166 -10.109 834 1HD1 ILE 101 1HD1 ILE 101 -9.049 11.740 -8.444 835 2HD1 ILE 101 2HD1 ILE 101 -8.981 10.916 -6.886 836 3HD1 ILE 101 3HD1 ILE 101 -9.200 9.986 -8.368 837 H CYS 102 H CYS 102 -4.718 10.360 -11.319 838 HA CYS 102 HA CYS 102 -4.184 13.161 -10.906 839 1HB CYS 102 1HB CYS 102 -2.535 11.309 -10.402 840 2HB CYS 102 2HB CYS 102 -2.320 11.143 -12.141 841 H HIS 103 H HIS 103 -6.130 12.771 -12.920 842 HA HIS 103 HA HIS 103 -6.643 13.238 -15.097 843 1HB HIS 103 1HB HIS 103 -4.293 15.122 -14.963 844 2HB HIS 103 2HB HIS 103 -5.785 15.311 -15.880 845 HD2 HIS 103 HD2 HIS 103 -4.312 16.655 -12.758 846 HE1 HIS 103 HE1 HIS 103 -8.498 16.723 -12.075 847 HE2 HIS 103 HE2 HIS 103 -6.241 17.483 -11.248 848 H GLU 104 H GLU 104 -5.167 10.957 -14.971 849 HA GLU 104 HA GLU 104 -3.752 9.565 -16.080 850 1HB GLU 104 1HB GLU 104 -3.971 9.600 -18.497 851 2HB GLU 104 2HB GLU 104 -5.527 9.886 -17.737 852 1HG GLU 104 1HG GLU 104 -5.392 12.239 -18.233 853 2HG GLU 104 2HG GLU 104 -3.762 12.045 -18.872 854 H CYS 105 H CYS 105 -2.005 10.769 -14.857 855 HA CYS 105 HA CYS 105 -0.321 12.572 -16.300 856 1HB CYS 105 1HB CYS 105 -0.603 11.931 -13.670 857 2HB CYS 105 2HB CYS 105 0.859 11.036 -14.069 858 H ASN 106 H ASN 106 -0.736 10.443 -17.983 859 HA ASN 106 HA ASN 106 1.346 8.500 -17.812 860 1HB ASN 106 1HB ASN 106 -0.861 8.145 -18.951 861 2HB ASN 106 2HB ASN 106 -0.324 9.239 -20.221 862 1HD2 ASN 106 1HD2 ASN 106 0.424 8.253 -21.935 863 2HD2 ASN 106 2HD2 ASN 106 1.238 6.730 -21.967 864 H ARG 107 H ARG 107 0.728 10.781 -20.457 865 HA ARG 107 HA ARG 107 3.476 10.819 -21.238 866 1HB ARG 107 1HB ARG 107 0.934 11.761 -22.279 867 2HB ARG 107 2HB ARG 107 2.209 12.946 -22.516 868 1HG ARG 107 1HG ARG 107 3.494 11.461 -23.806 869 2HG ARG 107 2HG ARG 107 2.531 10.069 -23.306 870 1HD ARG 107 1HD ARG 107 1.261 10.349 -25.106 871 2HD ARG 107 2HD ARG 107 0.739 11.905 -24.464 872 HE ARG 107 HE ARG 107 3.139 12.427 -25.655 873 1HH1 ARG 107 1HH1 ARG 107 0.131 11.006 -26.709 874 2HH1 ARG 107 2HH1 ARG 107 0.304 11.546 -28.344 875 1HH2 ARG 107 1HH2 ARG 107 3.368 13.141 -27.805 876 2HH2 ARG 107 2HH2 ARG 107 2.142 12.758 -28.968 877 HA PRO 108 HA PRO 108 4.929 13.999 -18.484 878 1HB PRO 108 1HB PRO 108 6.821 14.577 -20.703 879 2HB PRO 108 2HB PRO 108 7.151 14.221 -19.004 880 1HG PRO 108 1HG PRO 108 7.605 12.396 -20.889 881 2HG PRO 108 2HG PRO 108 6.947 11.931 -19.307 882 1HD PRO 108 1HD PRO 108 5.547 12.221 -21.935 883 2HD PRO 108 2HD PRO 108 5.310 11.012 -20.654 884 H ASP 109 H ASP 109 2.852 15.126 -19.014 885 HA ASP 109 HA ASP 109 3.125 17.330 -20.925 886 1HB ASP 109 1HB ASP 109 0.905 15.800 -19.823 887 2HB ASP 109 2HB ASP 109 0.630 17.533 -19.686 888 H THR 110 H THR 110 3.634 16.675 -17.674 889 HA THR 110 HA THR 110 3.607 19.537 -17.038 890 HB THR 110 HB THR 110 2.678 19.039 -14.816 891 HG1 THR 110 HG1 THR 110 2.034 16.446 -15.692 892 1HG2 THR 110 1HG2 THR 110 0.560 19.188 -15.503 893 2HG2 THR 110 2HG2 THR 110 0.643 17.671 -16.399 894 3HG2 THR 110 3HG2 THR 110 1.236 19.163 -17.131 895 H ARG 111 H ARG 111 4.758 19.829 -14.786 896 HA ARG 111 HA ARG 111 7.348 18.532 -15.073 897 1HB ARG 111 1HB ARG 111 6.428 21.081 -14.143 898 2HB ARG 111 2HB ARG 111 7.360 20.312 -12.865 899 1HG ARG 111 1HG ARG 111 9.213 19.976 -14.457 900 2HG ARG 111 2HG ARG 111 8.281 20.833 -15.685 901 1HD ARG 111 1HD ARG 111 9.214 22.710 -14.939 902 2HD ARG 111 2HD ARG 111 8.239 22.522 -13.481 903 HE ARG 111 HE ARG 111 10.173 22.120 -12.358 904 1HH1 ARG 111 1HH1 ARG 111 10.659 21.222 -15.696 905 2HH1 ARG 111 2HH1 ARG 111 12.320 20.792 -15.469 906 1HH2 ARG 111 1HH2 ARG 111 12.362 21.555 -12.058 907 2HH2 ARG 111 2HH2 ARG 111 13.288 20.982 -13.406 908 H ILE 112 H ILE 112 7.258 16.528 -14.247 909 HA ILE 112 HA ILE 112 6.130 16.138 -11.578 910 HB ILE 112 HB ILE 112 7.200 13.981 -13.387 911 1HG1 ILE 112 1HG1 ILE 112 5.541 15.097 -14.705 912 2HG1 ILE 112 2HG1 ILE 112 4.786 13.648 -14.049 913 1HG2 ILE 112 1HG2 ILE 112 5.014 13.755 -11.348 914 2HG2 ILE 112 2HG2 ILE 112 6.713 13.631 -10.892 915 3HG2 ILE 112 3HG2 ILE 112 6.021 12.484 -12.040 916 1HD1 ILE 112 1HD1 ILE 112 4.198 16.484 -13.553 917 2HD1 ILE 112 2HD1 ILE 112 4.127 15.424 -12.146 918 3HD1 ILE 112 3HD1 ILE 112 3.129 15.081 -13.558 919 H ILE 113 H ILE 113 7.292 15.339 -9.875 920 HA ILE 113 HA ILE 113 10.172 14.942 -10.217 921 HB ILE 113 HB ILE 113 9.901 17.278 -9.536 922 1HG1 ILE 113 1HG1 ILE 113 10.838 15.973 -7.026 923 2HG1 ILE 113 2HG1 ILE 113 11.660 15.549 -8.524 924 1HG2 ILE 113 1HG2 ILE 113 7.702 16.533 -8.217 925 2HG2 ILE 113 2HG2 ILE 113 8.587 18.011 -7.842 926 3HG2 ILE 113 3HG2 ILE 113 8.839 16.562 -6.870 927 1HD1 ILE 113 1HD1 ILE 113 12.944 17.293 -7.823 928 2HD1 ILE 113 2HD1 ILE 113 11.592 18.127 -7.058 929 3HD1 ILE 113 3HD1 ILE 113 11.768 18.157 -8.813 930 H ARG 114 H ARG 114 11.026 13.398 -8.879 931 HA ARG 114 HA ARG 114 9.254 12.270 -6.822 932 1HB ARG 114 1HB ARG 114 9.550 11.007 -9.132 933 2HB ARG 114 2HB ARG 114 11.038 10.460 -8.375 934 1HG ARG 114 1HG ARG 114 9.631 9.674 -6.442 935 2HG ARG 114 2HG ARG 114 8.220 9.986 -7.457 936 1HD ARG 114 1HD ARG 114 10.005 8.540 -9.057 937 2HD ARG 114 2HD ARG 114 10.037 7.749 -7.487 938 HE ARG 114 HE ARG 114 7.594 7.542 -7.684 939 1HH1 ARG 114 1HH1 ARG 114 9.437 8.106 -10.607 940 2HH1 ARG 114 2HH1 ARG 114 8.253 7.376 -11.635 941 1HH2 ARG 114 1HH2 ARG 114 6.050 6.582 -9.046 942 2HH2 ARG 114 2HH2 ARG 114 6.335 6.513 -10.752 943 H GLU 115 H GLU 115 10.226 12.543 -4.910 944 HA GLU 115 HA GLU 115 13.121 12.038 -4.748 945 1HB GLU 115 1HB GLU 115 11.833 13.973 -2.874 946 2HB GLU 115 2HB GLU 115 13.495 13.904 -3.438 947 1HG GLU 115 1HG GLU 115 11.644 14.462 -5.597 948 2HG GLU 115 2HG GLU 115 11.522 15.640 -4.294 949 H GLY 116 H GLY 116 13.864 11.000 -2.898 950 1HA GLY 116 1HA GLY 116 13.614 10.091 -0.718 951 2HA GLY 116 2HA GLY 116 11.872 10.203 -0.901 952 H ARG 117 H ARG 117 14.041 8.817 -3.302 953 HA ARG 117 HA ARG 117 14.160 6.728 -4.203 954 1HB ARG 117 1HB ARG 117 13.814 6.233 -1.284 955 2HB ARG 117 2HB ARG 117 13.655 4.860 -2.370 956 1HG ARG 117 1HG ARG 117 15.952 6.042 -3.266 957 2HG ARG 117 2HG ARG 117 16.031 6.329 -1.526 958 1HD ARG 117 1HD ARG 117 15.494 3.858 -1.252 959 2HD ARG 117 2HD ARG 117 15.825 3.706 -2.977 960 HE ARG 117 HE ARG 117 17.876 4.889 -1.259 961 1HH1 ARG 117 1HH1 ARG 117 16.791 2.183 -3.189 962 2HH1 ARG 117 2HH1 ARG 117 18.365 1.473 -3.294 963 1HH2 ARG 117 1HH2 ARG 117 19.941 3.946 -1.400 964 2HH2 ARG 117 2HH2 ARG 117 20.150 2.468 -2.280 965 H ILE 118 H ILE 118 12.008 7.766 -5.102 966 HA ILE 118 HA ILE 118 9.870 7.467 -5.830 967 HB ILE 118 HB ILE 118 10.377 4.559 -5.191 968 1HG1 ILE 118 1HG1 ILE 118 10.874 5.984 -7.809 969 2HG1 ILE 118 2HG1 ILE 118 12.136 5.687 -6.619 970 1HG2 ILE 118 1HG2 ILE 118 8.049 5.751 -5.998 971 2HG2 ILE 118 2HG2 ILE 118 8.474 4.059 -6.254 972 3HG2 ILE 118 3HG2 ILE 118 8.766 5.242 -7.528 973 1HD1 ILE 118 1HD1 ILE 118 10.855 3.854 -8.516 974 2HD1 ILE 118 2HD1 ILE 118 11.136 3.200 -6.902 975 3HD1 ILE 118 3HD1 ILE 118 12.484 3.843 -7.841 976 H SER 119 H SER 119 9.533 8.601 -3.663 977 HA SER 119 HA SER 119 7.458 7.119 -2.225 978 1HB SER 119 1HB SER 119 9.201 6.794 -0.699 979 2HB SER 119 2HB SER 119 9.889 8.387 -1.002 980 HG SER 119 HG SER 119 7.310 8.181 0.097 981 H LEU 120 H LEU 120 8.866 10.135 -3.237 982 HA LEU 120 HA LEU 120 6.361 11.510 -2.529 983 1HB LEU 120 1HB LEU 120 8.955 12.989 -2.735 984 2HB LEU 120 2HB LEU 120 7.511 13.405 -1.831 985 HG LEU 120 HG LEU 120 9.152 11.028 -1.018 986 1HD1 LEU 120 1HD1 LEU 120 10.615 12.304 0.287 987 2HD1 LEU 120 2HD1 LEU 120 9.678 13.777 0.060 988 3HD1 LEU 120 3HD1 LEU 120 10.602 13.108 -1.282 989 1HD2 LEU 120 1HD2 LEU 120 7.984 12.760 1.013 990 2HD2 LEU 120 2HD2 LEU 120 7.854 11.015 0.798 991 3HD2 LEU 120 3HD2 LEU 120 6.791 12.096 -0.103 992 H LEU 121 H LEU 121 5.547 12.987 -4.067 993 HA LEU 121 HA LEU 121 7.002 13.498 -6.506 994 1HB LEU 121 1HB LEU 121 4.342 12.412 -7.128 995 2HB LEU 121 2HB LEU 121 5.851 12.249 -8.000 996 HG LEU 121 HG LEU 121 6.444 10.601 -6.027 997 1HD1 LEU 121 1HD1 LEU 121 3.517 11.001 -5.818 998 2HD1 LEU 121 2HD1 LEU 121 4.700 10.600 -4.572 999 3HD1 LEU 121 3HD1 LEU 121 4.125 9.352 -5.679 1000 1HD2 LEU 121 1HD2 LEU 121 6.406 9.190 -7.738 1001 2HD2 LEU 121 2HD2 LEU 121 5.445 10.347 -8.657 1002 3HD2 LEU 121 3HD2 LEU 121 4.645 9.121 -7.675 1003 H LYS 122 H LYS 122 6.262 15.332 -7.596 1004 HA LYS 122 HA LYS 122 3.917 16.650 -6.389 1005 1HB LYS 122 1HB LYS 122 6.519 17.561 -6.332 1006 2HB LYS 122 2HB LYS 122 5.812 18.455 -7.671 1007 1HG LYS 122 1HG LYS 122 3.904 18.572 -5.648 1008 2HG LYS 122 2HG LYS 122 5.448 18.807 -4.835 1009 1HD LYS 122 1HD LYS 122 5.983 20.549 -6.563 1010 2HD LYS 122 2HD LYS 122 4.321 20.396 -7.131 1011 1HE LYS 122 1HE LYS 122 3.561 21.699 -5.490 1012 2HE LYS 122 2HE LYS 122 4.408 20.752 -4.267 1013 1HZ LYS 122 1HZ LYS 122 6.429 22.108 -5.349 1014 2HZ LYS 122 2HZ LYS 122 5.554 22.647 -4.006 1015 3HZ LYS 122 3HZ LYS 122 5.182 23.234 -5.547 1016 H CYS 123 H CYS 123 2.497 17.770 -7.699 1017 HA CYS 123 HA CYS 123 2.955 17.718 -10.591 1018 1HB CYS 123 1HB CYS 123 0.773 16.315 -9.112 1019 2HB CYS 123 2HB CYS 123 0.400 17.021 -10.678 1020 H GLU 124 H GLU 124 3.174 19.954 -9.024 1021 HA GLU 124 HA GLU 124 0.945 21.467 -8.475 1022 1HB GLU 124 1HB GLU 124 3.384 22.065 -8.066 1023 2HB GLU 124 2HB GLU 124 3.428 22.637 -9.727 1024 1HG GLU 124 1HG GLU 124 2.890 24.601 -8.803 1025 2HG GLU 124 2HG GLU 124 1.255 23.946 -8.820 1026 H ALA 125 H ALA 125 2.392 20.820 -11.620 1027 HA ALA 125 HA ALA 125 0.964 22.798 -13.059 1028 1HB ALA 125 1HB ALA 125 1.453 20.695 -14.833 1029 2HB ALA 125 2HB ALA 125 2.786 20.663 -13.679 1030 3HB ALA 125 3HB ALA 125 2.433 22.138 -14.579 1031 H CYS 126 H CYS 126 0.426 19.252 -13.292 1032 HA CYS 126 HA CYS 126 -2.296 19.745 -14.126 1033 1HB CYS 126 1HB CYS 126 -2.465 17.413 -14.557 1034 2HB CYS 126 2HB CYS 126 -0.847 17.885 -15.049 1035 H GLY 127 H GLY 127 -2.060 20.855 -11.706 1036 1HA GLY 127 1HA GLY 127 -3.835 20.755 -10.038 1037 2HA GLY 127 2HA GLY 127 -3.579 19.018 -9.967 1038 H ALA 128 H ALA 128 -2.621 18.419 -8.141 1039 HA ALA 128 HA ALA 128 -0.224 19.783 -7.268 1040 1HB ALA 128 1HB ALA 128 -2.220 20.973 -6.219 1041 2HB ALA 128 2HB ALA 128 -0.928 20.444 -5.142 1042 3HB ALA 128 3HB ALA 128 -2.422 19.515 -5.249 1043 H LYS 129 H LYS 129 1.013 18.605 -5.761 1044 HA LYS 129 HA LYS 129 0.094 16.004 -4.895 1045 1HB LYS 129 1HB LYS 129 1.364 16.150 -7.346 1046 2HB LYS 129 2HB LYS 129 2.665 15.732 -6.248 1047 1HG LYS 129 1HG LYS 129 1.963 13.640 -6.045 1048 2HG LYS 129 2HG LYS 129 0.301 14.149 -5.745 1049 1HD LYS 129 1HD LYS 129 0.916 14.613 -8.489 1050 2HD LYS 129 2HD LYS 129 1.388 12.965 -8.079 1051 1HE LYS 129 1HE LYS 129 -1.148 13.528 -6.895 1052 2HE LYS 129 2HE LYS 129 -1.201 13.972 -8.601 1053 1HZ LYS 129 1HZ LYS 129 -0.851 11.346 -7.374 1054 2HZ LYS 129 2HZ LYS 129 -0.025 11.640 -8.819 1055 3HZ LYS 129 3HZ LYS 129 -1.708 11.785 -8.764 1056 H ALA 130 H ALA 130 1.508 15.036 -3.322 1057 HA ALA 130 HA ALA 130 2.903 17.016 -1.756 1058 1HB ALA 130 1HB ALA 130 2.557 15.631 -0.025 1059 2HB ALA 130 2HB ALA 130 3.146 14.223 -0.911 1060 3HB ALA 130 3HB ALA 130 1.484 14.770 -1.129 1061 HA PRO 131 HA PRO 131 6.746 15.858 -3.898 1062 1HB PRO 131 1HB PRO 131 8.189 17.977 -3.033 1063 2HB PRO 131 2HB PRO 131 7.055 18.088 -4.383 1064 1HG PRO 131 1HG PRO 131 6.683 18.890 -1.523 1065 2HG PRO 131 2HG PRO 131 6.201 19.749 -2.997 1066 1HD PRO 131 1HD PRO 131 4.459 18.291 -1.514 1067 2HD PRO 131 2HD PRO 131 4.308 18.477 -3.271 1068 H LEU 132 H LEU 132 6.072 16.443 -0.556 1069 HA LEU 132 HA LEU 132 8.104 14.552 0.227 1070 1HB LEU 132 1HB LEU 132 9.337 16.677 0.174 1071 2HB LEU 132 2HB LEU 132 8.165 17.382 1.270 1072 HG LEU 132 HG LEU 132 9.378 14.937 2.320 1073 1HD1 LEU 132 1HD1 LEU 132 11.087 17.093 1.252 1074 2HD1 LEU 132 2HD1 LEU 132 11.448 15.390 1.539 1075 3HD1 LEU 132 3HD1 LEU 132 11.459 16.533 2.882 1076 1HD2 LEU 132 1HD2 LEU 132 9.355 16.113 4.323 1077 2HD2 LEU 132 2HD2 LEU 132 7.962 16.769 3.463 1078 3HD2 LEU 132 3HD2 LEU 132 9.472 17.679 3.522 1079 H LYS 133 H LYS 133 5.686 16.904 1.326 1080 HA LYS 133 HA LYS 133 4.276 14.928 2.809 1081 1HB LYS 133 1HB LYS 133 6.276 15.446 4.289 1082 2HB LYS 133 2HB LYS 133 5.601 17.056 4.488 1083 1HG LYS 133 1HG LYS 133 4.558 16.205 6.259 1084 2HG LYS 133 2HG LYS 133 3.463 15.468 5.088 1085 1HD LYS 133 1HD LYS 133 4.959 13.472 5.054 1086 2HD LYS 133 2HD LYS 133 5.894 14.209 6.358 1087 1HE LYS 133 1HE LYS 133 4.283 13.825 7.914 1088 2HE LYS 133 2HE LYS 133 2.968 14.016 6.755 1089 1HZ LYS 133 1HZ LYS 133 4.755 11.648 6.890 1090 2HZ LYS 133 2HZ LYS 133 3.394 11.830 5.904 1091 3HZ LYS 133 3HZ LYS 133 3.214 11.724 7.581 1092 H ASN 134 H ASN 134 4.837 18.403 3.356 1093 HA ASN 134 HA ASN 134 2.115 18.944 2.411 1094 1HB ASN 134 1HB ASN 134 3.290 19.737 5.073 1095 2HB ASN 134 2HB ASN 134 1.919 20.586 4.365 1096 1HD2 ASN 134 1HD2 ASN 134 0.087 19.958 5.228 1097 2HD2 ASN 134 2HD2 ASN 134 -0.325 18.348 5.701 1098 H VAL 135 H VAL 135 1.766 21.376 2.196 1099 HA VAL 135 HA VAL 135 4.024 22.441 0.725 1100 HB VAL 135 HB VAL 135 1.687 22.533 -0.163 1101 1HG1 VAL 135 1HG1 VAL 135 1.183 23.742 2.362 1102 2HG1 VAL 135 2HG1 VAL 135 0.038 23.332 1.088 1103 3HG1 VAL 135 3HG1 VAL 135 0.812 24.916 1.100 1104 1HG2 VAL 135 1HG2 VAL 135 3.734 24.231 -0.546 1105 2HG2 VAL 135 2HG2 VAL 135 2.503 25.364 0.014 1106 3HG2 VAL 135 3HG2 VAL 135 2.195 24.356 -1.400 Start of MODEL 4 1 H MET 1 H MET 1 -43.031 -42.393 -4.899 2 HA MET 1 HA MET 1 -42.324 -43.555 -7.510 3 1HB MET 1 1HB MET 1 -44.485 -41.638 -6.632 4 2HB MET 1 2HB MET 1 -43.979 -41.805 -8.307 5 1HG MET 1 1HG MET 1 -44.616 -44.165 -8.262 6 2HG MET 1 2HG MET 1 -45.134 -43.987 -6.586 7 1HE MET 1 1HE MET 1 -45.499 -43.487 -10.105 8 2HE MET 1 2HE MET 1 -46.439 -42.003 -10.266 9 3HE MET 1 3HE MET 1 -47.248 -43.569 -10.318 10 H ASP 2 H ASP 2 -40.553 -42.278 -5.564 11 HA ASP 2 HA ASP 2 -39.520 -40.209 -7.290 12 1HB ASP 2 1HB ASP 2 -41.183 -39.406 -5.214 13 2HB ASP 2 2HB ASP 2 -39.563 -39.183 -4.560 14 H ASP 3 H ASP 3 -37.329 -39.990 -7.123 15 HA ASP 3 HA ASP 3 -36.002 -41.854 -5.294 16 1HB ASP 3 1HB ASP 3 -35.653 -41.696 -7.910 17 2HB ASP 3 2HB ASP 3 -34.537 -40.409 -7.462 18 H TYR 4 H TYR 4 -35.369 -38.605 -6.623 19 HA TYR 4 HA TYR 4 -34.961 -37.429 -4.078 20 1HB TYR 4 1HB TYR 4 -32.611 -38.569 -5.474 21 2HB TYR 4 2HB TYR 4 -32.413 -36.936 -4.847 22 HD1 TYR 4 HD1 TYR 4 -32.094 -40.336 -4.081 23 HD2 TYR 4 HD2 TYR 4 -33.254 -36.630 -2.343 24 HE1 TYR 4 HE1 TYR 4 -31.661 -41.257 -1.842 25 HE2 TYR 4 HE2 TYR 4 -32.823 -37.540 -0.100 26 HH TYR 4 HH TYR 4 -32.666 -39.678 1.021 27 H GLU 5 H GLU 5 -35.227 -35.282 -4.255 28 HA GLU 5 HA GLU 5 -35.366 -34.167 -6.947 29 1HB GLU 5 1HB GLU 5 -37.234 -33.924 -5.225 30 2HB GLU 5 2HB GLU 5 -36.178 -32.796 -4.387 31 1HG GLU 5 1HG GLU 5 -37.664 -31.519 -5.711 32 2HG GLU 5 2HG GLU 5 -36.085 -31.450 -6.491 33 H LYS 6 H LYS 6 -33.335 -33.662 -7.574 34 HA LYS 6 HA LYS 6 -31.699 -32.004 -5.788 35 1HB LYS 6 1HB LYS 6 -31.105 -34.127 -7.636 36 2HB LYS 6 2HB LYS 6 -30.235 -32.674 -8.110 37 1HG LYS 6 1HG LYS 6 -29.281 -32.510 -5.869 38 2HG LYS 6 2HG LYS 6 -30.155 -33.967 -5.392 39 1HD LYS 6 1HD LYS 6 -28.813 -34.691 -7.718 40 2HD LYS 6 2HD LYS 6 -27.657 -33.692 -6.837 41 1HE LYS 6 1HE LYS 6 -27.265 -35.322 -5.375 42 2HE LYS 6 2HE LYS 6 -28.987 -35.513 -5.046 43 1HZ LYS 6 1HZ LYS 6 -27.512 -37.409 -6.147 44 2HZ LYS 6 2HZ LYS 6 -28.013 -36.620 -7.556 45 3HZ LYS 6 3HZ LYS 6 -29.163 -37.231 -6.476 46 H LEU 7 H LEU 7 -30.658 -30.120 -6.610 47 HA LEU 7 HA LEU 7 -32.059 -28.923 -8.911 48 1HB LEU 7 1HB LEU 7 -31.485 -26.718 -7.762 49 2HB LEU 7 2HB LEU 7 -32.776 -27.683 -7.071 50 HG LEU 7 HG LEU 7 -30.317 -28.422 -5.810 51 1HD1 LEU 7 1HD1 LEU 7 -30.733 -25.655 -5.018 52 2HD1 LEU 7 2HD1 LEU 7 -30.123 -25.817 -6.664 53 3HD1 LEU 7 3HD1 LEU 7 -29.237 -26.537 -5.321 54 1HD2 LEU 7 1HD2 LEU 7 -32.576 -28.672 -4.883 55 2HD2 LEU 7 2HD2 LEU 7 -32.713 -26.917 -4.768 56 3HD2 LEU 7 3HD2 LEU 7 -31.513 -27.773 -3.800 57 H LEU 8 H LEU 8 -30.781 -28.711 -10.611 58 HA LEU 8 HA LEU 8 -27.892 -28.412 -10.197 59 1HB LEU 8 1HB LEU 8 -29.483 -29.195 -12.639 60 2HB LEU 8 2HB LEU 8 -27.742 -28.981 -12.625 61 HG LEU 8 HG LEU 8 -29.015 -30.921 -10.732 62 1HD1 LEU 8 1HD1 LEU 8 -28.040 -32.040 -13.260 63 2HD1 LEU 8 2HD1 LEU 8 -29.540 -31.122 -13.390 64 3HD1 LEU 8 3HD1 LEU 8 -29.435 -32.488 -12.279 65 1HD2 LEU 8 1HD2 LEU 8 -26.835 -30.968 -10.190 66 2HD2 LEU 8 2HD2 LEU 8 -26.331 -30.264 -11.726 67 3HD2 LEU 8 3HD2 LEU 8 -26.686 -31.988 -11.621 68 H GLU 9 H GLU 9 -28.266 -26.145 -9.582 69 HA GLU 9 HA GLU 9 -28.815 -24.399 -11.881 70 1HB GLU 9 1HB GLU 9 -29.043 -24.021 -8.917 71 2HB GLU 9 2HB GLU 9 -28.854 -22.623 -9.967 72 1HG GLU 9 1HG GLU 9 -30.868 -24.216 -11.111 73 2HG GLU 9 2HG GLU 9 -31.199 -24.146 -9.380 74 H ARG 10 H ARG 10 -26.910 -24.190 -12.931 75 HA ARG 10 HA ARG 10 -24.423 -23.856 -11.522 76 1HB ARG 10 1HB ARG 10 -25.271 -24.385 -14.239 77 2HB ARG 10 2HB ARG 10 -24.031 -23.140 -14.200 78 1HG ARG 10 1HG ARG 10 -22.481 -24.575 -13.153 79 2HG ARG 10 2HG ARG 10 -23.729 -25.761 -12.768 80 1HD ARG 10 1HD ARG 10 -23.437 -26.781 -14.721 81 2HD ARG 10 2HD ARG 10 -23.677 -25.270 -15.596 82 HE ARG 10 HE ARG 10 -21.438 -25.250 -15.970 83 1HH1 ARG 10 1HH1 ARG 10 -22.013 -27.040 -13.028 84 2HH1 ARG 10 2HH1 ARG 10 -20.341 -27.415 -12.784 85 1HH2 ARG 10 1HH2 ARG 10 -19.241 -25.744 -15.651 86 2HH2 ARG 10 2HH2 ARG 10 -18.766 -26.680 -14.273 87 H ALA 11 H ALA 11 -22.981 -21.980 -12.604 88 HA ALA 11 HA ALA 11 -22.561 -19.748 -12.817 89 1HB ALA 11 1HB ALA 11 -25.310 -18.770 -12.751 90 2HB ALA 11 2HB ALA 11 -25.019 -19.985 -13.995 91 3HB ALA 11 3HB ALA 11 -24.043 -18.516 -13.951 92 H ILE 12 H ILE 12 -22.303 -20.753 -10.397 93 HA ILE 12 HA ILE 12 -23.702 -18.929 -8.567 94 HB ILE 12 HB ILE 12 -22.102 -21.353 -7.761 95 1HG1 ILE 12 1HG1 ILE 12 -25.086 -21.401 -7.805 96 2HG1 ILE 12 2HG1 ILE 12 -24.233 -21.652 -9.325 97 1HG2 ILE 12 1HG2 ILE 12 -22.644 -19.503 -6.110 98 2HG2 ILE 12 2HG2 ILE 12 -23.133 -21.135 -5.658 99 3HG2 ILE 12 3HG2 ILE 12 -24.331 -19.995 -6.272 100 1HD1 ILE 12 1HD1 ILE 12 -23.953 -23.282 -6.815 101 2HD1 ILE 12 2HD1 ILE 12 -22.991 -23.505 -8.277 102 3HD1 ILE 12 3HD1 ILE 12 -24.734 -23.769 -8.319 103 H ASP 13 H ASP 13 -20.642 -19.688 -9.941 104 HA ASP 13 HA ASP 13 -19.446 -17.503 -8.433 105 1HB ASP 13 1HB ASP 13 -17.332 -18.937 -8.165 106 2HB ASP 13 2HB ASP 13 -18.675 -19.253 -7.074 107 H GLN 14 H GLN 14 -18.348 -20.019 -10.742 108 HA GLN 14 HA GLN 14 -17.082 -17.908 -12.314 109 1HB GLN 14 1HB GLN 14 -15.649 -19.759 -11.739 110 2HB GLN 14 2HB GLN 14 -16.792 -20.914 -12.402 111 1HG GLN 14 1HG GLN 14 -15.789 -20.784 -14.365 112 2HG GLN 14 2HG GLN 14 -16.151 -19.061 -14.448 113 1HE2 GLN 14 1HE2 GLN 14 -13.873 -21.285 -12.871 114 2HE2 GLN 14 2HE2 GLN 14 -12.485 -20.277 -13.071 115 H LEU 15 H LEU 15 -18.143 -20.913 -13.772 116 HA LEU 15 HA LEU 15 -19.528 -21.375 -15.506 117 1HB LEU 15 1HB LEU 15 -21.019 -19.939 -13.684 118 2HB LEU 15 2HB LEU 15 -21.318 -19.092 -15.186 119 HG LEU 15 HG LEU 15 -22.981 -20.889 -14.581 120 1HD1 LEU 15 1HD1 LEU 15 -21.800 -20.243 -17.087 121 2HD1 LEU 15 2HD1 LEU 15 -23.462 -20.702 -16.724 122 3HD1 LEU 15 3HD1 LEU 15 -22.266 -21.944 -17.091 123 1HD2 LEU 15 1HD2 LEU 15 -20.682 -22.703 -15.298 124 2HD2 LEU 15 2HD2 LEU 15 -22.355 -23.208 -15.090 125 3HD2 LEU 15 3HD2 LEU 15 -21.453 -22.562 -13.720 126 HA PRO 16 HA PRO 16 -17.812 -19.073 -18.894 127 1HB PRO 16 1HB PRO 16 -19.855 -19.760 -20.701 128 2HB PRO 16 2HB PRO 16 -18.344 -20.638 -20.448 129 1HG PRO 16 1HG PRO 16 -21.054 -21.157 -19.313 130 2HG PRO 16 2HG PRO 16 -19.812 -22.313 -19.833 131 1HD PRO 16 1HD PRO 16 -20.228 -21.851 -17.247 132 2HD PRO 16 2HD PRO 16 -18.575 -22.048 -17.870 133 HA PRO 17 HA PRO 17 -19.928 -15.229 -19.149 134 1HB PRO 17 1HB PRO 17 -19.715 -14.577 -21.810 135 2HB PRO 17 2HB PRO 17 -18.399 -14.433 -20.646 136 1HG PRO 17 1HG PRO 17 -18.961 -16.642 -22.591 137 2HG PRO 17 2HG PRO 17 -17.418 -15.855 -22.209 138 1HD PRO 17 1HD PRO 17 -18.049 -18.239 -21.170 139 2HD PRO 17 2HD PRO 17 -17.173 -17.022 -20.215 140 H GLU 18 H GLU 18 -20.946 -15.619 -22.422 141 HA GLU 18 HA GLU 18 -23.007 -15.656 -23.367 142 1HB GLU 18 1HB GLU 18 -22.613 -18.056 -21.984 143 2HB GLU 18 2HB GLU 18 -24.265 -17.585 -21.616 144 1HG GLU 18 1HG GLU 18 -24.726 -17.377 -24.017 145 2HG GLU 18 2HG GLU 18 -23.080 -17.910 -24.362 146 H VAL 19 H VAL 19 -24.329 -16.540 -20.193 147 HA VAL 19 HA VAL 19 -25.910 -14.063 -20.280 148 HB VAL 19 HB VAL 19 -26.466 -16.523 -18.616 149 1HG1 VAL 19 1HG1 VAL 19 -27.466 -14.435 -17.789 150 2HG1 VAL 19 2HG1 VAL 19 -28.686 -15.573 -18.358 151 3HG1 VAL 19 3HG1 VAL 19 -28.234 -14.193 -19.357 152 1HG2 VAL 19 1HG2 VAL 19 -27.752 -15.737 -21.229 153 2HG2 VAL 19 2HG2 VAL 19 -28.110 -17.163 -20.255 154 3HG2 VAL 19 3HG2 VAL 19 -26.542 -17.008 -21.047 155 H PHE 20 H PHE 20 -26.262 -12.865 -18.337 156 HA PHE 20 HA PHE 20 -23.954 -12.966 -16.544 157 1HB PHE 20 1HB PHE 20 -24.811 -10.686 -15.821 158 2HB PHE 20 2HB PHE 20 -24.242 -10.812 -17.482 159 HD1 PHE 20 HD1 PHE 20 -25.830 -10.784 -19.345 160 HD2 PHE 20 HD2 PHE 20 -27.108 -10.251 -15.321 161 HE1 PHE 20 HE1 PHE 20 -27.977 -9.890 -20.149 162 HE2 PHE 20 HE2 PHE 20 -29.258 -9.360 -16.118 163 HZ PHE 20 HZ PHE 20 -29.694 -9.178 -18.534 164 H GLU 21 H GLU 21 -25.137 -14.971 -15.678 165 HA GLU 21 HA GLU 21 -27.439 -14.733 -14.082 166 1HB GLU 21 1HB GLU 21 -26.239 -16.850 -14.919 167 2HB GLU 21 2HB GLU 21 -25.184 -16.652 -13.529 168 1HG GLU 21 1HG GLU 21 -26.714 -17.425 -12.101 169 2HG GLU 21 2HG GLU 21 -28.033 -16.551 -12.881 170 H THR 22 H THR 22 -27.148 -15.400 -11.595 171 HA THR 22 HA THR 22 -25.793 -13.148 -10.380 172 HB THR 22 HB THR 22 -28.056 -13.645 -9.668 173 HG1 THR 22 HG1 THR 22 -27.319 -14.302 -7.321 174 1HG2 THR 22 1HG2 THR 22 -28.855 -15.680 -9.325 175 2HG2 THR 22 2HG2 THR 22 -27.606 -16.027 -8.130 176 3HG2 THR 22 3HG2 THR 22 -27.297 -16.326 -9.839 177 H LYS 23 H LYS 23 -23.589 -13.627 -10.420 178 HA LYS 23 HA LYS 23 -22.656 -16.157 -9.349 179 1HB LYS 23 1HB LYS 23 -21.197 -13.722 -10.376 180 2HB LYS 23 2HB LYS 23 -20.381 -15.137 -9.727 181 1HG LYS 23 1HG LYS 23 -20.673 -16.316 -11.597 182 2HG LYS 23 2HG LYS 23 -22.330 -15.746 -11.816 183 1HD LYS 23 1HD LYS 23 -20.176 -13.766 -12.250 184 2HD LYS 23 2HD LYS 23 -20.313 -15.057 -13.445 185 1HE LYS 23 1HE LYS 23 -22.636 -13.357 -12.559 186 2HE LYS 23 2HE LYS 23 -21.623 -12.967 -13.949 187 1HZ LYS 23 1HZ LYS 23 -22.461 -15.654 -14.117 188 2HZ LYS 23 2HZ LYS 23 -22.785 -14.375 -15.176 189 3HZ LYS 23 3HZ LYS 23 -23.812 -14.669 -13.868 190 H ARG 24 H ARG 24 -21.786 -16.487 -7.356 191 HA ARG 24 HA ARG 24 -22.151 -14.340 -5.423 192 1HB ARG 24 1HB ARG 24 -22.145 -17.267 -5.338 193 2HB ARG 24 2HB ARG 24 -21.281 -16.535 -3.994 194 1HG ARG 24 1HG ARG 24 -24.126 -15.941 -4.786 195 2HG ARG 24 2HG ARG 24 -23.614 -16.964 -3.444 196 1HD ARG 24 1HD ARG 24 -22.591 -15.084 -2.337 197 2HD ARG 24 2HD ARG 24 -22.916 -14.044 -3.721 198 HE ARG 24 HE ARG 24 -25.253 -15.243 -2.515 199 1HH1 ARG 24 1HH1 ARG 24 -23.107 -12.487 -2.571 200 2HH1 ARG 24 2HH1 ARG 24 -24.271 -11.413 -1.873 201 1HH2 ARG 24 1HH2 ARG 24 -26.780 -13.828 -1.596 202 2HH2 ARG 24 2HH2 ARG 24 -26.354 -12.172 -1.319 203 H PHE 25 H PHE 25 -20.073 -13.722 -7.048 204 HA PHE 25 HA PHE 25 -17.614 -14.528 -5.692 205 1HB PHE 25 1HB PHE 25 -16.432 -13.444 -7.494 206 2HB PHE 25 2HB PHE 25 -17.696 -14.456 -8.186 207 HD1 PHE 25 HD1 PHE 25 -16.485 -11.067 -7.698 208 HD2 PHE 25 HD2 PHE 25 -19.674 -13.444 -9.178 209 HE1 PHE 25 HE1 PHE 25 -17.349 -9.124 -8.943 210 HE2 PHE 25 HE2 PHE 25 -20.551 -11.516 -10.428 211 HZ PHE 25 HZ PHE 25 -19.386 -9.350 -10.311 212 H GLU 26 H GLU 26 -16.622 -13.311 -4.234 213 HA GLU 26 HA GLU 26 -16.774 -10.458 -4.232 214 1HB GLU 26 1HB GLU 26 -17.639 -10.615 -1.717 215 2HB GLU 26 2HB GLU 26 -18.739 -10.434 -3.074 216 1HG GLU 26 1HG GLU 26 -18.769 -13.043 -3.031 217 2HG GLU 26 2HG GLU 26 -18.192 -12.826 -1.381 218 H VAL 27 H VAL 27 -14.807 -9.839 -3.708 219 HA VAL 27 HA VAL 27 -13.416 -11.011 -1.431 220 HB VAL 27 HB VAL 27 -12.064 -10.868 -4.135 221 1HG1 VAL 27 1HG1 VAL 27 -10.548 -12.453 -2.457 222 2HG1 VAL 27 2HG1 VAL 27 -11.099 -11.144 -1.410 223 3HG1 VAL 27 3HG1 VAL 27 -10.219 -10.777 -2.894 224 1HG2 VAL 27 1HG2 VAL 27 -12.034 -13.512 -3.161 225 2HG2 VAL 27 2HG2 VAL 27 -12.845 -12.891 -4.597 226 3HG2 VAL 27 3HG2 VAL 27 -13.698 -12.952 -3.062 227 HA PRO 28 HA PRO 28 -13.133 -6.301 -2.357 228 1HB PRO 28 1HB PRO 28 -13.886 -6.394 0.526 229 2HB PRO 28 2HB PRO 28 -14.400 -5.264 -0.733 230 1HG PRO 28 1HG PRO 28 -16.042 -7.173 0.112 231 2HG PRO 28 2HG PRO 28 -15.959 -6.748 -1.608 232 1HD PRO 28 1HD PRO 28 -14.822 -9.110 -0.181 233 2HD PRO 28 2HD PRO 28 -15.521 -8.998 -1.808 234 H LYS 29 H LYS 29 -11.239 -5.260 -1.985 235 HA LYS 29 HA LYS 29 -9.750 -5.557 0.405 236 1HB LYS 29 1HB LYS 29 -9.225 -7.479 -1.678 237 2HB LYS 29 2HB LYS 29 -7.800 -6.488 -1.390 238 1HG LYS 29 1HG LYS 29 -7.450 -7.342 0.663 239 2HG LYS 29 2HG LYS 29 -9.170 -7.476 1.014 240 1HD LYS 29 1HD LYS 29 -8.401 -9.289 -1.097 241 2HD LYS 29 2HD LYS 29 -7.416 -9.543 0.343 242 1HE LYS 29 1HE LYS 29 -10.408 -9.681 0.080 243 2HE LYS 29 2HE LYS 29 -9.297 -10.958 0.569 244 1HZ LYS 29 1HZ LYS 29 -9.525 -10.340 2.663 245 2HZ LYS 29 2HZ LYS 29 -10.665 -9.179 2.205 246 3HZ LYS 29 3HZ LYS 29 -9.030 -8.760 2.321 247 H ALA 30 H ALA 30 -7.262 -4.832 -0.285 248 HA ALA 30 HA ALA 30 -5.917 -3.204 -1.209 249 1HB ALA 30 1HB ALA 30 -6.432 -2.282 -3.184 250 2HB ALA 30 2HB ALA 30 -7.967 -1.645 -2.593 251 3HB ALA 30 3HB ALA 30 -7.858 -3.319 -3.139 252 H TYR 31 H TYR 31 -7.742 -3.127 1.182 253 HA TYR 31 HA TYR 31 -6.983 -0.656 2.223 254 1HB TYR 31 1HB TYR 31 -9.059 0.582 2.295 255 2HB TYR 31 2HB TYR 31 -8.681 0.212 0.617 256 HD1 TYR 31 HD1 TYR 31 -11.357 0.708 2.482 257 HD2 TYR 31 HD2 TYR 31 -9.664 -2.507 0.270 258 HE1 TYR 31 HE1 TYR 31 -13.593 -0.279 2.211 259 HE2 TYR 31 HE2 TYR 31 -11.893 -3.502 -0.005 260 HH TYR 31 HH TYR 31 -14.383 -2.475 0.009 261 H SER 32 H SER 32 -7.801 -0.306 4.403 262 HA SER 32 HA SER 32 -8.177 -2.762 5.804 263 1HB SER 32 1HB SER 32 -7.143 -0.357 6.502 264 2HB SER 32 2HB SER 32 -8.745 -0.225 7.226 265 HG SER 32 HG SER 32 -8.329 -1.982 8.479 266 H VAL 33 H VAL 33 -9.924 -2.612 7.696 267 HA VAL 33 HA VAL 33 -12.504 -1.878 6.498 268 HB VAL 33 HB VAL 33 -12.618 -4.245 8.234 269 1HG1 VAL 33 1HG1 VAL 33 -14.589 -3.581 7.158 270 2HG1 VAL 33 2HG1 VAL 33 -14.040 -5.000 6.265 271 3HG1 VAL 33 3HG1 VAL 33 -13.775 -3.387 5.605 272 1HG2 VAL 33 1HG2 VAL 33 -10.476 -4.407 6.635 273 2HG2 VAL 33 2HG2 VAL 33 -11.717 -4.910 5.490 274 3HG2 VAL 33 3HG2 VAL 33 -11.501 -5.793 7.001 275 H ILE 34 H ILE 34 -13.886 -0.857 7.832 276 HA ILE 34 HA ILE 34 -13.035 0.270 10.227 277 HB ILE 34 HB ILE 34 -15.922 -0.217 9.513 278 1HG1 ILE 34 1HG1 ILE 34 -14.975 2.391 8.751 279 2HG1 ILE 34 2HG1 ILE 34 -13.987 1.158 7.974 280 1HG2 ILE 34 1HG2 ILE 34 -16.440 1.168 11.178 281 2HG2 ILE 34 2HG2 ILE 34 -15.199 2.330 10.708 282 3HG2 ILE 34 3HG2 ILE 34 -14.780 0.956 11.731 283 1HD1 ILE 34 1HD1 ILE 34 -16.771 0.475 7.798 284 2HD1 ILE 34 2HD1 ILE 34 -15.589 0.721 6.513 285 3HD1 ILE 34 3HD1 ILE 34 -16.481 2.095 7.166 286 H GLN 35 H GLN 35 -13.211 -0.265 12.355 287 HA GLN 35 HA GLN 35 -14.743 -2.643 13.096 288 1HB GLN 35 1HB GLN 35 -12.203 -3.109 12.667 289 2HB GLN 35 2HB GLN 35 -11.992 -2.340 14.233 290 1HG GLN 35 1HG GLN 35 -12.093 -4.722 14.495 291 2HG GLN 35 2HG GLN 35 -13.504 -3.971 15.239 292 1HE2 GLN 35 1HE2 GLN 35 -12.346 -6.094 12.843 293 2HE2 GLN 35 2HE2 GLN 35 -13.871 -6.624 12.233 294 H GLY 36 H GLY 36 -15.229 -2.787 15.361 295 1HA GLY 36 1HA GLY 36 -16.156 -0.492 16.535 296 2HA GLY 36 2HA GLY 36 -15.755 -1.944 17.437 297 H ASN 37 H ASN 37 -14.576 1.163 16.321 298 HA ASN 37 HA ASN 37 -13.027 2.596 17.185 299 1HB ASN 37 1HB ASN 37 -14.096 1.445 19.386 300 2HB ASN 37 2HB ASN 37 -12.425 0.918 19.555 301 1HD2 ASN 37 1HD2 ASN 37 -14.186 2.887 21.005 302 2HD2 ASN 37 2HD2 ASN 37 -13.238 4.329 21.081 303 H ARG 38 H ARG 38 -12.365 -0.021 15.708 304 HA ARG 38 HA ARG 38 -9.475 0.227 16.013 305 1HB ARG 38 1HB ARG 38 -10.311 -2.577 15.739 306 2HB ARG 38 2HB ARG 38 -9.055 -1.871 16.737 307 1HG ARG 38 1HG ARG 38 -10.321 -1.977 18.553 308 2HG ARG 38 2HG ARG 38 -11.671 -1.209 17.751 309 1HD ARG 38 1HD ARG 38 -12.715 -3.158 17.407 310 2HD ARG 38 2HD ARG 38 -11.225 -3.968 16.919 311 HE ARG 38 HE ARG 38 -11.112 -3.544 19.673 312 1HH1 ARG 38 1HH1 ARG 38 -12.977 -5.407 17.390 313 2HH1 ARG 38 2HH1 ARG 38 -13.319 -6.677 18.516 314 1HH2 ARG 38 1HH2 ARG 38 -11.555 -5.210 21.155 315 2HH2 ARG 38 2HH2 ARG 38 -12.511 -6.566 20.657 316 H THR 39 H THR 39 -8.277 -0.829 14.218 317 HA THR 39 HA THR 39 -9.906 -0.836 11.768 318 HB THR 39 HB THR 39 -7.667 0.673 12.390 319 HG1 THR 39 HG1 THR 39 -8.207 0.207 9.697 320 1HG2 THR 39 1HG2 THR 39 -5.863 -0.551 11.916 321 2HG2 THR 39 2HG2 THR 39 -6.287 -0.189 10.250 322 3HG2 THR 39 3HG2 THR 39 -6.753 -1.728 10.961 323 H PHE 40 H PHE 40 -10.074 -2.651 10.589 324 HA PHE 40 HA PHE 40 -8.465 -4.969 11.407 325 1HB PHE 40 1HB PHE 40 -11.013 -5.073 11.325 326 2HB PHE 40 2HB PHE 40 -10.869 -4.980 9.575 327 HD1 PHE 40 HD1 PHE 40 -8.895 -6.775 8.740 328 HD2 PHE 40 HD2 PHE 40 -11.495 -7.166 12.080 329 HE1 PHE 40 HE1 PHE 40 -8.663 -9.215 8.636 330 HE2 PHE 40 HE2 PHE 40 -11.267 -9.606 11.982 331 HZ PHE 40 HZ PHE 40 -9.848 -10.637 10.258 332 H ILE 41 H ILE 41 -6.536 -4.370 10.275 333 HA ILE 41 HA ILE 41 -6.709 -4.053 7.402 334 HB ILE 41 HB ILE 41 -5.097 -2.776 8.887 335 1HG1 ILE 41 1HG1 ILE 41 -3.154 -3.332 7.136 336 2HG1 ILE 41 2HG1 ILE 41 -4.488 -4.156 6.333 337 1HG2 ILE 41 1HG2 ILE 41 -4.378 -5.220 9.809 338 2HG2 ILE 41 2HG2 ILE 41 -3.413 -3.758 9.975 339 3HG2 ILE 41 3HG2 ILE 41 -3.088 -4.888 8.659 340 1HD1 ILE 41 1HD1 ILE 41 -5.677 -1.830 6.867 341 2HD1 ILE 41 2HD1 ILE 41 -4.758 -2.126 5.393 342 3HD1 ILE 41 3HD1 ILE 41 -4.009 -1.278 6.747 343 H GLN 42 H GLN 42 -6.721 -5.694 6.050 344 HA GLN 42 HA GLN 42 -5.670 -8.289 6.953 345 1HB GLN 42 1HB GLN 42 -8.134 -8.011 6.302 346 2HB GLN 42 2HB GLN 42 -7.557 -7.872 4.644 347 1HG GLN 42 1HG GLN 42 -6.451 -10.078 4.910 348 2HG GLN 42 2HG GLN 42 -7.203 -10.203 6.495 349 1HE2 GLN 42 1HE2 GLN 42 -9.629 -9.854 6.457 350 2HE2 GLN 42 2HE2 GLN 42 -10.491 -10.657 5.194 351 H ASN 43 H ASN 43 -5.604 -5.929 4.369 352 HA ASN 43 HA ASN 43 -3.661 -7.550 2.894 353 1HB ASN 43 1HB ASN 43 -5.685 -5.600 2.146 354 2HB ASN 43 2HB ASN 43 -4.119 -5.201 1.449 355 1HD2 ASN 43 1HD2 ASN 43 -5.505 -5.654 -0.504 356 2HD2 ASN 43 2HD2 ASN 43 -5.501 -7.275 -1.099 357 H PHE 44 H PHE 44 -2.767 -6.498 5.323 358 HA PHE 44 HA PHE 44 -1.580 -4.042 5.388 359 1HB PHE 44 1HB PHE 44 -1.531 -5.928 7.143 360 2HB PHE 44 2HB PHE 44 -0.079 -6.485 6.318 361 HD1 PHE 44 HD1 PHE 44 -1.178 -3.000 6.960 362 HD2 PHE 44 HD2 PHE 44 1.614 -6.081 7.870 363 HE1 PHE 44 HE1 PHE 44 0.165 -1.395 8.249 364 HE2 PHE 44 HE2 PHE 44 2.962 -4.479 9.165 365 HZ PHE 44 HZ PHE 44 2.238 -2.132 9.354 366 H ARG 45 H ARG 45 -0.583 -6.819 3.528 367 HA ARG 45 HA ARG 45 1.972 -5.747 2.780 368 1HB ARG 45 1HB ARG 45 1.397 -8.195 2.782 369 2HB ARG 45 2HB ARG 45 0.417 -7.903 1.349 370 1HG ARG 45 1HG ARG 45 2.572 -8.769 0.707 371 2HG ARG 45 2HG ARG 45 2.418 -7.094 0.169 372 1HD ARG 45 1HD ARG 45 3.553 -7.315 2.834 373 2HD ARG 45 2HD ARG 45 4.512 -8.162 1.623 374 HE ARG 45 HE ARG 45 4.262 -5.889 0.383 375 1HH1 ARG 45 1HH1 ARG 45 4.745 -6.353 3.815 376 2HH1 ARG 45 2HH1 ARG 45 5.549 -4.837 4.028 377 1HH2 ARG 45 1HH2 ARG 45 5.326 -3.899 0.672 378 2HH2 ARG 45 2HH2 ARG 45 5.880 -3.445 2.249 379 H GLU 46 H GLU 46 -1.028 -6.289 0.927 380 HA GLU 46 HA GLU 46 -0.174 -4.800 -1.327 381 1HB GLU 46 1HB GLU 46 -2.002 -6.549 -1.275 382 2HB GLU 46 2HB GLU 46 -3.026 -5.330 -0.536 383 1HG GLU 46 1HG GLU 46 -3.541 -5.337 -2.834 384 2HG GLU 46 2HG GLU 46 -2.587 -3.883 -2.537 385 H VAL 47 H VAL 47 -2.443 -4.028 1.294 386 HA VAL 47 HA VAL 47 -3.043 -1.438 0.520 387 HB VAL 47 HB VAL 47 -2.866 -2.421 3.365 388 1HG1 VAL 47 1HG1 VAL 47 -4.945 -0.652 3.224 389 2HG1 VAL 47 2HG1 VAL 47 -3.771 0.068 2.122 390 3HG1 VAL 47 3HG1 VAL 47 -3.321 -0.268 3.793 391 1HG2 VAL 47 1HG2 VAL 47 -5.536 -2.354 2.388 392 2HG2 VAL 47 2HG2 VAL 47 -4.607 -3.742 2.955 393 3HG2 VAL 47 3HG2 VAL 47 -4.558 -3.285 1.253 394 H ALA 48 H ALA 48 -0.304 -2.659 2.379 395 HA ALA 48 HA ALA 48 0.689 -0.210 3.304 396 1HB ALA 48 1HB ALA 48 1.964 -2.858 2.760 397 2HB ALA 48 2HB ALA 48 1.642 -2.070 4.305 398 3HB ALA 48 3HB ALA 48 2.936 -1.476 3.263 399 H ASP 49 H ASP 49 1.842 -2.094 0.518 400 HA ASP 49 HA ASP 49 3.665 -0.332 -0.513 401 1HB ASP 49 1HB ASP 49 2.593 -2.699 -1.350 402 2HB ASP 49 2HB ASP 49 1.967 -1.598 -2.571 403 H ALA 50 H ALA 50 0.323 -0.542 -1.808 404 HA ALA 50 HA ALA 50 0.463 1.786 -3.297 405 1HB ALA 50 1HB ALA 50 -1.967 0.550 -2.031 406 2HB ALA 50 2HB ALA 50 -1.295 0.175 -3.615 407 3HB ALA 50 3HB ALA 50 -1.992 1.766 -3.307 408 H LEU 51 H LEU 51 -0.673 1.477 0.075 409 HA LEU 51 HA LEU 51 -1.350 4.195 0.357 410 1HB LEU 51 1HB LEU 51 -2.329 2.838 1.951 411 2HB LEU 51 2HB LEU 51 -0.866 1.921 2.225 412 HG LEU 51 HG LEU 51 0.076 3.721 3.517 413 1HD1 LEU 51 1HD1 LEU 51 -0.720 5.684 2.546 414 2HD1 LEU 51 2HD1 LEU 51 -1.521 5.640 4.112 415 3HD1 LEU 51 3HD1 LEU 51 -2.397 5.166 2.654 416 1HD2 LEU 51 1HD2 LEU 51 -0.951 2.676 5.207 417 2HD2 LEU 51 2HD2 LEU 51 -2.351 2.320 4.209 418 3HD2 LEU 51 3HD2 LEU 51 -2.252 3.856 5.070 419 H ASN 52 H ASN 52 1.619 2.540 0.241 420 HA ASN 52 HA ASN 52 3.246 4.711 0.012 421 1HB ASN 52 1HB ASN 52 2.454 4.692 2.640 422 2HB ASN 52 2HB ASN 52 3.980 3.814 2.710 423 1HD2 ASN 52 1HD2 ASN 52 5.357 5.062 0.669 424 2HD2 ASN 52 2HD2 ASN 52 5.672 6.700 1.119 425 H ARG 53 H ARG 53 4.794 3.822 -1.153 426 HA ARG 53 HA ARG 53 5.420 1.224 -1.531 427 1HB ARG 53 1HB ARG 53 6.437 2.863 -2.929 428 2HB ARG 53 2HB ARG 53 7.238 3.631 -1.567 429 1HG ARG 53 1HG ARG 53 8.891 2.445 -2.777 430 2HG ARG 53 2HG ARG 53 8.590 1.538 -1.295 431 1HD ARG 53 1HD ARG 53 6.883 0.737 -3.525 432 2HD ARG 53 2HD ARG 53 8.602 0.502 -3.835 433 HE ARG 53 HE ARG 53 7.829 -0.491 -1.275 434 1HH1 ARG 53 1HH1 ARG 53 7.840 -1.239 -4.684 435 2HH1 ARG 53 2HH1 ARG 53 7.817 -2.953 -4.436 436 1HH2 ARG 53 1HH2 ARG 53 7.800 -2.744 -0.947 437 2HH2 ARG 53 2HH2 ARG 53 7.793 -3.808 -2.314 438 H ASP 54 H ASP 54 7.542 3.240 0.491 439 HA ASP 54 HA ASP 54 8.748 1.044 1.786 440 1HB ASP 54 1HB ASP 54 8.894 3.949 1.908 441 2HB ASP 54 2HB ASP 54 9.044 3.220 3.504 442 HA PRO 55 HA PRO 55 5.596 0.078 4.758 443 1HB PRO 55 1HB PRO 55 7.057 -1.394 6.490 444 2HB PRO 55 2HB PRO 55 6.604 -1.989 4.889 445 1HG PRO 55 1HG PRO 55 9.194 -0.795 5.799 446 2HG PRO 55 2HG PRO 55 8.918 -2.214 4.773 447 1HD PRO 55 1HD PRO 55 9.572 0.223 3.771 448 2HD PRO 55 2HD PRO 55 8.560 -0.939 2.891 449 H GLN 56 H GLN 56 8.716 1.263 5.970 450 HA GLN 56 HA GLN 56 8.036 1.927 8.558 451 1HB GLN 56 1HB GLN 56 10.145 2.551 6.728 452 2HB GLN 56 2HB GLN 56 9.678 4.024 7.564 453 1HG GLN 56 1HG GLN 56 9.809 2.373 9.658 454 2HG GLN 56 2HG GLN 56 10.976 1.585 8.596 455 1HE2 GLN 56 1HE2 GLN 56 12.641 3.024 7.648 456 2HE2 GLN 56 2HE2 GLN 56 13.282 4.281 8.645 457 H HIS 57 H HIS 57 7.201 3.555 5.587 458 HA HIS 57 HA HIS 57 6.368 5.990 6.780 459 1HB HIS 57 1HB HIS 57 6.630 4.954 4.155 460 2HB HIS 57 2HB HIS 57 4.966 5.493 4.332 461 HD2 HIS 57 HD2 HIS 57 4.638 8.270 4.644 462 HE1 HIS 57 HE1 HIS 57 8.683 9.225 3.790 463 HE2 HIS 57 HE2 HIS 57 6.364 10.137 4.171 464 H LEU 58 H LEU 58 4.801 2.956 6.094 465 HA LEU 58 HA LEU 58 2.145 3.892 6.536 466 1HB LEU 58 1HB LEU 58 3.397 1.464 5.751 467 2HB LEU 58 2HB LEU 58 2.374 1.108 7.131 468 HG LEU 58 HG LEU 58 0.698 2.622 5.630 469 1HD1 LEU 58 1HD1 LEU 58 0.855 1.798 3.319 470 2HD1 LEU 58 2HD1 LEU 58 2.403 1.050 3.712 471 3HD1 LEU 58 3HD1 LEU 58 2.231 2.804 3.775 472 1HD2 LEU 58 1HD2 LEU 58 -0.470 0.610 5.163 473 2HD2 LEU 58 2HD2 LEU 58 0.346 0.375 6.712 474 3HD2 LEU 58 3HD2 LEU 58 1.011 -0.346 5.246 475 H LEU 59 H LEU 59 4.577 2.276 8.492 476 HA LEU 59 HA LEU 59 3.075 1.842 10.795 477 1HB LEU 59 1HB LEU 59 6.012 2.354 10.401 478 2HB LEU 59 2HB LEU 59 5.329 1.981 11.972 479 HG LEU 59 HG LEU 59 5.168 0.184 9.549 480 1HD1 LEU 59 1HD1 LEU 59 7.451 0.373 10.365 481 2HD1 LEU 59 2HD1 LEU 59 6.782 -1.215 10.740 482 3HD1 LEU 59 3HD1 LEU 59 6.910 0.008 12.003 483 1HD2 LEU 59 1HD2 LEU 59 3.375 -0.522 10.765 484 2HD2 LEU 59 2HD2 LEU 59 4.035 0.066 12.291 485 3HD2 LEU 59 3HD2 LEU 59 4.644 -1.431 11.586 486 H LYS 60 H LYS 60 5.185 4.612 10.039 487 HA LYS 60 HA LYS 60 4.695 6.073 12.359 488 1HB LYS 60 1HB LYS 60 6.174 6.441 10.059 489 2HB LYS 60 2HB LYS 60 4.986 7.735 9.973 490 1HG LYS 60 1HG LYS 60 6.352 8.892 11.284 491 2HG LYS 60 2HG LYS 60 5.832 7.828 12.592 492 1HD LYS 60 1HD LYS 60 7.770 6.646 12.583 493 2HD LYS 60 2HD LYS 60 7.994 6.822 10.841 494 1HE LYS 60 1HE LYS 60 9.709 8.033 12.108 495 2HE LYS 60 2HE LYS 60 8.712 9.122 11.146 496 1HZ LYS 60 1HZ LYS 60 7.768 8.681 13.843 497 2HZ LYS 60 2HZ LYS 60 7.907 10.120 12.966 498 3HZ LYS 60 3HZ LYS 60 9.262 9.470 13.744 499 H PHE 61 H PHE 61 3.035 6.226 9.218 500 HA PHE 61 HA PHE 61 1.232 8.249 9.729 501 1HB PHE 61 1HB PHE 61 1.430 6.007 7.875 502 2HB PHE 61 2HB PHE 61 -0.235 6.406 8.257 503 HD1 PHE 61 HD1 PHE 61 1.741 6.762 5.720 504 HD2 PHE 61 HD2 PHE 61 -0.090 9.325 8.581 505 HE1 PHE 61 HE1 PHE 61 1.820 8.614 4.104 506 HE2 PHE 61 HE2 PHE 61 -0.014 11.183 6.970 507 HZ PHE 61 HZ PHE 61 0.940 10.829 4.727 508 H LEU 62 H LEU 62 0.996 4.820 10.533 509 HA LEU 62 HA LEU 62 -1.593 4.772 11.550 510 1HB LEU 62 1HB LEU 62 0.873 3.179 12.209 511 2HB LEU 62 2HB LEU 62 -0.670 2.847 12.966 512 HG LEU 62 HG LEU 62 -0.504 2.910 9.982 513 1HD1 LEU 62 1HD1 LEU 62 -0.111 0.378 10.191 514 2HD1 LEU 62 2HD1 LEU 62 0.550 0.756 11.781 515 3HD1 LEU 62 3HD1 LEU 62 1.278 1.453 10.336 516 1HD2 LEU 62 1HD2 LEU 62 -2.579 2.621 11.598 517 2HD2 LEU 62 2HD2 LEU 62 -2.045 0.940 11.573 518 3HD2 LEU 62 3HD2 LEU 62 -2.461 1.755 10.066 519 H LEU 63 H LEU 63 1.467 5.183 13.352 520 HA LEU 63 HA LEU 63 0.361 5.621 15.867 521 1HB LEU 63 1HB LEU 63 2.915 5.707 14.699 522 2HB LEU 63 2HB LEU 63 2.699 7.260 15.482 523 HG LEU 63 HG LEU 63 1.867 5.610 17.460 524 1HD1 LEU 63 1HD1 LEU 63 2.322 3.505 16.764 525 2HD1 LEU 63 2HD1 LEU 63 3.930 3.913 17.364 526 3HD1 LEU 63 3HD1 LEU 63 3.577 4.029 15.640 527 1HD2 LEU 63 1HD2 LEU 63 4.302 7.064 16.784 528 2HD2 LEU 63 2HD2 LEU 63 4.574 5.735 17.911 529 3HD2 LEU 63 3HD2 LEU 63 3.404 6.996 18.300 530 H ARG 64 H ARG 64 0.483 7.729 13.121 531 HA ARG 64 HA ARG 64 0.213 10.185 14.533 532 1HB ARG 64 1HB ARG 64 0.504 9.384 11.833 533 2HB ARG 64 2HB ARG 64 -0.964 10.347 11.922 534 1HG ARG 64 1HG ARG 64 0.353 12.127 11.753 535 2HG ARG 64 2HG ARG 64 0.841 11.801 13.418 536 1HD ARG 64 1HD ARG 64 2.640 10.318 12.507 537 2HD ARG 64 2HD ARG 64 2.210 10.886 10.894 538 HE ARG 64 HE ARG 64 3.367 12.801 11.322 539 1HH1 ARG 64 1HH1 ARG 64 2.589 11.288 14.368 540 2HH1 ARG 64 2HH1 ARG 64 3.500 12.423 15.307 541 1HH2 ARG 64 1HH2 ARG 64 4.561 14.297 12.553 542 2HH2 ARG 64 2HH2 ARG 64 4.619 14.132 14.276 543 H GLU 65 H GLU 65 -2.147 8.122 12.824 544 HA GLU 65 HA GLU 65 -4.361 9.715 13.786 545 1HB GLU 65 1HB GLU 65 -4.176 7.170 12.188 546 2HB GLU 65 2HB GLU 65 -5.713 7.760 12.799 547 1HG GLU 65 1HG GLU 65 -3.936 9.487 11.119 548 2HG GLU 65 2HG GLU 65 -5.059 8.330 10.410 549 H LEU 66 H LEU 66 -3.948 6.209 13.959 550 HA LEU 66 HA LEU 66 -5.525 5.929 16.253 551 1HB LEU 66 1HB LEU 66 -4.077 3.666 16.372 552 2HB LEU 66 2HB LEU 66 -5.455 3.895 15.322 553 HG LEU 66 HG LEU 66 -3.168 4.777 13.896 554 1HD1 LEU 66 1HD1 LEU 66 -2.303 2.191 13.975 555 2HD1 LEU 66 2HD1 LEU 66 -2.638 2.528 15.674 556 3HD1 LEU 66 3HD1 LEU 66 -1.520 3.553 14.775 557 1HD2 LEU 66 1HD2 LEU 66 -3.931 2.344 12.843 558 2HD2 LEU 66 2HD2 LEU 66 -4.600 3.917 12.418 559 3HD2 LEU 66 3HD2 LEU 66 -5.390 2.925 13.643 560 H GLY 67 H GLY 67 -4.920 7.246 17.883 561 1HA GLY 67 1HA GLY 67 -2.202 7.123 18.932 562 2HA GLY 67 2HA GLY 67 -3.476 8.211 19.462 563 H THR 68 H THR 68 -3.845 4.746 19.109 564 HA THR 68 HA THR 68 -4.108 4.535 22.030 565 HB THR 68 HB THR 68 -5.900 3.081 21.816 566 HG1 THR 68 HG1 THR 68 -5.210 1.541 20.462 567 1HG2 THR 68 1HG2 THR 68 -7.441 3.892 20.042 568 2HG2 THR 68 2HG2 THR 68 -6.125 4.896 19.433 569 3HG2 THR 68 3HG2 THR 68 -6.758 5.162 21.058 570 H ALA 69 H ALA 69 -3.776 2.231 22.806 571 HA ALA 69 HA ALA 69 -1.310 1.364 22.844 572 1HB ALA 69 1HB ALA 69 -2.016 -0.713 23.527 573 2HB ALA 69 2HB ALA 69 -3.304 -0.792 22.324 574 3HB ALA 69 3HB ALA 69 -3.481 0.244 23.742 575 H GLY 70 H GLY 70 -3.469 0.083 20.297 576 1HA GLY 70 1HA GLY 70 -2.996 -0.466 18.106 577 2HA GLY 70 2HA GLY 70 -1.418 0.278 18.310 578 H ASN 71 H ASN 71 -3.016 -2.585 17.790 579 HA ASN 71 HA ASN 71 -0.609 -4.114 17.915 580 1HB ASN 71 1HB ASN 71 -2.236 -4.080 20.257 581 2HB ASN 71 2HB ASN 71 -2.379 -5.673 19.519 582 1HD2 ASN 71 1HD2 ASN 71 -0.920 -7.096 20.106 583 2HD2 ASN 71 2HD2 ASN 71 0.658 -6.747 20.716 584 H LEU 72 H LEU 72 -1.107 -6.493 17.368 585 HA LEU 72 HA LEU 72 -3.089 -6.458 15.232 586 1HB LEU 72 1HB LEU 72 -0.687 -8.081 15.878 587 2HB LEU 72 2HB LEU 72 -1.960 -8.868 14.964 588 HG LEU 72 HG LEU 72 -1.792 -6.776 13.421 589 1HD1 LEU 72 1HD1 LEU 72 -0.276 -5.271 14.019 590 2HD1 LEU 72 2HD1 LEU 72 0.964 -6.457 13.614 591 3HD1 LEU 72 3HD1 LEU 72 0.373 -6.329 15.271 592 1HD2 LEU 72 1HD2 LEU 72 0.321 -7.948 12.360 593 2HD2 LEU 72 2HD2 LEU 72 -1.259 -8.731 12.366 594 3HD2 LEU 72 3HD2 LEU 72 -0.050 -9.179 13.566 595 H GLU 73 H GLU 73 -5.090 -7.159 15.615 596 HA GLU 73 HA GLU 73 -5.513 -9.127 17.759 597 1HB GLU 73 1HB GLU 73 -6.888 -6.748 17.042 598 2HB GLU 73 2HB GLU 73 -7.980 -8.086 16.739 599 1HG GLU 73 1HG GLU 73 -7.723 -8.843 19.023 600 2HG GLU 73 2HG GLU 73 -6.556 -7.558 19.336 601 H GLY 74 H GLY 74 -6.959 -10.898 17.403 602 1HA GLY 74 1HA GLY 74 -7.706 -12.710 16.207 603 2HA GLY 74 2HA GLY 74 -8.202 -11.539 14.996 604 H GLY 75 H GLY 75 -7.611 -13.648 13.769 605 1HA GLY 75 1HA GLY 75 -4.980 -14.457 13.367 606 2HA GLY 75 2HA GLY 75 -6.258 -14.584 12.168 607 H ARG 76 H ARG 76 -6.745 -11.779 11.924 608 HA ARG 76 HA ARG 76 -4.492 -11.118 10.214 609 1HB ARG 76 1HB ARG 76 -7.200 -9.812 10.543 610 2HB ARG 76 2HB ARG 76 -5.990 -9.341 9.354 611 1HG ARG 76 1HG ARG 76 -7.145 -12.112 9.519 612 2HG ARG 76 2HG ARG 76 -7.811 -10.840 8.496 613 1HD ARG 76 1HD ARG 76 -6.399 -11.609 6.943 614 2HD ARG 76 2HD ARG 76 -5.156 -10.759 7.853 615 HE ARG 76 HE ARG 76 -4.905 -12.993 9.053 616 1HH1 ARG 76 1HH1 ARG 76 -5.876 -12.707 5.703 617 2HH1 ARG 76 2HH1 ARG 76 -5.222 -14.244 5.257 618 1HH2 ARG 76 1HH2 ARG 76 -4.038 -15.008 8.454 619 2HH2 ARG 76 2HH2 ARG 76 -4.178 -15.549 6.814 620 H ALA 77 H ALA 77 -4.472 -8.376 10.166 621 HA ALA 77 HA ALA 77 -3.358 -7.825 12.821 622 1HB ALA 77 1HB ALA 77 -2.177 -5.962 11.690 623 2HB ALA 77 2HB ALA 77 -2.914 -6.468 10.170 624 3HB ALA 77 3HB ALA 77 -1.809 -7.548 11.012 625 H ILE 78 H ILE 78 -5.568 -7.562 13.642 626 HA ILE 78 HA ILE 78 -6.967 -5.141 12.829 627 HB ILE 78 HB ILE 78 -7.768 -6.915 15.118 628 1HG1 ILE 78 1HG1 ILE 78 -8.689 -7.375 12.290 629 2HG1 ILE 78 2HG1 ILE 78 -7.277 -8.201 12.931 630 1HG2 ILE 78 1HG2 ILE 78 -8.875 -4.695 14.659 631 2HG2 ILE 78 2HG2 ILE 78 -9.946 -6.094 14.730 632 3HG2 ILE 78 3HG2 ILE 78 -9.491 -5.412 13.170 633 1HD1 ILE 78 1HD1 ILE 78 -9.030 -9.703 13.227 634 2HD1 ILE 78 2HD1 ILE 78 -10.134 -8.447 13.789 635 3HD1 ILE 78 3HD1 ILE 78 -8.803 -8.976 14.817 636 H LEU 79 H LEU 79 -5.551 -3.498 13.525 637 HA LEU 79 HA LEU 79 -4.722 -3.394 16.286 638 1HB LEU 79 1HB LEU 79 -3.605 -1.338 15.717 639 2HB LEU 79 2HB LEU 79 -3.264 -2.559 14.509 640 HG LEU 79 HG LEU 79 -5.432 -1.276 13.437 641 1HD1 LEU 79 1HD1 LEU 79 -5.486 0.926 13.907 642 2HD1 LEU 79 2HD1 LEU 79 -3.742 1.019 14.141 643 3HD1 LEU 79 3HD1 LEU 79 -4.766 0.412 15.432 644 1HD2 LEU 79 1HD2 LEU 79 -3.050 -1.954 12.568 645 2HD2 LEU 79 2HD2 LEU 79 -2.694 -0.254 12.865 646 3HD2 LEU 79 3HD2 LEU 79 -3.981 -0.700 11.745 647 H GLN 80 H GLN 80 -4.933 -0.734 16.978 648 HA GLN 80 HA GLN 80 -7.818 -0.188 16.952 649 1HB GLN 80 1HB GLN 80 -6.451 -1.315 19.125 650 2HB GLN 80 2HB GLN 80 -6.692 0.375 19.552 651 1HG GLN 80 1HG GLN 80 -9.124 -0.001 18.853 652 2HG GLN 80 2HG GLN 80 -8.735 -1.718 18.945 653 1HE2 GLN 80 1HE2 GLN 80 -10.345 -1.816 20.608 654 2HE2 GLN 80 2HE2 GLN 80 -9.944 -1.362 22.225 655 H GLY 81 H GLY 81 -8.407 1.933 17.031 656 1HA GLY 81 1HA GLY 81 -7.423 4.138 18.037 657 2HA GLY 81 2HA GLY 81 -6.236 3.877 16.785 658 H LYS 82 H LYS 82 -7.138 3.718 14.491 659 HA LYS 82 HA LYS 82 -9.747 4.721 13.995 660 1HB LYS 82 1HB LYS 82 -8.103 6.694 14.802 661 2HB LYS 82 2HB LYS 82 -7.798 6.755 13.076 662 1HG LYS 82 1HG LYS 82 -10.120 7.138 12.619 663 2HG LYS 82 2HG LYS 82 -10.538 6.875 14.313 664 1HD LYS 82 1HD LYS 82 -8.649 8.856 14.474 665 2HD LYS 82 2HD LYS 82 -9.493 9.260 12.978 666 1HE LYS 82 1HE LYS 82 -10.634 10.402 14.705 667 2HE LYS 82 2HE LYS 82 -11.647 9.026 14.272 668 1HZ LYS 82 1HZ LYS 82 -11.666 8.721 16.484 669 2HZ LYS 82 2HZ LYS 82 -10.233 9.581 16.744 670 3HZ LYS 82 3HZ LYS 82 -10.170 7.972 16.222 671 H PHE 83 H PHE 83 -7.301 5.958 11.827 672 HA PHE 83 HA PHE 83 -7.049 5.542 9.577 673 1HB PHE 83 1HB PHE 83 -6.151 3.179 11.104 674 2HB PHE 83 2HB PHE 83 -6.364 2.929 9.372 675 HD1 PHE 83 HD1 PHE 83 -5.407 6.182 10.763 676 HD2 PHE 83 HD2 PHE 83 -4.014 2.592 8.950 677 HE1 PHE 83 HE1 PHE 83 -3.236 7.249 10.321 678 HE2 PHE 83 HE2 PHE 83 -1.844 3.654 8.503 679 HZ PHE 83 HZ PHE 83 -1.464 5.983 9.190 680 H THR 84 H THR 84 -9.726 5.562 10.126 681 HA THR 84 HA THR 84 -11.011 3.200 9.071 682 HB THR 84 HB THR 84 -13.031 4.888 9.143 683 HG1 THR 84 HG1 THR 84 -12.059 6.269 11.155 684 1HG2 THR 84 1HG2 THR 84 -12.703 3.009 10.722 685 2HG2 THR 84 2HG2 THR 84 -13.430 4.436 11.460 686 3HG2 THR 84 3HG2 THR 84 -11.726 4.076 11.731 687 H HIS 85 H HIS 85 -9.614 3.420 7.058 688 HA HIS 85 HA HIS 85 -9.382 3.833 4.829 689 1HB HIS 85 1HB HIS 85 -12.268 4.704 4.782 690 2HB HIS 85 2HB HIS 85 -11.351 3.902 3.517 691 HD2 HIS 85 HD2 HIS 85 -10.652 1.790 6.458 692 HE1 HIS 85 HE1 HIS 85 -14.355 0.336 4.976 693 HE2 HIS 85 HE2 HIS 85 -12.507 -0.002 6.656 694 H PHE 86 H PHE 86 -8.760 5.952 6.621 695 HA PHE 86 HA PHE 86 -9.675 8.383 5.291 696 1HB PHE 86 1HB PHE 86 -8.402 7.754 7.888 697 2HB PHE 86 2HB PHE 86 -7.955 9.291 7.157 698 HD1 PHE 86 HD1 PHE 86 -8.994 10.803 8.609 699 HD2 PHE 86 HD2 PHE 86 -11.237 7.606 6.923 700 HE1 PHE 86 HE1 PHE 86 -11.070 11.817 9.456 701 HE2 PHE 86 HE2 PHE 86 -13.317 8.612 7.766 702 HZ PHE 86 HZ PHE 86 -13.234 10.721 9.034 703 H LEU 87 H LEU 87 -6.473 7.691 6.598 704 HA LEU 87 HA LEU 87 -5.215 8.981 4.359 705 1HB LEU 87 1HB LEU 87 -3.973 7.503 6.682 706 2HB LEU 87 2HB LEU 87 -3.110 8.499 5.529 707 HG LEU 87 HG LEU 87 -3.286 9.895 7.363 708 1HD1 LEU 87 1HD1 LEU 87 -4.943 11.620 6.848 709 2HD1 LEU 87 2HD1 LEU 87 -5.754 10.509 5.742 710 3HD1 LEU 87 3HD1 LEU 87 -4.112 11.057 5.398 711 1HD2 LEU 87 1HD2 LEU 87 -6.157 9.096 7.768 712 2HD2 LEU 87 2HD2 LEU 87 -5.147 10.055 8.845 713 3HD2 LEU 87 3HD2 LEU 87 -4.795 8.343 8.595 714 H ILE 88 H ILE 88 -5.510 5.671 5.613 715 HA ILE 88 HA ILE 88 -3.743 4.389 3.880 716 HB ILE 88 HB ILE 88 -6.401 3.273 4.795 717 1HG1 ILE 88 1HG1 ILE 88 -3.706 3.296 6.178 718 2HG1 ILE 88 2HG1 ILE 88 -5.242 3.900 6.792 719 1HG2 ILE 88 1HG2 ILE 88 -4.828 2.207 2.929 720 2HG2 ILE 88 2HG2 ILE 88 -5.743 1.229 4.076 721 3HG2 ILE 88 3HG2 ILE 88 -4.035 1.552 4.360 722 1HD1 ILE 88 1HD1 ILE 88 -5.925 1.349 6.414 723 2HD1 ILE 88 2HD1 ILE 88 -5.193 1.931 7.907 724 3HD1 ILE 88 3HD1 ILE 88 -4.196 1.139 6.686 725 H ASN 89 H ASN 89 -7.277 4.591 3.518 726 HA ASN 89 HA ASN 89 -7.421 3.646 0.923 727 1HB ASN 89 1HB ASN 89 -9.321 4.019 2.561 728 2HB ASN 89 2HB ASN 89 -9.314 5.702 2.038 729 1HD2 ASN 89 1HD2 ASN 89 -9.581 2.388 0.858 730 2HD2 ASN 89 2HD2 ASN 89 -10.610 2.756 -0.480 731 H GLU 90 H GLU 90 -7.051 6.989 2.049 732 HA GLU 90 HA GLU 90 -7.328 8.242 -0.427 733 1HB GLU 90 1HB GLU 90 -7.359 9.519 1.610 734 2HB GLU 90 2HB GLU 90 -5.721 9.021 2.006 735 1HG GLU 90 1HG GLU 90 -4.958 10.833 1.004 736 2HG GLU 90 2HG GLU 90 -5.588 10.230 -0.527 737 H ARG 91 H ARG 91 -4.313 7.286 1.235 738 HA ARG 91 HA ARG 91 -2.631 7.994 -0.917 739 1HB ARG 91 1HB ARG 91 -2.219 7.311 1.677 740 2HB ARG 91 2HB ARG 91 -1.677 5.855 0.859 741 1HG ARG 91 1HG ARG 91 0.223 6.819 0.242 742 2HG ARG 91 2HG ARG 91 -0.634 8.196 -0.446 743 1HD ARG 91 1HD ARG 91 -0.348 7.992 2.515 744 2HD ARG 91 2HD ARG 91 1.031 8.518 1.555 745 HE ARG 91 HE ARG 91 -0.237 10.402 0.837 746 1HH1 ARG 91 1HH1 ARG 91 -1.768 8.533 3.366 747 2HH1 ARG 91 2HH1 ARG 91 -2.868 9.796 3.796 748 1HH2 ARG 91 1HH2 ARG 91 -1.695 12.050 1.402 749 2HH2 ARG 91 2HH2 ARG 91 -2.830 11.788 2.682 750 H ILE 92 H ILE 92 -3.936 4.831 0.085 751 HA ILE 92 HA ILE 92 -2.632 3.298 -1.847 752 HB ILE 92 HB ILE 92 -3.826 2.303 0.036 753 1HG1 ILE 92 1HG1 ILE 92 -5.416 1.029 -2.038 754 2HG1 ILE 92 2HG1 ILE 92 -3.767 1.324 -2.565 755 1HG2 ILE 92 1HG2 ILE 92 -6.127 2.305 0.311 756 2HG2 ILE 92 2HG2 ILE 92 -6.421 2.805 -1.355 757 3HG2 ILE 92 3HG2 ILE 92 -5.754 3.950 -0.195 758 1HD1 ILE 92 1HD1 ILE 92 -3.625 -0.772 -1.629 759 2HD1 ILE 92 2HD1 ILE 92 -4.760 -0.383 -0.335 760 3HD1 ILE 92 3HD1 ILE 92 -3.120 0.267 -0.294 761 H GLU 93 H GLU 93 -5.947 4.631 -1.985 762 HA GLU 93 HA GLU 93 -6.472 3.930 -4.636 763 1HB GLU 93 1HB GLU 93 -7.796 5.388 -2.609 764 2HB GLU 93 2HB GLU 93 -7.770 6.419 -4.030 765 1HG GLU 93 1HG GLU 93 -9.764 5.203 -4.165 766 2HG GLU 93 2HG GLU 93 -8.670 4.434 -5.314 767 H ASP 94 H ASP 94 -4.508 6.487 -3.356 768 HA ASP 94 HA ASP 94 -4.585 8.158 -5.664 769 1HB ASP 94 1HB ASP 94 -2.859 8.013 -3.223 770 2HB ASP 94 2HB ASP 94 -2.330 8.988 -4.592 771 H TYR 95 H TYR 95 -2.534 5.488 -4.640 772 HA TYR 95 HA TYR 95 -0.743 5.807 -6.901 773 1HB TYR 95 1HB TYR 95 -0.012 5.020 -4.597 774 2HB TYR 95 2HB TYR 95 -0.837 3.507 -4.948 775 HD1 TYR 95 HD1 TYR 95 -0.131 2.840 -7.649 776 HD2 TYR 95 HD2 TYR 95 2.264 4.702 -4.663 777 HE1 TYR 95 HE1 TYR 95 1.890 1.992 -8.752 778 HE2 TYR 95 HE2 TYR 95 4.294 3.855 -5.763 779 HH TYR 95 HH TYR 95 4.508 1.488 -7.656 780 H VAL 96 H VAL 96 -2.806 3.171 -5.674 781 HA VAL 96 HA VAL 96 -2.681 1.545 -7.924 782 HB VAL 96 HB VAL 96 -5.155 1.752 -6.222 783 1HG1 VAL 96 1HG1 VAL 96 -4.212 -0.029 -8.255 784 2HG1 VAL 96 2HG1 VAL 96 -5.760 -0.020 -7.412 785 3HG1 VAL 96 3HG1 VAL 96 -4.395 -0.907 -6.736 786 1HG2 VAL 96 1HG2 VAL 96 -3.701 -0.188 -5.004 787 2HG2 VAL 96 2HG2 VAL 96 -3.806 1.481 -4.444 788 3HG2 VAL 96 3HG2 VAL 96 -2.437 0.965 -5.428 789 H ASN 97 H ASN 97 -4.912 4.182 -7.155 790 HA ASN 97 HA ASN 97 -6.001 3.951 -9.877 791 1HB ASN 97 1HB ASN 97 -7.329 5.536 -7.692 792 2HB ASN 97 2HB ASN 97 -8.040 4.841 -9.143 793 1HD2 ASN 97 1HD2 ASN 97 -9.271 3.152 -8.794 794 2HD2 ASN 97 2HD2 ASN 97 -9.109 2.016 -7.502 795 H LYS 98 H LYS 98 -3.594 5.104 -9.803 796 HA LYS 98 HA LYS 98 -3.786 7.953 -9.440 797 1HB LYS 98 1HB LYS 98 -1.484 8.027 -10.245 798 2HB LYS 98 2HB LYS 98 -1.683 6.833 -8.972 799 1HG LYS 98 1HG LYS 98 -1.978 5.163 -10.934 800 2HG LYS 98 2HG LYS 98 -1.192 6.424 -11.886 801 1HD LYS 98 1HD LYS 98 0.350 6.232 -9.581 802 2HD LYS 98 2HD LYS 98 -0.054 4.563 -9.975 803 1HE LYS 98 1HE LYS 98 0.624 5.352 -12.406 804 2HE LYS 98 2HE LYS 98 1.549 6.549 -11.502 805 1HZ LYS 98 1HZ LYS 98 1.959 4.034 -10.331 806 2HZ LYS 98 2HZ LYS 98 3.086 5.024 -11.113 807 3HZ LYS 98 3HZ LYS 98 2.207 3.881 -11.998 808 H PHE 99 H PHE 99 -4.909 5.953 -11.798 809 HA PHE 99 HA PHE 99 -4.192 7.473 -14.126 810 1HB PHE 99 1HB PHE 99 -4.883 4.976 -13.970 811 2HB PHE 99 2HB PHE 99 -6.533 5.588 -13.962 812 HD1 PHE 99 HD1 PHE 99 -4.151 4.219 -15.992 813 HD2 PHE 99 HD2 PHE 99 -6.840 7.517 -15.888 814 HE1 PHE 99 HE1 PHE 99 -4.120 4.318 -18.450 815 HE2 PHE 99 HE2 PHE 99 -6.812 7.621 -18.346 816 HZ PHE 99 HZ PHE 99 -5.451 6.020 -19.630 817 H VAL 100 H VAL 100 -7.240 6.985 -12.340 818 HA VAL 100 HA VAL 100 -8.515 9.152 -13.740 819 HB VAL 100 HB VAL 100 -9.821 7.202 -13.096 820 1HG1 VAL 100 1HG1 VAL 100 -10.397 7.371 -10.451 821 2HG1 VAL 100 2HG1 VAL 100 -8.684 7.791 -10.459 822 3HG1 VAL 100 3HG1 VAL 100 -9.218 6.261 -11.152 823 1HG2 VAL 100 1HG2 VAL 100 -11.752 8.330 -12.404 824 2HG2 VAL 100 2HG2 VAL 100 -10.789 9.566 -13.213 825 3HG2 VAL 100 3HG2 VAL 100 -10.838 9.499 -11.452 826 H ILE 101 H ILE 101 -6.703 8.835 -10.802 827 HA ILE 101 HA ILE 101 -7.800 11.321 -9.755 828 HB ILE 101 HB ILE 101 -6.544 10.969 -7.764 829 1HG1 ILE 101 1HG1 ILE 101 -5.190 8.607 -7.875 830 2HG1 ILE 101 2HG1 ILE 101 -4.913 9.233 -9.493 831 1HG2 ILE 101 1HG2 ILE 101 -8.247 9.609 -7.293 832 2HG2 ILE 101 2HG2 ILE 101 -7.121 8.286 -7.596 833 3HG2 ILE 101 3HG2 ILE 101 -8.190 8.845 -8.881 834 1HD1 ILE 101 1HD1 ILE 101 -3.983 10.255 -6.877 835 2HD1 ILE 101 2HD1 ILE 101 -4.309 11.425 -8.154 836 3HD1 ILE 101 3HD1 ILE 101 -3.131 10.139 -8.417 837 H CYS 102 H CYS 102 -4.644 10.076 -10.876 838 HA CYS 102 HA CYS 102 -3.574 12.783 -10.864 839 1HB CYS 102 1HB CYS 102 -2.296 10.622 -10.165 840 2HB CYS 102 2HB CYS 102 -2.067 10.406 -11.897 841 H HIS 103 H HIS 103 -5.433 11.064 -12.960 842 HA HIS 103 HA HIS 103 -5.959 11.266 -15.161 843 1HB HIS 103 1HB HIS 103 -4.378 13.809 -14.798 844 2HB HIS 103 2HB HIS 103 -5.130 13.380 -16.330 845 HD2 HIS 103 HD2 HIS 103 -7.186 12.632 -13.138 846 HE1 HIS 103 HE1 HIS 103 -8.833 16.083 -14.980 847 HE2 HIS 103 HE2 HIS 103 -9.174 14.285 -13.247 848 H GLU 104 H GLU 104 -4.137 9.412 -14.796 849 HA GLU 104 HA GLU 104 -2.320 8.288 -15.608 850 1HB GLU 104 1HB GLU 104 -4.131 8.427 -17.479 851 2HB GLU 104 2HB GLU 104 -2.966 9.474 -18.281 852 1HG GLU 104 1HG GLU 104 -1.343 7.453 -17.673 853 2HG GLU 104 2HG GLU 104 -2.862 6.567 -17.755 854 H CYS 105 H CYS 105 -0.825 9.733 -14.471 855 HA CYS 105 HA CYS 105 0.454 11.867 -15.857 856 1HB CYS 105 1HB CYS 105 0.345 11.106 -13.252 857 2HB CYS 105 2HB CYS 105 1.947 10.520 -13.687 858 H ASN 106 H ASN 106 0.684 10.379 -17.850 859 HA ASN 106 HA ASN 106 2.790 8.452 -17.807 860 1HB ASN 106 1HB ASN 106 0.777 9.292 -19.649 861 2HB ASN 106 2HB ASN 106 2.329 9.361 -20.472 862 1HD2 ASN 106 1HD2 ASN 106 2.438 7.618 -21.694 863 2HD2 ASN 106 2HD2 ASN 106 2.153 5.999 -21.162 864 H ARG 107 H ARG 107 3.051 10.776 -20.390 865 HA ARG 107 HA ARG 107 5.660 11.595 -19.313 866 1HB ARG 107 1HB ARG 107 5.629 10.345 -21.488 867 2HB ARG 107 2HB ARG 107 4.743 11.692 -22.189 868 1HG ARG 107 1HG ARG 107 6.865 12.225 -22.823 869 2HG ARG 107 2HG ARG 107 6.779 13.085 -21.284 870 1HD ARG 107 1HD ARG 107 7.996 10.366 -21.754 871 2HD ARG 107 2HD ARG 107 8.874 11.867 -21.467 872 HE ARG 107 HE ARG 107 7.708 10.170 -19.506 873 1HH1 ARG 107 1HH1 ARG 107 8.434 13.506 -20.227 874 2HH1 ARG 107 2HH1 ARG 107 8.480 13.985 -18.563 875 1HH2 ARG 107 1HH2 ARG 107 7.770 10.798 -17.318 876 2HH2 ARG 107 2HH2 ARG 107 8.103 12.449 -16.912 877 HA PRO 108 HA PRO 108 2.688 15.356 -19.278 878 1HB PRO 108 1HB PRO 108 4.327 15.800 -16.834 879 2HB PRO 108 2HB PRO 108 2.599 16.065 -17.095 880 1HG PRO 108 1HG PRO 108 3.487 13.973 -15.694 881 2HG PRO 108 2HG PRO 108 2.072 13.844 -16.754 882 1HD PRO 108 1HD PRO 108 4.841 12.825 -17.150 883 2HD PRO 108 2HD PRO 108 3.294 12.159 -17.703 884 H ASP 109 H ASP 109 3.282 17.346 -20.018 885 HA ASP 109 HA ASP 109 6.070 17.707 -20.754 886 1HB ASP 109 1HB ASP 109 3.882 19.689 -21.314 887 2HB ASP 109 2HB ASP 109 5.338 19.362 -22.247 888 H THR 110 H THR 110 5.697 17.810 -18.012 889 HA THR 110 HA THR 110 6.382 20.597 -17.461 890 HB THR 110 HB THR 110 5.180 19.620 -15.111 891 HG1 THR 110 HG1 THR 110 3.652 19.080 -17.432 892 1HG2 THR 110 1HG2 THR 110 4.563 21.736 -15.170 893 2HG2 THR 110 2HG2 THR 110 3.337 21.303 -16.364 894 3HG2 THR 110 3HG2 THR 110 4.928 21.847 -16.891 895 H ARG 111 H ARG 111 7.248 20.652 -15.037 896 HA ARG 111 HA ARG 111 9.510 18.842 -15.070 897 1HB ARG 111 1HB ARG 111 8.867 21.466 -13.980 898 2HB ARG 111 2HB ARG 111 9.711 20.454 -12.817 899 1HG ARG 111 1HG ARG 111 11.006 20.221 -15.342 900 2HG ARG 111 2HG ARG 111 10.782 21.931 -14.966 901 1HD ARG 111 1HD ARG 111 12.442 21.853 -13.498 902 2HD ARG 111 2HD ARG 111 11.626 20.574 -12.605 903 HE ARG 111 HE ARG 111 13.718 20.251 -14.605 904 1HH1 ARG 111 1HH1 ARG 111 11.391 18.743 -12.475 905 2HH1 ARG 111 2HH1 ARG 111 12.160 17.195 -12.535 906 1HH2 ARG 111 1HH2 ARG 111 14.715 18.210 -14.688 907 2HH2 ARG 111 2HH2 ARG 111 14.042 16.890 -13.790 908 H ILE 112 H ILE 112 8.905 16.868 -14.359 909 HA ILE 112 HA ILE 112 7.511 16.663 -11.783 910 HB ILE 112 HB ILE 112 8.029 14.195 -13.324 911 1HG1 ILE 112 1HG1 ILE 112 5.662 15.086 -14.472 912 2HG1 ILE 112 2HG1 ILE 112 6.710 16.495 -14.555 913 1HG2 ILE 112 1HG2 ILE 112 5.408 15.134 -12.229 914 2HG2 ILE 112 2HG2 ILE 112 6.679 14.546 -11.156 915 3HG2 ILE 112 3HG2 ILE 112 6.022 13.490 -12.407 916 1HD1 ILE 112 1HD1 ILE 112 8.142 15.511 -16.021 917 2HD1 ILE 112 2HD1 ILE 112 6.648 14.683 -16.465 918 3HD1 ILE 112 3HD1 ILE 112 7.822 13.886 -15.417 919 H ILE 113 H ILE 113 8.316 15.287 -10.151 920 HA ILE 113 HA ILE 113 11.010 14.211 -10.479 921 HB ILE 113 HB ILE 113 11.222 16.572 -9.646 922 1HG1 ILE 113 1HG1 ILE 113 12.837 14.618 -9.176 923 2HG1 ILE 113 2HG1 ILE 113 13.005 16.088 -8.225 924 1HG2 ILE 113 1HG2 ILE 113 9.453 15.527 -7.531 925 2HG2 ILE 113 2HG2 ILE 113 9.610 17.152 -8.189 926 3HG2 ILE 113 3HG2 ILE 113 10.780 16.562 -7.008 927 1HD1 ILE 113 1HD1 ILE 113 12.898 13.564 -7.221 928 2HD1 ILE 113 2HD1 ILE 113 11.233 14.110 -7.018 929 3HD1 ILE 113 3HD1 ILE 113 12.556 15.037 -6.315 930 H ARG 114 H ARG 114 11.285 12.322 -9.376 931 HA ARG 114 HA ARG 114 9.332 11.655 -7.279 932 1HB ARG 114 1HB ARG 114 9.122 10.578 -9.763 933 2HB ARG 114 2HB ARG 114 10.208 9.418 -9.012 934 1HG ARG 114 1HG ARG 114 8.627 8.731 -7.464 935 2HG ARG 114 2HG ARG 114 7.668 10.195 -7.638 936 1HD ARG 114 1HD ARG 114 7.681 9.079 -10.177 937 2HD ARG 114 2HD ARG 114 7.524 7.697 -9.098 938 HE ARG 114 HE ARG 114 5.522 9.609 -9.715 939 1HH1 ARG 114 1HH1 ARG 114 6.720 7.721 -7.031 940 2HH1 ARG 114 2HH1 ARG 114 5.165 7.567 -6.287 941 1HH2 ARG 114 1HH2 ARG 114 3.475 9.394 -8.732 942 2HH2 ARG 114 2HH2 ARG 114 3.329 8.511 -7.250 943 H GLU 115 H GLU 115 10.252 10.891 -5.466 944 HA GLU 115 HA GLU 115 12.881 9.607 -5.649 945 1HB GLU 115 1HB GLU 115 13.739 10.933 -3.782 946 2HB GLU 115 2HB GLU 115 13.303 11.962 -5.139 947 1HG GLU 115 1HG GLU 115 11.882 13.121 -3.901 948 2HG GLU 115 2HG GLU 115 11.077 11.655 -3.347 949 H GLY 116 H GLY 116 13.256 8.006 -4.178 950 1HA GLY 116 1HA GLY 116 12.885 6.882 -2.104 951 2HA GLY 116 2HA GLY 116 11.289 7.608 -2.030 952 H ARG 117 H ARG 117 12.831 5.873 -4.709 953 HA ARG 117 HA ARG 117 12.140 4.094 -5.947 954 1HB ARG 117 1HB ARG 117 11.963 3.315 -3.137 955 2HB ARG 117 2HB ARG 117 10.907 2.364 -4.170 956 1HG ARG 117 1HG ARG 117 12.609 1.191 -4.964 957 2HG ARG 117 2HG ARG 117 13.515 2.652 -5.360 958 1HD ARG 117 1HD ARG 117 13.583 2.393 -2.554 959 2HD ARG 117 2HD ARG 117 13.918 0.795 -3.219 960 HE ARG 117 HE ARG 117 15.407 3.060 -4.299 961 1HH1 ARG 117 1HH1 ARG 117 15.374 0.227 -2.250 962 2HH1 ARG 117 2HH1 ARG 117 17.099 0.100 -2.196 963 1HH2 ARG 117 1HH2 ARG 117 17.670 2.890 -4.219 964 2HH2 ARG 117 2HH2 ARG 117 18.402 1.610 -3.310 965 H ILE 118 H ILE 118 10.380 6.164 -6.149 966 HA ILE 118 HA ILE 118 8.307 6.589 -7.011 967 HB ILE 118 HB ILE 118 7.634 3.681 -6.574 968 1HG1 ILE 118 1HG1 ILE 118 9.707 3.833 -7.874 969 2HG1 ILE 118 2HG1 ILE 118 8.373 3.300 -8.889 970 1HG2 ILE 118 1HG2 ILE 118 5.960 5.641 -7.236 971 2HG2 ILE 118 2HG2 ILE 118 5.806 4.003 -7.866 972 3HG2 ILE 118 3HG2 ILE 118 6.577 5.254 -8.842 973 1HD1 ILE 118 1HD1 ILE 118 9.035 6.198 -8.790 974 2HD1 ILE 118 2HD1 ILE 118 8.337 5.241 -10.097 975 3HD1 ILE 118 3HD1 ILE 118 10.056 5.107 -9.728 976 H SER 119 H SER 119 8.690 7.280 -4.447 977 HA SER 119 HA SER 119 6.177 6.497 -3.111 978 1HB SER 119 1HB SER 119 7.309 6.921 -0.954 979 2HB SER 119 2HB SER 119 8.101 5.647 -1.881 980 HG SER 119 HG SER 119 9.369 7.694 -2.662 981 H LEU 120 H LEU 120 8.359 9.139 -3.905 982 HA LEU 120 HA LEU 120 6.227 11.029 -3.138 983 1HB LEU 120 1HB LEU 120 9.196 11.232 -2.723 984 2HB LEU 120 2HB LEU 120 8.196 12.666 -2.819 985 HG LEU 120 HG LEU 120 8.678 11.974 -0.498 986 1HD1 LEU 120 1HD1 LEU 120 5.910 12.156 -1.565 987 2HD1 LEU 120 2HD1 LEU 120 6.794 13.259 -0.511 988 3HD1 LEU 120 3HD1 LEU 120 6.134 11.758 0.138 989 1HD2 LEU 120 1HD2 LEU 120 8.171 9.940 0.367 990 2HD2 LEU 120 2HD2 LEU 120 8.433 9.452 -1.306 991 3HD2 LEU 120 3HD2 LEU 120 6.793 9.700 -0.707 992 H LEU 121 H LEU 121 6.193 13.034 -4.417 993 HA LEU 121 HA LEU 121 7.787 13.508 -6.651 994 1HB LEU 121 1HB LEU 121 6.996 11.500 -7.633 995 2HB LEU 121 2HB LEU 121 5.344 11.834 -7.181 996 HG LEU 121 HG LEU 121 6.100 13.941 -8.887 997 1HD1 LEU 121 1HD1 LEU 121 7.467 11.449 -9.561 998 2HD1 LEU 121 2HD1 LEU 121 7.793 13.101 -10.081 999 3HD1 LEU 121 3HD1 LEU 121 6.537 12.160 -10.877 1000 1HD2 LEU 121 1HD2 LEU 121 4.373 13.112 -10.290 1001 2HD2 LEU 121 2HD2 LEU 121 3.894 12.802 -8.624 1002 3HD2 LEU 121 3HD2 LEU 121 4.524 11.490 -9.615 1003 H LYS 122 H LYS 122 6.961 15.208 -8.060 1004 HA LYS 122 HA LYS 122 4.840 16.782 -6.752 1005 1HB LYS 122 1HB LYS 122 7.316 17.648 -7.002 1006 2HB LYS 122 2HB LYS 122 6.806 18.009 -8.646 1007 1HG LYS 122 1HG LYS 122 5.429 19.690 -8.004 1008 2HG LYS 122 2HG LYS 122 5.029 18.924 -6.467 1009 1HD LYS 122 1HD LYS 122 7.145 19.585 -5.528 1010 2HD LYS 122 2HD LYS 122 7.688 20.206 -7.089 1011 1HE LYS 122 1HE LYS 122 5.450 21.630 -6.840 1012 2HE LYS 122 2HE LYS 122 5.787 21.368 -5.130 1013 1HZ LYS 122 1HZ LYS 122 7.731 22.568 -5.240 1014 2HZ LYS 122 2HZ LYS 122 6.759 23.424 -6.328 1015 3HZ LYS 122 3HZ LYS 122 7.923 22.342 -6.906 1016 H CYS 123 H CYS 123 3.201 17.673 -7.989 1017 HA CYS 123 HA CYS 123 3.188 17.141 -10.870 1018 1HB CYS 123 1HB CYS 123 1.148 16.155 -8.887 1019 2HB CYS 123 2HB CYS 123 0.713 16.444 -10.564 1020 H GLU 124 H GLU 124 3.647 19.569 -9.671 1021 HA GLU 124 HA GLU 124 1.587 21.250 -9.061 1022 1HB GLU 124 1HB GLU 124 4.007 21.842 -9.117 1023 2HB GLU 124 2HB GLU 124 3.903 21.954 -10.869 1024 1HG GLU 124 1HG GLU 124 1.930 23.622 -10.248 1025 2HG GLU 124 2HG GLU 124 2.897 23.791 -8.782 1026 H ALA 125 H ALA 125 2.438 19.984 -12.208 1027 HA ALA 125 HA ALA 125 0.847 21.734 -13.767 1028 1HB ALA 125 1HB ALA 125 0.981 19.704 -15.404 1029 2HB ALA 125 2HB ALA 125 2.138 19.084 -14.225 1030 3HB ALA 125 3HB ALA 125 2.427 20.629 -15.013 1031 H CYS 126 H CYS 126 0.256 18.256 -13.487 1032 HA CYS 126 HA CYS 126 -2.560 18.605 -13.878 1033 1HB CYS 126 1HB CYS 126 -2.660 16.174 -13.753 1034 2HB CYS 126 2HB CYS 126 -1.306 16.662 -14.766 1035 H GLY 127 H GLY 127 -2.025 20.077 -11.682 1036 1HA GLY 127 1HA GLY 127 -3.453 20.229 -9.745 1037 2HA GLY 127 2HA GLY 127 -3.267 18.494 -9.533 1038 H ALA 128 H ALA 128 -2.036 17.962 -7.875 1039 HA ALA 128 HA ALA 128 0.484 19.318 -7.407 1040 1HB ALA 128 1HB ALA 128 -1.386 20.540 -6.131 1041 2HB ALA 128 2HB ALA 128 0.070 20.085 -5.245 1042 3HB ALA 128 3HB ALA 128 -1.398 19.122 -5.082 1043 H LYS 129 H LYS 129 1.891 18.148 -6.016 1044 HA LYS 129 HA LYS 129 1.039 15.474 -5.191 1045 1HB LYS 129 1HB LYS 129 2.365 15.921 -7.586 1046 2HB LYS 129 2HB LYS 129 3.638 15.433 -6.502 1047 1HG LYS 129 1HG LYS 129 1.184 13.893 -7.276 1048 2HG LYS 129 2HG LYS 129 2.866 13.500 -7.607 1049 1HD LYS 129 1HD LYS 129 3.293 12.952 -5.357 1050 2HD LYS 129 2HD LYS 129 1.792 13.702 -4.817 1051 1HE LYS 129 1HE LYS 129 1.632 11.459 -6.759 1052 2HE LYS 129 2HE LYS 129 2.004 11.088 -5.075 1053 1HZ LYS 129 1HZ LYS 129 -0.490 11.566 -6.179 1054 2HZ LYS 129 2HZ LYS 129 -0.151 12.913 -5.212 1055 3HZ LYS 129 3HZ LYS 129 -0.114 11.360 -4.542 1056 H ALA 130 H ALA 130 2.429 14.526 -3.590 1057 HA ALA 130 HA ALA 130 3.763 16.476 -1.941 1058 1HB ALA 130 1HB ALA 130 3.139 15.105 -0.311 1059 2HB ALA 130 2HB ALA 130 4.101 13.793 -0.992 1060 3HB ALA 130 3HB ALA 130 2.436 14.035 -1.524 1061 HA PRO 131 HA PRO 131 7.673 15.364 -3.991 1062 1HB PRO 131 1HB PRO 131 9.049 17.560 -3.251 1063 2HB PRO 131 2HB PRO 131 7.868 17.577 -4.558 1064 1HG PRO 131 1HG PRO 131 7.555 18.474 -1.721 1065 2HG PRO 131 2HG PRO 131 7.008 19.259 -3.211 1066 1HD PRO 131 1HD PRO 131 5.368 17.777 -1.617 1067 2HD PRO 131 2HD PRO 131 5.139 17.950 -3.367 1068 H LEU 132 H LEU 132 7.941 16.935 -0.746 1069 HA LEU 132 HA LEU 132 8.853 14.611 0.542 1070 1HB LEU 132 1HB LEU 132 11.218 15.324 0.989 1071 2HB LEU 132 2HB LEU 132 10.898 14.712 -0.621 1072 HG LEU 132 HG LEU 132 10.905 17.667 -0.119 1073 1HD1 LEU 132 1HD1 LEU 132 12.996 17.358 0.716 1074 2HD1 LEU 132 2HD1 LEU 132 13.382 17.335 -1.005 1075 3HD1 LEU 132 3HD1 LEU 132 13.222 15.820 -0.117 1076 1HD2 LEU 132 1HD2 LEU 132 10.153 17.164 -2.256 1077 2HD2 LEU 132 2HD2 LEU 132 11.286 15.832 -2.452 1078 3HD2 LEU 132 3HD2 LEU 132 11.864 17.498 -2.497 1079 H LYS 133 H LYS 133 9.388 18.127 0.554 1080 HA LYS 133 HA LYS 133 8.204 18.241 3.211 1081 1HB LYS 133 1HB LYS 133 10.997 19.162 2.550 1082 2HB LYS 133 2HB LYS 133 10.092 19.844 3.894 1083 1HG LYS 133 1HG LYS 133 10.416 18.046 5.188 1084 2HG LYS 133 2HG LYS 133 10.170 16.917 3.855 1085 1HD LYS 133 1HD LYS 133 12.375 16.823 3.352 1086 2HD LYS 133 2HD LYS 133 12.644 18.521 3.749 1087 1HE LYS 133 1HE LYS 133 12.187 16.376 5.814 1088 2HE LYS 133 2HE LYS 133 13.786 16.868 5.259 1089 1HZ LYS 133 1HZ LYS 133 13.431 19.053 6.093 1090 2HZ LYS 133 2HZ LYS 133 13.038 17.973 7.333 1091 3HZ LYS 133 3HZ LYS 133 11.809 18.731 6.451 1092 H ASN 134 H ASN 134 7.911 20.603 3.870 1093 HA ASN 134 HA ASN 134 7.479 22.270 1.485 1094 1HB ASN 134 1HB ASN 134 5.369 23.088 2.637 1095 2HB ASN 134 2HB ASN 134 5.313 21.451 1.990 1096 1HD2 ASN 134 1HD2 ASN 134 4.559 23.313 4.576 1097 2HD2 ASN 134 2HD2 ASN 134 4.475 22.095 5.799 1098 H VAL 135 H VAL 135 7.369 24.556 1.893 1099 HA VAL 135 HA VAL 135 8.585 25.389 4.436 1100 HB VAL 135 HB VAL 135 10.380 25.305 2.807 1101 1HG1 VAL 135 1HG1 VAL 135 8.423 26.782 1.112 1102 2HG1 VAL 135 2HG1 VAL 135 9.486 25.436 0.699 1103 3HG1 VAL 135 3HG1 VAL 135 10.148 27.061 0.876 1104 1HG2 VAL 135 1HG2 VAL 135 10.693 27.049 4.339 1105 2HG2 VAL 135 2HG2 VAL 135 9.430 28.040 3.610 1106 3HG2 VAL 135 3HG2 VAL 135 10.960 27.799 2.767 Start of MODEL 5 1 H MET 1 H MET 1 -6.350 -3.075 -27.908 2 HA MET 1 HA MET 1 -8.406 -4.136 -28.519 3 1HB MET 1 1HB MET 1 -6.648 -2.839 -30.051 4 2HB MET 1 2HB MET 1 -6.632 -4.378 -30.900 5 1HG MET 1 1HG MET 1 -8.376 -3.597 -32.031 6 2HG MET 1 2HG MET 1 -9.311 -3.908 -30.570 7 1HE MET 1 1HE MET 1 -11.067 -2.302 -31.375 8 2HE MET 1 2HE MET 1 -11.041 -0.640 -30.787 9 3HE MET 1 3HE MET 1 -10.877 -1.980 -29.652 10 H ASP 2 H ASP 2 -5.540 -6.077 -29.352 11 HA ASP 2 HA ASP 2 -7.311 -8.388 -29.766 12 1HB ASP 2 1HB ASP 2 -5.382 -7.424 -31.436 13 2HB ASP 2 2HB ASP 2 -4.480 -8.646 -30.545 14 H ASP 3 H ASP 3 -5.434 -10.414 -29.497 15 HA ASP 3 HA ASP 3 -5.461 -10.858 -26.720 16 1HB ASP 3 1HB ASP 3 -3.836 -12.245 -28.866 17 2HB ASP 3 2HB ASP 3 -4.088 -12.851 -27.232 18 H TYR 4 H TYR 4 -3.036 -11.886 -25.990 19 HA TYR 4 HA TYR 4 -1.641 -9.663 -25.072 20 1HB TYR 4 1HB TYR 4 -1.116 -12.584 -25.177 21 2HB TYR 4 2HB TYR 4 0.269 -11.538 -24.883 22 HD1 TYR 4 HD1 TYR 4 0.577 -10.469 -22.780 23 HD2 TYR 4 HD2 TYR 4 -3.038 -12.559 -23.594 24 HE1 TYR 4 HE1 TYR 4 -0.037 -10.320 -20.404 25 HE2 TYR 4 HE2 TYR 4 -3.663 -12.414 -21.220 26 HH TYR 4 HH TYR 4 -2.589 -10.404 -19.153 27 H GLU 5 H GLU 5 -0.514 -8.228 -26.188 28 HA GLU 5 HA GLU 5 0.602 -8.896 -28.773 29 1HB GLU 5 1HB GLU 5 0.775 -6.287 -27.256 30 2HB GLU 5 2HB GLU 5 1.100 -6.534 -28.967 31 1HG GLU 5 1HG GLU 5 -1.269 -7.192 -29.271 32 2HG GLU 5 2HG GLU 5 -1.558 -6.783 -27.581 33 H LYS 6 H LYS 6 1.687 -8.591 -25.506 34 HA LYS 6 HA LYS 6 4.201 -9.728 -26.047 35 1HB LYS 6 1HB LYS 6 4.051 -6.796 -26.142 36 2HB LYS 6 2HB LYS 6 5.288 -7.411 -25.055 37 1HG LYS 6 1HG LYS 6 5.916 -8.916 -27.098 38 2HG LYS 6 2HG LYS 6 5.062 -7.674 -28.014 39 1HD LYS 6 1HD LYS 6 6.585 -6.091 -26.505 40 2HD LYS 6 2HD LYS 6 7.620 -7.520 -26.525 41 1HE LYS 6 1HE LYS 6 6.550 -6.046 -28.930 42 2HE LYS 6 2HE LYS 6 8.211 -6.020 -28.341 43 1HZ LYS 6 1HZ LYS 6 6.746 -8.259 -29.598 44 2HZ LYS 6 2HZ LYS 6 8.149 -8.521 -28.691 45 3HZ LYS 6 3HZ LYS 6 8.209 -7.555 -30.078 46 H LEU 7 H LEU 7 5.507 -9.994 -24.106 47 HA LEU 7 HA LEU 7 3.822 -10.042 -21.730 48 1HB LEU 7 1HB LEU 7 5.663 -11.815 -22.774 49 2HB LEU 7 2HB LEU 7 6.536 -11.085 -21.441 50 HG LEU 7 HG LEU 7 3.784 -12.012 -20.858 51 1HD1 LEU 7 1HD1 LEU 7 5.804 -14.132 -20.666 52 2HD1 LEU 7 2HD1 LEU 7 5.298 -13.729 -22.306 53 3HD1 LEU 7 3HD1 LEU 7 4.099 -14.219 -21.110 54 1HD2 LEU 7 1HD2 LEU 7 4.754 -12.571 -18.739 55 2HD2 LEU 7 2HD2 LEU 7 5.302 -10.957 -19.193 56 3HD2 LEU 7 3HD2 LEU 7 6.384 -12.338 -19.371 57 H LEU 8 H LEU 8 7.323 -9.453 -22.021 58 HA LEU 8 HA LEU 8 6.998 -7.232 -20.120 59 1HB LEU 8 1HB LEU 8 9.521 -7.566 -19.811 60 2HB LEU 8 2HB LEU 8 8.436 -8.745 -19.104 61 HG LEU 8 HG LEU 8 9.217 -9.548 -21.773 62 1HD1 LEU 8 1HD1 LEU 8 11.255 -8.205 -20.405 63 2HD1 LEU 8 2HD1 LEU 8 11.412 -9.248 -21.818 64 3HD1 LEU 8 3HD1 LEU 8 11.591 -9.925 -20.199 65 1HD2 LEU 8 1HD2 LEU 8 8.295 -11.140 -20.297 66 2HD2 LEU 8 2HD2 LEU 8 9.417 -10.707 -19.007 67 3HD2 LEU 8 3HD2 LEU 8 10.005 -11.553 -20.438 68 H GLU 9 H GLU 9 8.476 -5.391 -20.380 69 HA GLU 9 HA GLU 9 9.547 -4.971 -23.049 70 1HB GLU 9 1HB GLU 9 8.302 -2.729 -23.144 71 2HB GLU 9 2HB GLU 9 7.385 -4.183 -23.506 72 1HG GLU 9 1HG GLU 9 7.067 -3.873 -20.782 73 2HG GLU 9 2HG GLU 9 7.017 -2.225 -21.404 74 H ARG 10 H ARG 10 10.140 -2.349 -23.004 75 HA ARG 10 HA ARG 10 12.257 -2.231 -21.096 76 1HB ARG 10 1HB ARG 10 11.697 -1.032 -23.553 77 2HB ARG 10 2HB ARG 10 11.697 0.299 -22.405 78 1HG ARG 10 1HG ARG 10 13.928 -1.705 -22.605 79 2HG ARG 10 2HG ARG 10 13.895 -0.189 -23.505 80 1HD ARG 10 1HD ARG 10 14.865 0.752 -21.739 81 2HD ARG 10 2HD ARG 10 13.332 0.557 -20.895 82 HE ARG 10 HE ARG 10 14.274 -1.698 -20.222 83 1HH1 ARG 10 1HH1 ARG 10 16.297 1.095 -20.805 84 2HH1 ARG 10 2HH1 ARG 10 17.563 0.542 -19.765 85 1HH2 ARG 10 1HH2 ARG 10 15.941 -2.413 -18.854 86 2HH2 ARG 10 2HH2 ARG 10 17.364 -1.444 -18.659 87 H ALA 11 H ALA 11 9.052 -0.862 -21.317 88 HA ALA 11 HA ALA 11 9.055 -0.152 -18.555 89 1HB ALA 11 1HB ALA 11 8.524 2.298 -20.075 90 2HB ALA 11 2HB ALA 11 10.207 1.770 -20.099 91 3HB ALA 11 3HB ALA 11 9.397 2.066 -18.561 92 H ILE 12 H ILE 12 7.048 -0.503 -17.872 93 HA ILE 12 HA ILE 12 4.868 -0.470 -19.827 94 HB ILE 12 HB ILE 12 4.638 -1.473 -17.001 95 1HG1 ILE 12 1HG1 ILE 12 5.111 -3.462 -19.132 96 2HG1 ILE 12 2HG1 ILE 12 6.514 -2.494 -18.693 97 1HG2 ILE 12 1HG2 ILE 12 2.528 -1.310 -17.984 98 2HG2 ILE 12 2HG2 ILE 12 2.972 -3.000 -18.218 99 3HG2 ILE 12 3HG2 ILE 12 3.115 -1.857 -19.554 100 1HD1 ILE 12 1HD1 ILE 12 6.140 -4.712 -17.483 101 2HD1 ILE 12 2HD1 ILE 12 4.865 -3.865 -16.609 102 3HD1 ILE 12 3HD1 ILE 12 6.531 -3.293 -16.511 103 H ASP 13 H ASP 13 6.043 1.965 -18.568 104 HA ASP 13 HA ASP 13 3.539 3.028 -17.447 105 1HB ASP 13 1HB ASP 13 6.243 3.046 -16.281 106 2HB ASP 13 2HB ASP 13 5.435 4.610 -16.271 107 H GLN 14 H GLN 14 6.678 3.917 -18.872 108 HA GLN 14 HA GLN 14 5.919 6.512 -19.658 109 1HB GLN 14 1HB GLN 14 8.200 4.759 -20.010 110 2HB GLN 14 2HB GLN 14 7.858 5.650 -21.487 111 1HG GLN 14 1HG GLN 14 8.264 6.875 -18.767 112 2HG GLN 14 2HG GLN 14 9.471 6.797 -20.050 113 1HE2 GLN 14 1HE2 GLN 14 9.685 8.991 -20.268 114 2HE2 GLN 14 2HE2 GLN 14 8.443 10.003 -20.915 115 H LEU 15 H LEU 15 6.216 3.534 -21.597 116 HA LEU 15 HA LEU 15 5.229 2.878 -23.537 117 1HB LEU 15 1HB LEU 15 3.172 3.026 -22.311 118 2HB LEU 15 2HB LEU 15 3.109 4.766 -22.527 119 HG LEU 15 HG LEU 15 2.708 4.489 -24.912 120 1HD1 LEU 15 1HD1 LEU 15 2.127 2.012 -25.564 121 2HD1 LEU 15 2HD1 LEU 15 3.272 1.637 -24.276 122 3HD1 LEU 15 3HD1 LEU 15 3.784 2.611 -25.655 123 1HD2 LEU 15 1HD2 LEU 15 0.686 4.608 -23.818 124 2HD2 LEU 15 2HD2 LEU 15 0.941 3.092 -22.954 125 3HD2 LEU 15 3HD2 LEU 15 0.533 3.072 -24.669 126 HA PRO 16 HA PRO 16 7.121 6.238 -25.982 127 1HB PRO 16 1HB PRO 16 7.149 4.614 -28.263 128 2HB PRO 16 2HB PRO 16 8.481 4.834 -27.127 129 1HG PRO 16 1HG PRO 16 6.478 2.637 -27.299 130 2HG PRO 16 2HG PRO 16 8.190 2.568 -26.841 131 1HD PRO 16 1HD PRO 16 6.242 2.410 -25.011 132 2HD PRO 16 2HD PRO 16 7.764 3.260 -24.669 133 HA PRO 17 HA PRO 17 3.289 7.738 -27.678 134 1HB PRO 17 1HB PRO 17 4.389 9.616 -29.370 135 2HB PRO 17 2HB PRO 17 4.103 9.867 -27.645 136 1HG PRO 17 1HG PRO 17 6.628 9.104 -29.056 137 2HG PRO 17 2HG PRO 17 6.392 10.241 -27.716 138 1HD PRO 17 1HD PRO 17 7.352 7.775 -27.301 139 2HD PRO 17 2HD PRO 17 6.253 8.546 -26.138 140 H GLU 18 H GLU 18 2.708 5.858 -28.852 141 HA GLU 18 HA GLU 18 2.507 6.185 -31.619 142 1HB GLU 18 1HB GLU 18 4.938 5.625 -31.538 143 2HB GLU 18 2HB GLU 18 4.518 4.062 -30.853 144 1HG GLU 18 1HG GLU 18 3.945 3.214 -32.834 145 2HG GLU 18 2HG GLU 18 3.089 4.676 -33.319 146 H VAL 19 H VAL 19 3.174 3.223 -29.757 147 HA VAL 19 HA VAL 19 0.550 2.203 -30.559 148 HB VAL 19 HB VAL 19 1.413 0.028 -29.616 149 1HG1 VAL 19 1HG1 VAL 19 1.734 -0.301 -31.789 150 2HG1 VAL 19 2HG1 VAL 19 3.397 0.243 -31.568 151 3HG1 VAL 19 3HG1 VAL 19 2.148 1.394 -32.044 152 1HG2 VAL 19 1HG2 VAL 19 4.048 1.494 -29.569 153 2HG2 VAL 19 2HG2 VAL 19 3.779 -0.208 -29.197 154 3HG2 VAL 19 3HG2 VAL 19 3.119 1.039 -28.140 155 H PHE 20 H PHE 20 -0.885 1.253 -29.047 156 HA PHE 20 HA PHE 20 -0.865 2.593 -26.479 157 1HB PHE 20 1HB PHE 20 -2.897 2.112 -28.114 158 2HB PHE 20 2HB PHE 20 -2.967 0.603 -27.211 159 HD1 PHE 20 HD1 PHE 20 -4.188 3.848 -27.363 160 HD2 PHE 20 HD2 PHE 20 -2.797 0.957 -24.567 161 HE1 PHE 20 HE1 PHE 20 -5.435 4.984 -25.573 162 HE2 PHE 20 HE2 PHE 20 -4.042 2.087 -22.771 163 HZ PHE 20 HZ PHE 20 -5.364 4.103 -23.273 164 H GLU 21 H GLU 21 -0.685 1.631 -24.500 165 HA GLU 21 HA GLU 21 -0.758 -1.131 -23.999 166 1HB GLU 21 1HB GLU 21 1.508 -0.571 -25.349 167 2HB GLU 21 2HB GLU 21 2.062 -0.263 -23.709 168 1HG GLU 21 1HG GLU 21 1.814 -2.458 -23.067 169 2HG GLU 21 2HG GLU 21 0.621 -2.800 -24.319 170 H THR 22 H THR 22 -1.925 -0.466 -22.221 171 HA THR 22 HA THR 22 -0.749 1.367 -20.308 172 HB THR 22 HB THR 22 -3.166 1.448 -20.779 173 HG1 THR 22 HG1 THR 22 -3.779 1.047 -18.425 174 1HG2 THR 22 1HG2 THR 22 -3.331 -1.123 -21.011 175 2HG2 THR 22 2HG2 THR 22 -4.677 -0.226 -20.310 176 3HG2 THR 22 3HG2 THR 22 -3.554 -1.091 -19.263 177 H LYS 23 H LYS 23 -1.507 0.402 -17.898 178 HA LYS 23 HA LYS 23 0.293 -1.883 -17.576 179 1HB LYS 23 1HB LYS 23 0.024 -1.251 -15.078 180 2HB LYS 23 2HB LYS 23 1.006 -0.223 -16.109 181 1HG LYS 23 1HG LYS 23 -0.188 1.392 -15.084 182 2HG LYS 23 2HG LYS 23 -1.329 1.040 -16.378 183 1HD LYS 23 1HD LYS 23 -1.966 -0.807 -14.419 184 2HD LYS 23 2HD LYS 23 -1.588 0.658 -13.511 185 1HE LYS 23 1HE LYS 23 -3.285 1.015 -15.897 186 2HE LYS 23 2HE LYS 23 -4.013 0.125 -14.560 187 1HZ LYS 23 1HZ LYS 23 -2.859 2.858 -14.455 188 2HZ LYS 23 2HZ LYS 23 -3.396 2.001 -13.100 189 3HZ LYS 23 3HZ LYS 23 -4.492 2.440 -14.311 190 H ARG 24 H ARG 24 -0.522 -3.839 -17.316 191 HA ARG 24 HA ARG 24 -3.345 -4.209 -16.862 192 1HB ARG 24 1HB ARG 24 -1.146 -6.271 -17.108 193 2HB ARG 24 2HB ARG 24 -2.874 -6.585 -17.182 194 1HG ARG 24 1HG ARG 24 -2.639 -6.430 -19.386 195 2HG ARG 24 2HG ARG 24 -2.538 -4.688 -19.127 196 1HD ARG 24 1HD ARG 24 0.008 -5.269 -18.695 197 2HD ARG 24 2HD ARG 24 -0.386 -6.657 -19.708 198 HE ARG 24 HE ARG 24 0.019 -4.004 -20.584 199 1HH1 ARG 24 1HH1 ARG 24 -2.001 -6.791 -21.155 200 2HH1 ARG 24 2HH1 ARG 24 -2.354 -6.358 -22.793 201 1HH2 ARG 24 1HH2 ARG 24 -0.447 -3.428 -22.742 202 2HH2 ARG 24 2HH2 ARG 24 -1.471 -4.448 -23.695 203 H PHE 25 H PHE 25 -2.220 -2.956 -14.665 204 HA PHE 25 HA PHE 25 -1.883 -5.013 -12.623 205 1HB PHE 25 1HB PHE 25 -1.125 -2.183 -12.910 206 2HB PHE 25 2HB PHE 25 -1.691 -2.625 -11.302 207 HD1 PHE 25 HD1 PHE 25 -0.631 -4.806 -10.315 208 HD2 PHE 25 HD2 PHE 25 1.095 -2.480 -13.432 209 HE1 PHE 25 HE1 PHE 25 1.578 -5.756 -9.795 210 HE2 PHE 25 HE2 PHE 25 3.307 -3.427 -12.917 211 HZ PHE 25 HZ PHE 25 3.550 -5.068 -11.098 212 H GLU 26 H GLU 26 -3.694 -5.775 -11.755 213 HA GLU 26 HA GLU 26 -5.699 -3.882 -10.805 214 1HB GLU 26 1HB GLU 26 -6.390 -4.649 -13.084 215 2HB GLU 26 2HB GLU 26 -6.453 -6.292 -12.465 216 1HG GLU 26 1HG GLU 26 -7.988 -4.445 -10.840 217 2HG GLU 26 2HG GLU 26 -8.519 -4.464 -12.522 218 H VAL 27 H VAL 27 -6.284 -4.353 -8.799 219 HA VAL 27 HA VAL 27 -6.404 -7.112 -7.872 220 HB VAL 27 HB VAL 27 -4.701 -5.056 -6.448 221 1HG1 VAL 27 1HG1 VAL 27 -4.869 -7.966 -5.756 222 2HG1 VAL 27 2HG1 VAL 27 -6.038 -6.814 -5.110 223 3HG1 VAL 27 3HG1 VAL 27 -4.322 -6.612 -4.770 224 1HG2 VAL 27 1HG2 VAL 27 -3.034 -7.121 -6.962 225 2HG2 VAL 27 2HG2 VAL 27 -3.170 -5.683 -7.974 226 3HG2 VAL 27 3HG2 VAL 27 -4.046 -7.152 -8.404 227 HA PRO 28 HA PRO 28 -9.931 -4.463 -6.432 228 1HB PRO 28 1HB PRO 28 -11.043 -7.220 -6.273 229 2HB PRO 28 2HB PRO 28 -11.774 -5.747 -6.922 230 1HG PRO 28 1HG PRO 28 -10.859 -7.634 -8.559 231 2HG PRO 28 2HG PRO 28 -10.637 -5.916 -8.940 232 1HD PRO 28 1HD PRO 28 -8.665 -7.892 -7.874 233 2HD PRO 28 2HD PRO 28 -8.427 -6.582 -9.048 234 H LYS 29 H LYS 29 -10.823 -4.277 -4.359 235 HA LYS 29 HA LYS 29 -10.841 -4.383 -2.088 236 1HB LYS 29 1HB LYS 29 -10.327 -7.280 -2.742 237 2HB LYS 29 2HB LYS 29 -10.534 -6.710 -1.092 238 1HG LYS 29 1HG LYS 29 -12.642 -5.832 -2.910 239 2HG LYS 29 2HG LYS 29 -12.529 -7.583 -2.734 240 1HD LYS 29 1HD LYS 29 -12.404 -5.937 -0.265 241 2HD LYS 29 2HD LYS 29 -13.965 -6.080 -1.075 242 1HE LYS 29 1HE LYS 29 -12.236 -8.289 0.017 243 2HE LYS 29 2HE LYS 29 -13.853 -7.818 0.543 244 1HZ LYS 29 1HZ LYS 29 -14.545 -9.430 -0.809 245 2HZ LYS 29 2HZ LYS 29 -13.062 -9.541 -1.615 246 3HZ LYS 29 3HZ LYS 29 -14.195 -8.377 -2.087 247 H ALA 30 H ALA 30 -9.031 -3.026 -1.848 248 HA ALA 30 HA ALA 30 -6.578 -4.438 -1.027 249 1HB ALA 30 1HB ALA 30 -5.379 -2.308 -1.780 250 2HB ALA 30 2HB ALA 30 -6.857 -1.938 -2.666 251 3HB ALA 30 3HB ALA 30 -5.952 -3.406 -3.034 252 H TYR 31 H TYR 31 -8.378 -1.388 -0.739 253 HA TYR 31 HA TYR 31 -7.124 -0.288 1.447 254 1HB TYR 31 1HB TYR 31 -9.250 0.893 1.891 255 2HB TYR 31 2HB TYR 31 -8.819 0.912 0.185 256 HD1 TYR 31 HD1 TYR 31 -10.003 -0.708 -1.375 257 HD2 TYR 31 HD2 TYR 31 -11.313 0.021 2.608 258 HE1 TYR 31 HE1 TYR 31 -12.214 -1.618 -1.942 259 HE2 TYR 31 HE2 TYR 31 -13.530 -0.887 2.049 260 HH TYR 31 HH TYR 31 -14.822 -1.098 -0.578 261 H SER 32 H SER 32 -7.366 -0.390 3.667 262 HA SER 32 HA SER 32 -7.895 -2.920 4.783 263 1HB SER 32 1HB SER 32 -7.707 -0.241 6.186 264 2HB SER 32 2HB SER 32 -7.567 -1.820 6.956 265 HG SER 32 HG SER 32 -5.668 -2.173 5.856 266 H VAL 33 H VAL 33 -9.339 -2.757 6.997 267 HA VAL 33 HA VAL 33 -12.007 -1.825 6.166 268 HB VAL 33 HB VAL 33 -12.181 -4.088 7.957 269 1HG1 VAL 33 1HG1 VAL 33 -13.791 -4.861 6.360 270 2HG1 VAL 33 2HG1 VAL 33 -13.161 -3.770 5.126 271 3HG1 VAL 33 3HG1 VAL 33 -13.980 -3.118 6.545 272 1HG2 VAL 33 1HG2 VAL 33 -10.055 -4.715 6.827 273 2HG2 VAL 33 2HG2 VAL 33 -10.916 -4.687 5.288 274 3HG2 VAL 33 3HG2 VAL 33 -11.378 -5.844 6.537 275 H ILE 34 H ILE 34 -13.277 -0.913 7.722 276 HA ILE 34 HA ILE 34 -12.039 -0.593 10.375 277 HB ILE 34 HB ILE 34 -13.785 1.409 8.950 278 1HG1 ILE 34 1HG1 ILE 34 -11.383 2.569 8.995 279 2HG1 ILE 34 2HG1 ILE 34 -10.857 0.900 8.921 280 1HG2 ILE 34 1HG2 ILE 34 -13.977 2.052 11.127 281 2HG2 ILE 34 2HG2 ILE 34 -12.451 2.848 10.746 282 3HG2 ILE 34 3HG2 ILE 34 -12.451 1.304 11.598 283 1HD1 ILE 34 1HD1 ILE 34 -11.117 2.174 6.742 284 2HD1 ILE 34 2HD1 ILE 34 -12.854 2.001 6.987 285 3HD1 ILE 34 3HD1 ILE 34 -11.835 0.568 6.838 286 H GLN 35 H GLN 35 -13.194 -1.170 12.081 287 HA GLN 35 HA GLN 35 -16.108 -1.299 11.895 288 1HB GLN 35 1HB GLN 35 -14.263 -3.589 12.214 289 2HB GLN 35 2HB GLN 35 -15.653 -3.572 13.291 290 1HG GLN 35 1HG GLN 35 -16.618 -2.953 10.723 291 2HG GLN 35 2HG GLN 35 -15.506 -4.308 10.536 292 1HE2 GLN 35 1HE2 GLN 35 -18.187 -4.576 10.017 293 2HE2 GLN 35 2HE2 GLN 35 -18.905 -5.604 11.205 294 H GLY 36 H GLY 36 -17.053 -0.483 13.650 295 1HA GLY 36 1HA GLY 36 -17.363 0.279 15.796 296 2HA GLY 36 2HA GLY 36 -16.113 -0.851 16.296 297 H ASN 37 H ASN 37 -13.866 -0.167 16.020 298 HA ASN 37 HA ASN 37 -13.257 2.586 15.536 299 1HB ASN 37 1HB ASN 37 -13.589 1.592 18.332 300 2HB ASN 37 2HB ASN 37 -12.280 2.722 18.002 301 1HD2 ASN 37 1HD2 ASN 37 -13.210 4.505 16.336 302 2HD2 ASN 37 2HD2 ASN 37 -14.610 5.309 16.948 303 H ARG 38 H ARG 38 -12.398 -0.076 14.702 304 HA ARG 38 HA ARG 38 -9.531 0.240 15.232 305 1HB ARG 38 1HB ARG 38 -9.300 -2.229 15.455 306 2HB ARG 38 2HB ARG 38 -10.222 -1.507 16.758 307 1HG ARG 38 1HG ARG 38 -12.029 -2.256 14.707 308 2HG ARG 38 2HG ARG 38 -10.954 -3.618 15.036 309 1HD ARG 38 1HD ARG 38 -11.456 -3.371 17.447 310 2HD ARG 38 2HD ARG 38 -12.614 -2.104 17.048 311 HE ARG 38 HE ARG 38 -13.623 -4.015 15.599 312 1HH1 ARG 38 1HH1 ARG 38 -12.239 -4.320 18.795 313 2HH1 ARG 38 2HH1 ARG 38 -13.214 -5.685 19.217 314 1HH2 ARG 38 1HH2 ARG 38 -14.902 -5.804 16.160 315 2HH2 ARG 38 2HH2 ARG 38 -14.725 -6.528 17.723 316 H THR 39 H THR 39 -8.160 -0.727 13.608 317 HA THR 39 HA THR 39 -9.546 -1.009 11.031 318 HB THR 39 HB THR 39 -7.411 0.641 11.750 319 HG1 THR 39 HG1 THR 39 -8.080 -0.154 9.119 320 1HG2 THR 39 1HG2 THR 39 -5.497 0.034 10.597 321 2HG2 THR 39 2HG2 THR 39 -6.315 -1.253 9.713 322 3HG2 THR 39 3HG2 THR 39 -5.955 -1.450 11.424 323 H PHE 40 H PHE 40 -9.696 -2.961 10.225 324 HA PHE 40 HA PHE 40 -8.084 -5.118 11.310 325 1HB PHE 40 1HB PHE 40 -10.610 -4.879 9.788 326 2HB PHE 40 2HB PHE 40 -9.658 -6.327 9.478 327 HD1 PHE 40 HD1 PHE 40 -9.671 -8.109 10.969 328 HD2 PHE 40 HD2 PHE 40 -11.260 -4.351 12.165 329 HE1 PHE 40 HE1 PHE 40 -10.580 -9.148 13.003 330 HE2 PHE 40 HE2 PHE 40 -12.173 -5.379 14.205 331 HZ PHE 40 HZ PHE 40 -11.833 -7.782 14.626 332 H ILE 41 H ILE 41 -6.041 -4.435 10.345 333 HA ILE 41 HA ILE 41 -5.778 -4.336 7.511 334 HB ILE 41 HB ILE 41 -4.005 -3.968 9.784 335 1HG1 ILE 41 1HG1 ILE 41 -3.489 -3.133 6.951 336 2HG1 ILE 41 2HG1 ILE 41 -4.818 -2.415 7.862 337 1HG2 ILE 41 1HG2 ILE 41 -3.096 -6.140 8.640 338 2HG2 ILE 41 2HG2 ILE 41 -1.992 -4.843 9.062 339 3HG2 ILE 41 3HG2 ILE 41 -2.544 -5.022 7.398 340 1HD1 ILE 41 1HD1 ILE 41 -1.919 -2.368 8.671 341 2HD1 ILE 41 2HD1 ILE 41 -3.255 -1.617 9.543 342 3HD1 ILE 41 3HD1 ILE 41 -2.811 -1.035 7.939 343 H GLN 42 H GLN 42 -6.152 -6.014 6.292 344 HA GLN 42 HA GLN 42 -5.357 -8.693 7.199 345 1HB GLN 42 1HB GLN 42 -7.445 -7.659 5.319 346 2HB GLN 42 2HB GLN 42 -6.827 -9.290 5.101 347 1HG GLN 42 1HG GLN 42 -7.381 -9.204 7.785 348 2HG GLN 42 2HG GLN 42 -8.675 -8.236 7.081 349 1HE2 GLN 42 1HE2 GLN 42 -7.968 -11.224 8.057 350 2HE2 GLN 42 2HE2 GLN 42 -8.964 -12.155 7.000 351 H ASN 43 H ASN 43 -5.025 -6.331 4.650 352 HA ASN 43 HA ASN 43 -3.044 -8.042 3.306 353 1HB ASN 43 1HB ASN 43 -4.577 -5.672 2.211 354 2HB ASN 43 2HB ASN 43 -3.432 -6.662 1.309 355 1HD2 ASN 43 1HD2 ASN 43 -5.477 -6.736 -0.038 356 2HD2 ASN 43 2HD2 ASN 43 -6.550 -8.055 0.271 357 H PHE 44 H PHE 44 -2.104 -6.890 5.542 358 HA PHE 44 HA PHE 44 -1.168 -4.348 5.623 359 1HB PHE 44 1HB PHE 44 0.722 -5.173 6.946 360 2HB PHE 44 2HB PHE 44 -0.758 -6.014 7.390 361 HD1 PHE 44 HD1 PHE 44 -1.149 -8.255 5.945 362 HD2 PHE 44 HD2 PHE 44 2.617 -6.436 6.734 363 HE1 PHE 44 HE1 PHE 44 -0.034 -10.407 5.552 364 HE2 PHE 44 HE2 PHE 44 3.739 -8.591 6.343 365 HZ PHE 44 HZ PHE 44 2.412 -10.579 5.751 366 H ARG 45 H ARG 45 0.225 -7.027 3.761 367 HA ARG 45 HA ARG 45 2.471 -5.581 2.820 368 1HB ARG 45 1HB ARG 45 2.238 -8.071 2.758 369 2HB ARG 45 2HB ARG 45 1.084 -7.883 1.444 370 1HG ARG 45 1HG ARG 45 3.090 -8.353 0.369 371 2HG ARG 45 2HG ARG 45 2.942 -6.599 0.245 372 1HD ARG 45 1HD ARG 45 4.606 -6.212 1.790 373 2HD ARG 45 2HD ARG 45 4.398 -7.783 2.563 374 HE ARG 45 HE ARG 45 6.189 -7.165 0.471 375 1HH1 ARG 45 1HH1 ARG 45 4.030 -9.683 1.550 376 2HH1 ARG 45 2HH1 ARG 45 4.921 -10.952 0.779 377 1HH2 ARG 45 1HH2 ARG 45 7.363 -8.829 -0.546 378 2HH2 ARG 45 2HH2 ARG 45 6.816 -10.467 -0.411 379 H GLU 46 H GLU 46 -0.658 -6.327 1.275 380 HA GLU 46 HA GLU 46 -0.135 -4.757 -1.033 381 1HB GLU 46 1HB GLU 46 -2.043 -6.611 -0.324 382 2HB GLU 46 2HB GLU 46 -2.961 -5.113 -0.361 383 1HG GLU 46 1HG GLU 46 -2.479 -4.740 -2.623 384 2HG GLU 46 2HG GLU 46 -1.178 -5.932 -2.626 385 H VAL 47 H VAL 47 -2.371 -4.185 1.698 386 HA VAL 47 HA VAL 47 -3.129 -1.613 1.027 387 HB VAL 47 HB VAL 47 -2.681 -2.549 3.862 388 1HG1 VAL 47 1HG1 VAL 47 -4.811 -1.042 4.071 389 2HG1 VAL 47 2HG1 VAL 47 -4.203 -0.330 2.580 390 3HG1 VAL 47 3HG1 VAL 47 -3.204 -0.317 4.033 391 1HG2 VAL 47 1HG2 VAL 47 -5.399 -2.799 2.990 392 2HG2 VAL 47 2HG2 VAL 47 -4.325 -4.030 3.653 393 3HG2 VAL 47 3HG2 VAL 47 -4.346 -3.721 1.917 394 H ALA 48 H ALA 48 -0.191 -2.715 2.653 395 HA ALA 48 HA ALA 48 0.698 -0.231 3.550 396 1HB ALA 48 1HB ALA 48 2.928 -1.193 3.658 397 2HB ALA 48 2HB ALA 48 2.372 -2.576 2.716 398 3HB ALA 48 3HB ALA 48 1.713 -2.278 4.325 399 H ASP 49 H ASP 49 1.796 -1.983 0.688 400 HA ASP 49 HA ASP 49 3.362 -0.066 -0.476 401 1HB ASP 49 1HB ASP 49 2.744 -2.478 -1.269 402 2HB ASP 49 2HB ASP 49 1.521 -1.652 -2.231 403 H ALA 50 H ALA 50 -0.041 -0.566 -1.490 404 HA ALA 50 HA ALA 50 -0.338 1.647 -3.049 405 1HB ALA 50 1HB ALA 50 -2.738 1.549 -2.559 406 2HB ALA 50 2HB ALA 50 -2.409 0.456 -1.216 407 3HB ALA 50 3HB ALA 50 -2.050 -0.042 -2.868 408 H LEU 51 H LEU 51 -1.219 1.619 0.437 409 HA LEU 51 HA LEU 51 -1.669 4.389 0.529 410 1HB LEU 51 1HB LEU 51 -2.731 3.321 2.262 411 2HB LEU 51 2HB LEU 51 -1.381 2.247 2.571 412 HG LEU 51 HG LEU 51 -0.156 4.086 3.631 413 1HD1 LEU 51 1HD1 LEU 51 -0.780 6.230 3.577 414 2HD1 LEU 51 2HD1 LEU 51 -2.485 5.844 3.811 415 3HD1 LEU 51 3HD1 LEU 51 -1.761 5.708 2.216 416 1HD2 LEU 51 1HD2 LEU 51 -2.418 2.780 4.683 417 2HD2 LEU 51 2HD2 LEU 51 -2.513 4.454 5.230 418 3HD2 LEU 51 3HD2 LEU 51 -1.074 3.498 5.570 419 H ASN 52 H ASN 52 1.216 2.681 0.282 420 HA ASN 52 HA ASN 52 2.874 4.851 0.129 421 1HB ASN 52 1HB ASN 52 2.175 4.543 2.804 422 2HB ASN 52 2HB ASN 52 3.760 3.789 2.698 423 1HD2 ASN 52 1HD2 ASN 52 5.520 5.041 2.569 424 2HD2 ASN 52 2HD2 ASN 52 5.498 6.764 2.450 425 H ARG 53 H ARG 53 4.421 4.057 -1.116 426 HA ARG 53 HA ARG 53 4.957 1.404 -1.600 427 1HB ARG 53 1HB ARG 53 6.796 3.786 -1.848 428 2HB ARG 53 2HB ARG 53 7.176 2.195 -2.490 429 1HG ARG 53 1HG ARG 53 4.605 2.857 -3.436 430 2HG ARG 53 2HG ARG 53 5.619 4.285 -3.653 431 1HD ARG 53 1HD ARG 53 5.918 3.077 -5.624 432 2HD ARG 53 2HD ARG 53 7.336 2.678 -4.662 433 HE ARG 53 HE ARG 53 4.989 0.909 -4.916 434 1HH1 ARG 53 1HH1 ARG 53 8.448 1.390 -4.701 435 2HH1 ARG 53 2HH1 ARG 53 8.811 -0.295 -4.839 436 1HH2 ARG 53 1HH2 ARG 53 5.477 -1.304 -5.101 437 2HH2 ARG 53 2HH2 ARG 53 7.130 -1.823 -5.068 438 H ASP 54 H ASP 54 6.407 3.518 0.813 439 HA ASP 54 HA ASP 54 8.331 1.573 1.674 440 1HB ASP 54 1HB ASP 54 7.913 4.331 2.074 441 2HB ASP 54 2HB ASP 54 7.795 3.589 3.663 442 HA PRO 55 HA PRO 55 5.464 -0.669 4.243 443 1HB PRO 55 1HB PRO 55 7.278 -2.222 5.545 444 2HB PRO 55 2HB PRO 55 6.753 -2.529 3.888 445 1HG PRO 55 1HG PRO 55 9.260 -1.252 4.878 446 2HG PRO 55 2HG PRO 55 9.020 -2.344 3.504 447 1HD PRO 55 1HD PRO 55 9.298 0.369 3.269 448 2HD PRO 55 2HD PRO 55 8.430 -0.642 2.099 449 H GLN 56 H GLN 56 8.507 0.184 5.875 450 HA GLN 56 HA GLN 56 7.541 0.324 8.462 451 1HB GLN 56 1HB GLN 56 9.958 0.941 7.146 452 2HB GLN 56 2HB GLN 56 9.532 2.363 8.090 453 1HG GLN 56 1HG GLN 56 9.268 -0.218 9.479 454 2HG GLN 56 2HG GLN 56 10.909 0.267 9.055 455 1HE2 GLN 56 1HE2 GLN 56 11.263 2.720 9.521 456 2HE2 GLN 56 2HE2 GLN 56 10.782 3.228 11.101 457 H HIS 57 H HIS 57 6.983 2.487 5.873 458 HA HIS 57 HA HIS 57 6.444 4.846 7.376 459 1HB HIS 57 1HB HIS 57 6.398 4.097 4.629 460 2HB HIS 57 2HB HIS 57 4.836 4.802 5.015 461 HD2 HIS 57 HD2 HIS 57 8.516 5.991 5.924 462 HE1 HIS 57 HE1 HIS 57 6.252 9.265 4.453 463 HE2 HIS 57 HE2 HIS 57 8.499 8.502 5.301 464 H LEU 58 H LEU 58 4.204 2.620 5.740 465 HA LEU 58 HA LEU 58 1.811 3.500 6.664 466 1HB LEU 58 1HB LEU 58 2.564 1.358 5.258 467 2HB LEU 58 2HB LEU 58 2.207 0.564 6.781 468 HG LEU 58 HG LEU 58 0.006 2.180 6.396 469 1HD1 LEU 58 1HD1 LEU 58 0.441 0.848 3.772 470 2HD1 LEU 58 2HD1 LEU 58 1.031 2.476 4.039 471 3HD1 LEU 58 3HD1 LEU 58 -0.678 2.107 4.203 472 1HD2 LEU 58 1HD2 LEU 58 -0.832 0.212 6.977 473 2HD2 LEU 58 2HD2 LEU 58 0.648 -0.616 6.492 474 3HD2 LEU 58 3HD2 LEU 58 -0.631 -0.327 5.311 475 H LEU 59 H LEU 59 4.045 1.391 8.406 476 HA LEU 59 HA LEU 59 2.395 0.905 10.632 477 1HB LEU 59 1HB LEU 59 4.716 -0.110 9.827 478 2HB LEU 59 2HB LEU 59 5.345 1.058 10.974 479 HG LEU 59 HG LEU 59 3.596 -0.041 12.598 480 1HD1 LEU 59 1HD1 LEU 59 4.204 -2.527 11.122 481 2HD1 LEU 59 2HD1 LEU 59 2.939 -1.497 10.455 482 3HD1 LEU 59 3HD1 LEU 59 2.803 -2.101 12.106 483 1HD2 LEU 59 1HD2 LEU 59 5.624 -0.385 13.470 484 2HD2 LEU 59 2HD2 LEU 59 6.359 -0.652 11.889 485 3HD2 LEU 59 3HD2 LEU 59 5.537 -1.976 12.715 486 H LYS 60 H LYS 60 5.135 3.159 10.296 487 HA LYS 60 HA LYS 60 4.884 4.443 12.738 488 1HB LYS 60 1HB LYS 60 6.795 4.753 11.225 489 2HB LYS 60 2HB LYS 60 5.766 5.627 10.098 490 1HG LYS 60 1HG LYS 60 5.591 7.476 11.500 491 2HG LYS 60 2HG LYS 60 6.114 6.566 12.920 492 1HD LYS 60 1HD LYS 60 8.286 6.920 12.480 493 2HD LYS 60 2HD LYS 60 8.082 6.594 10.759 494 1HE LYS 60 1HE LYS 60 6.882 9.109 11.668 495 2HE LYS 60 2HE LYS 60 8.635 9.036 11.840 496 1HZ LYS 60 1HZ LYS 60 7.985 8.012 9.327 497 2HZ LYS 60 2HZ LYS 60 8.808 9.445 9.686 498 3HZ LYS 60 3HZ LYS 60 7.126 9.458 9.512 499 H PHE 61 H PHE 61 3.155 4.953 9.730 500 HA PHE 61 HA PHE 61 1.873 7.366 10.494 501 1HB PHE 61 1HB PHE 61 1.765 5.492 8.244 502 2HB PHE 61 2HB PHE 61 0.217 6.244 8.606 503 HD1 PHE 61 HD1 PHE 61 -0.048 8.674 8.467 504 HD2 PHE 61 HD2 PHE 61 3.582 6.754 7.355 505 HE1 PHE 61 HE1 PHE 61 0.663 10.712 7.289 506 HE2 PHE 61 HE2 PHE 61 4.301 8.788 6.173 507 HZ PHE 61 HZ PHE 61 2.841 10.771 6.139 508 H LEU 62 H LEU 62 0.904 3.955 10.615 509 HA LEU 62 HA LEU 62 -1.730 4.314 11.450 510 1HB LEU 62 1HB LEU 62 0.266 2.113 11.909 511 2HB LEU 62 2HB LEU 62 -1.350 2.028 12.585 512 HG LEU 62 HG LEU 62 -1.147 2.579 9.676 513 1HD1 LEU 62 1HD1 LEU 62 -1.185 -0.150 9.707 514 2HD1 LEU 62 2HD1 LEU 62 0.017 0.216 10.944 515 3HD1 LEU 62 3HD1 LEU 62 0.216 0.845 9.308 516 1HD2 LEU 62 1HD2 LEU 62 -3.332 2.425 10.349 517 2HD2 LEU 62 2HD2 LEU 62 -2.991 1.217 11.577 518 3HD2 LEU 62 3HD2 LEU 62 -3.022 0.758 9.875 519 H LEU 63 H LEU 63 1.206 3.871 13.437 520 HA LEU 63 HA LEU 63 -0.156 4.194 15.907 521 1HB LEU 63 1HB LEU 63 2.732 4.278 15.107 522 2HB LEU 63 2HB LEU 63 2.232 4.623 16.753 523 HG LEU 63 HG LEU 63 1.098 2.140 15.703 524 1HD1 LEU 63 1HD1 LEU 63 3.712 2.585 14.935 525 2HD1 LEU 63 2HD1 LEU 63 2.908 1.022 15.062 526 3HD1 LEU 63 3HD1 LEU 63 3.863 1.634 16.412 527 1HD2 LEU 63 1HD2 LEU 63 2.816 2.033 18.052 528 2HD2 LEU 63 2HD2 LEU 63 1.115 1.604 17.868 529 3HD2 LEU 63 3HD2 LEU 63 1.576 3.281 18.157 530 H ARG 64 H ARG 64 1.331 6.403 13.664 531 HA ARG 64 HA ARG 64 1.670 8.639 15.301 532 1HB ARG 64 1HB ARG 64 1.343 8.200 12.387 533 2HB ARG 64 2HB ARG 64 1.048 9.833 12.972 534 1HG ARG 64 1HG ARG 64 3.381 9.224 14.230 535 2HG ARG 64 2HG ARG 64 3.558 8.347 12.713 536 1HD ARG 64 1HD ARG 64 4.257 10.277 11.855 537 2HD ARG 64 2HD ARG 64 2.567 10.776 11.899 538 HE ARG 64 HE ARG 64 3.268 11.535 14.297 539 1HH1 ARG 64 1HH1 ARG 64 5.151 11.801 11.362 540 2HH1 ARG 64 2HH1 ARG 64 6.026 13.190 11.908 541 1HH2 ARG 64 1HH2 ARG 64 4.421 13.364 15.005 542 2HH2 ARG 64 2HH2 ARG 64 5.614 14.077 13.971 543 H GLU 65 H GLU 65 -1.207 7.540 13.540 544 HA GLU 65 HA GLU 65 -2.746 9.720 14.762 545 1HB GLU 65 1HB GLU 65 -2.865 8.350 12.235 546 2HB GLU 65 2HB GLU 65 -4.417 8.232 13.051 547 1HG GLU 65 1HG GLU 65 -3.750 10.869 13.398 548 2HG GLU 65 2HG GLU 65 -3.124 10.515 11.789 549 H LEU 66 H LEU 66 -2.114 6.398 15.111 550 HA LEU 66 HA LEU 66 -4.577 5.457 16.105 551 1HB LEU 66 1HB LEU 66 -1.800 4.562 16.027 552 2HB LEU 66 2HB LEU 66 -2.640 4.027 17.462 553 HG LEU 66 HG LEU 66 -4.131 2.708 16.254 554 1HD1 LEU 66 1HD1 LEU 66 -5.116 3.515 14.440 555 2HD1 LEU 66 2HD1 LEU 66 -3.664 3.114 13.527 556 3HD1 LEU 66 3HD1 LEU 66 -3.846 4.720 14.227 557 1HD2 LEU 66 1HD2 LEU 66 -2.518 1.684 14.389 558 2HD2 LEU 66 2HD2 LEU 66 -2.293 1.400 16.114 559 3HD2 LEU 66 3HD2 LEU 66 -1.342 2.636 15.292 560 H GLY 67 H GLY 67 -5.381 7.110 17.506 561 1HA GLY 67 1HA GLY 67 -3.914 8.025 19.773 562 2HA GLY 67 2HA GLY 67 -5.636 8.236 19.501 563 H THR 68 H THR 68 -5.125 5.009 19.217 564 HA THR 68 HA THR 68 -5.730 4.552 22.055 565 HB THR 68 HB THR 68 -7.282 2.968 21.491 566 HG1 THR 68 HG1 THR 68 -5.454 2.287 19.595 567 1HG2 THR 68 1HG2 THR 68 -8.312 3.499 19.167 568 2HG2 THR 68 2HG2 THR 68 -7.191 4.859 19.191 569 3HG2 THR 68 3HG2 THR 68 -8.396 4.690 20.465 570 H ALA 69 H ALA 69 -5.168 2.250 22.745 571 HA ALA 69 HA ALA 69 -2.599 1.800 23.143 572 1HB ALA 69 1HB ALA 69 -4.575 -0.370 22.462 573 2HB ALA 69 2HB ALA 69 -4.258 0.319 24.055 574 3HB ALA 69 3HB ALA 69 -3.015 -0.633 23.243 575 H GLY 70 H GLY 70 -4.210 0.666 20.174 576 1HA GLY 70 1HA GLY 70 -3.348 0.218 18.091 577 2HA GLY 70 2HA GLY 70 -1.917 1.115 18.577 578 H ASN 71 H ASN 71 -3.277 -1.971 18.021 579 HA ASN 71 HA ASN 71 -0.695 -3.223 18.201 580 1HB ASN 71 1HB ASN 71 -1.707 -3.230 20.581 581 2HB ASN 71 2HB ASN 71 -2.834 -4.425 19.945 582 1HD2 ASN 71 1HD2 ASN 71 -2.252 -6.361 20.585 583 2HD2 ASN 71 2HD2 ASN 71 -0.642 -6.986 20.614 584 H LEU 72 H LEU 72 -0.846 -5.574 17.593 585 HA LEU 72 HA LEU 72 -2.890 -5.872 15.518 586 1HB LEU 72 1HB LEU 72 -0.575 -7.736 15.895 587 2HB LEU 72 2HB LEU 72 -1.445 -7.349 14.427 588 HG LEU 72 HG LEU 72 0.622 -6.327 14.120 589 1HD1 LEU 72 1HD1 LEU 72 -0.182 -4.351 13.522 590 2HD1 LEU 72 2HD1 LEU 72 -0.269 -3.826 15.203 591 3HD1 LEU 72 3HD1 LEU 72 -1.625 -4.688 14.477 592 1HD2 LEU 72 1HD2 LEU 72 0.799 -4.780 16.597 593 2HD2 LEU 72 2HD2 LEU 72 2.034 -5.703 15.741 594 3HD2 LEU 72 3HD2 LEU 72 0.910 -6.525 16.821 595 H GLU 73 H GLU 73 -4.676 -6.979 16.084 596 HA GLU 73 HA GLU 73 -4.407 -9.141 18.063 597 1HB GLU 73 1HB GLU 73 -7.075 -8.096 17.209 598 2HB GLU 73 2HB GLU 73 -6.602 -8.822 18.733 599 1HG GLU 73 1HG GLU 73 -5.157 -6.651 18.966 600 2HG GLU 73 2HG GLU 73 -6.314 -6.020 17.799 601 H GLY 74 H GLY 74 -5.624 -11.119 17.694 602 1HA GLY 74 1HA GLY 74 -6.305 -12.894 16.403 603 2HA GLY 74 2HA GLY 74 -6.895 -11.710 15.248 604 H GLY 75 H GLY 75 -5.948 -13.990 14.227 605 1HA GLY 75 1HA GLY 75 -3.268 -14.338 13.731 606 2HA GLY 75 2HA GLY 75 -4.529 -14.716 12.568 607 H ARG 76 H ARG 76 -5.341 -11.842 12.472 608 HA ARG 76 HA ARG 76 -3.328 -11.012 10.525 609 1HB ARG 76 1HB ARG 76 -5.885 -9.525 10.990 610 2HB ARG 76 2HB ARG 76 -4.973 -9.733 9.500 611 1HG ARG 76 1HG ARG 76 -6.423 -11.299 8.928 612 2HG ARG 76 2HG ARG 76 -5.763 -12.304 10.216 613 1HD ARG 76 1HD ARG 76 -7.381 -11.368 11.785 614 2HD ARG 76 2HD ARG 76 -8.029 -10.338 10.510 615 HE ARG 76 HE ARG 76 -8.082 -13.219 10.062 616 1HH1 ARG 76 1HH1 ARG 76 -9.833 -10.328 10.959 617 2HH1 ARG 76 2HH1 ARG 76 -11.385 -11.021 10.632 618 1HH2 ARG 76 1HH2 ARG 76 -10.127 -14.124 9.637 619 2HH2 ARG 76 2HH2 ARG 76 -11.553 -13.172 9.884 620 H ALA 77 H ALA 77 -4.163 -8.177 10.705 621 HA ALA 77 HA ALA 77 -2.781 -7.485 13.210 622 1HB ALA 77 1HB ALA 77 -2.013 -5.416 11.916 623 2HB ALA 77 2HB ALA 77 -2.486 -6.307 10.471 624 3HB ALA 77 3HB ALA 77 -1.241 -6.955 11.534 625 H ILE 78 H ILE 78 -4.932 -7.432 14.136 626 HA ILE 78 HA ILE 78 -6.744 -5.340 13.282 627 HB ILE 78 HB ILE 78 -6.941 -7.002 15.788 628 1HG1 ILE 78 1HG1 ILE 78 -8.325 -7.674 13.207 629 2HG1 ILE 78 2HG1 ILE 78 -6.718 -8.296 13.556 630 1HG2 ILE 78 1HG2 ILE 78 -8.384 -5.027 15.677 631 2HG2 ILE 78 2HG2 ILE 78 -9.318 -6.523 15.634 632 3HG2 ILE 78 3HG2 ILE 78 -9.051 -5.607 14.151 633 1HD1 ILE 78 1HD1 ILE 78 -9.295 -9.173 14.527 634 2HD1 ILE 78 2HD1 ILE 78 -8.159 -8.874 15.840 635 3HD1 ILE 78 3HD1 ILE 78 -7.737 -9.997 14.548 636 H LEU 79 H LEU 79 -5.714 -3.382 13.640 637 HA LEU 79 HA LEU 79 -4.792 -2.824 16.365 638 1HB LEU 79 1HB LEU 79 -3.725 -0.844 15.431 639 2HB LEU 79 2HB LEU 79 -3.218 -2.297 14.588 640 HG LEU 79 HG LEU 79 -5.282 -1.532 13.024 641 1HD1 LEU 79 1HD1 LEU 79 -5.190 0.596 14.644 642 2HD1 LEU 79 2HD1 LEU 79 -5.663 0.692 12.948 643 3HD1 LEU 79 3HD1 LEU 79 -4.018 1.102 13.428 644 1HD2 LEU 79 1HD2 LEU 79 -2.553 -0.341 12.655 645 2HD2 LEU 79 2HD2 LEU 79 -3.673 -0.939 11.429 646 3HD2 LEU 79 3HD2 LEU 79 -2.842 -2.073 12.496 647 H GLN 80 H GLN 80 -5.182 -0.401 16.979 648 HA GLN 80 HA GLN 80 -7.909 0.388 16.265 649 1HB GLN 80 1HB GLN 80 -7.274 -0.920 18.652 650 2HB GLN 80 2HB GLN 80 -7.425 0.771 19.096 651 1HG GLN 80 1HG GLN 80 -9.575 0.103 17.377 652 2HG GLN 80 2HG GLN 80 -9.466 -1.118 18.640 653 1HE2 GLN 80 1HE2 GLN 80 -10.065 -0.621 20.674 654 2HE2 GLN 80 2HE2 GLN 80 -10.690 0.915 21.157 655 H GLY 81 H GLY 81 -8.167 2.525 16.025 656 1HA GLY 81 1HA GLY 81 -6.787 4.515 17.462 657 2HA GLY 81 2HA GLY 81 -5.967 4.250 15.937 658 H LYS 82 H LYS 82 -6.701 5.285 14.172 659 HA LYS 82 HA LYS 82 -9.469 6.109 13.986 660 1HB LYS 82 1HB LYS 82 -8.353 7.919 15.301 661 2HB LYS 82 2HB LYS 82 -7.303 8.211 13.921 662 1HG LYS 82 1HG LYS 82 -9.102 8.957 12.584 663 2HG LYS 82 2HG LYS 82 -10.297 8.355 13.733 664 1HD LYS 82 1HD LYS 82 -8.881 10.042 15.307 665 2HD LYS 82 2HD LYS 82 -8.741 10.851 13.746 666 1HE LYS 82 1HE LYS 82 -11.440 9.925 14.223 667 2HE LYS 82 2HE LYS 82 -10.883 10.984 15.518 668 1HZ LYS 82 1HZ LYS 82 -10.998 11.597 12.618 669 2HZ LYS 82 2HZ LYS 82 -10.211 12.581 13.746 670 3HZ LYS 82 3HZ LYS 82 -11.879 12.332 13.862 671 H PHE 83 H PHE 83 -7.335 4.505 12.517 672 HA PHE 83 HA PHE 83 -7.000 5.920 10.027 673 1HB PHE 83 1HB PHE 83 -6.048 3.413 11.205 674 2HB PHE 83 2HB PHE 83 -6.421 3.277 9.490 675 HD1 PHE 83 HD1 PHE 83 -4.305 3.123 8.525 676 HD2 PHE 83 HD2 PHE 83 -5.110 6.230 11.300 677 HE1 PHE 83 HE1 PHE 83 -2.155 4.160 7.960 678 HE2 PHE 83 HE2 PHE 83 -2.955 7.278 10.746 679 HZ PHE 83 HZ PHE 83 -1.480 6.244 9.078 680 H THR 84 H THR 84 -9.664 5.947 10.548 681 HA THR 84 HA THR 84 -11.043 3.763 9.426 682 HB THR 84 HB THR 84 -12.001 5.383 11.071 683 HG1 THR 84 HG1 THR 84 -13.149 4.070 9.247 684 1HG2 THR 84 1HG2 THR 84 -13.062 7.225 9.161 685 2HG2 THR 84 2HG2 THR 84 -11.303 7.312 9.182 686 3HG2 THR 84 3HG2 THR 84 -12.211 7.541 10.674 687 H HIS 85 H HIS 85 -9.710 3.564 7.509 688 HA HIS 85 HA HIS 85 -9.136 3.929 5.324 689 1HB HIS 85 1HB HIS 85 -11.075 4.058 3.830 690 2HB HIS 85 2HB HIS 85 -11.356 2.908 5.129 691 HD2 HIS 85 HD2 HIS 85 -12.882 6.115 3.669 692 HE1 HIS 85 HE1 HIS 85 -15.055 5.157 7.187 693 HE2 HIS 85 HE2 HIS 85 -14.982 6.579 5.107 694 H PHE 86 H PHE 86 -8.665 6.190 6.912 695 HA PHE 86 HA PHE 86 -9.521 8.485 5.337 696 1HB PHE 86 1HB PHE 86 -8.615 8.057 8.055 697 2HB PHE 86 2HB PHE 86 -7.702 9.351 7.284 698 HD1 PHE 86 HD1 PHE 86 -10.381 8.783 9.300 699 HD2 PHE 86 HD2 PHE 86 -9.385 10.882 5.740 700 HE1 PHE 86 HE1 PHE 86 -12.269 10.310 9.683 701 HE2 PHE 86 HE2 PHE 86 -11.266 12.423 6.117 702 HZ PHE 86 HZ PHE 86 -12.712 12.137 8.091 703 H LEU 87 H LEU 87 -6.380 7.744 6.784 704 HA LEU 87 HA LEU 87 -4.984 8.959 4.615 705 1HB LEU 87 1HB LEU 87 -4.388 8.518 7.216 706 2HB LEU 87 2HB LEU 87 -3.499 7.204 6.473 707 HG LEU 87 HG LEU 87 -2.203 9.334 6.893 708 1HD1 LEU 87 1HD1 LEU 87 -1.802 9.119 4.072 709 2HD1 LEU 87 2HD1 LEU 87 -2.126 7.522 4.746 710 3HD1 LEU 87 3HD1 LEU 87 -0.810 8.500 5.392 711 1HD2 LEU 87 1HD2 LEU 87 -3.654 10.364 4.468 712 2HD2 LEU 87 2HD2 LEU 87 -2.493 11.211 5.489 713 3HD2 LEU 87 3HD2 LEU 87 -4.094 10.818 6.115 714 H ILE 88 H ILE 88 -5.471 5.581 5.685 715 HA ILE 88 HA ILE 88 -3.781 4.369 3.823 716 HB ILE 88 HB ILE 88 -6.413 3.152 4.635 717 1HG1 ILE 88 1HG1 ILE 88 -3.838 3.265 6.235 718 2HG1 ILE 88 2HG1 ILE 88 -5.420 3.872 6.717 719 1HG2 ILE 88 1HG2 ILE 88 -4.245 2.281 3.074 720 2HG2 ILE 88 2HG2 ILE 88 -5.652 1.354 3.595 721 3HG2 ILE 88 3HG2 ILE 88 -4.187 1.360 4.577 722 1HD1 ILE 88 1HD1 ILE 88 -4.545 1.010 6.436 723 2HD1 ILE 88 2HD1 ILE 88 -6.236 1.485 6.596 724 3HD1 ILE 88 3HD1 ILE 88 -5.095 1.845 7.887 725 H ASN 89 H ASN 89 -7.317 4.620 3.543 726 HA ASN 89 HA ASN 89 -7.521 3.781 0.919 727 1HB ASN 89 1HB ASN 89 -9.454 3.963 2.372 728 2HB ASN 89 2HB ASN 89 -9.293 5.717 2.414 729 1HD2 ASN 89 1HD2 ASN 89 -9.000 3.508 -0.324 730 2HD2 ASN 89 2HD2 ASN 89 -10.309 4.175 -1.232 731 H GLU 90 H GLU 90 -7.123 7.116 2.097 732 HA GLU 90 HA GLU 90 -7.461 8.491 -0.278 733 1HB GLU 90 1HB GLU 90 -6.323 9.026 2.303 734 2HB GLU 90 2HB GLU 90 -5.305 9.738 1.064 735 1HG GLU 90 1HG GLU 90 -8.212 10.188 0.811 736 2HG GLU 90 2HG GLU 90 -7.389 10.994 2.146 737 H ARG 91 H ARG 91 -4.384 7.352 1.074 738 HA ARG 91 HA ARG 91 -2.826 8.049 -1.159 739 1HB ARG 91 1HB ARG 91 -2.351 7.171 1.388 740 2HB ARG 91 2HB ARG 91 -1.852 5.799 0.418 741 1HG ARG 91 1HG ARG 91 -0.859 8.602 0.019 742 2HG ARG 91 2HG ARG 91 -0.023 7.367 0.960 743 1HD ARG 91 1HD ARG 91 0.713 6.292 -0.872 744 2HD ARG 91 2HD ARG 91 -0.803 6.535 -1.743 745 HE ARG 91 HE ARG 91 0.798 8.913 -1.435 746 1HH1 ARG 91 1HH1 ARG 91 0.192 6.107 -3.413 747 2HH1 ARG 91 2HH1 ARG 91 0.738 6.868 -4.869 748 1HH2 ARG 91 1HH2 ARG 91 1.511 9.912 -3.345 749 2HH2 ARG 91 2HH2 ARG 91 1.486 9.027 -4.833 750 H ILE 92 H ILE 92 -4.318 4.915 -0.228 751 HA ILE 92 HA ILE 92 -3.222 3.352 -2.248 752 HB ILE 92 HB ILE 92 -6.026 3.181 -1.121 753 1HG1 ILE 92 1HG1 ILE 92 -3.651 1.485 -0.374 754 2HG1 ILE 92 2HG1 ILE 92 -4.055 2.963 0.486 755 1HG2 ILE 92 1HG2 ILE 92 -5.653 0.700 -1.822 756 2HG2 ILE 92 2HG2 ILE 92 -4.489 1.392 -2.948 757 3HG2 ILE 92 3HG2 ILE 92 -6.179 1.885 -3.017 758 1HD1 ILE 92 1HD1 ILE 92 -6.345 1.946 0.855 759 2HD1 ILE 92 2HD1 ILE 92 -5.001 1.214 1.725 760 3HD1 ILE 92 3HD1 ILE 92 -5.644 0.430 0.288 761 H GLU 93 H GLU 93 -6.374 4.983 -2.251 762 HA GLU 93 HA GLU 93 -7.040 4.510 -4.918 763 1HB GLU 93 1HB GLU 93 -8.297 5.624 -2.785 764 2HB GLU 93 2HB GLU 93 -7.986 7.056 -3.758 765 1HG GLU 93 1HG GLU 93 -9.023 4.926 -5.389 766 2HG GLU 93 2HG GLU 93 -10.085 5.240 -4.017 767 H ASP 94 H ASP 94 -4.855 6.786 -3.517 768 HA ASP 94 HA ASP 94 -4.830 8.717 -5.574 769 1HB ASP 94 1HB ASP 94 -3.200 8.072 -3.223 770 2HB ASP 94 2HB ASP 94 -2.281 8.791 -4.540 771 H TYR 95 H TYR 95 -2.750 5.883 -4.985 772 HA TYR 95 HA TYR 95 -1.436 6.245 -7.546 773 1HB TYR 95 1HB TYR 95 -0.345 5.400 -5.349 774 2HB TYR 95 2HB TYR 95 -1.083 3.857 -5.757 775 HD1 TYR 95 HD1 TYR 95 -0.629 3.066 -8.252 776 HD2 TYR 95 HD2 TYR 95 1.808 5.798 -6.085 777 HE1 TYR 95 HE1 TYR 95 1.264 2.545 -9.734 778 HE2 TYR 95 HE2 TYR 95 3.706 5.285 -7.561 779 HH TYR 95 HH TYR 95 3.870 4.369 -10.095 780 H VAL 96 H VAL 96 -3.138 3.563 -5.955 781 HA VAL 96 HA VAL 96 -3.432 1.864 -8.075 782 HB VAL 96 HB VAL 96 -5.576 2.357 -6.008 783 1HG1 VAL 96 1HG1 VAL 96 -5.917 0.825 -8.089 784 2HG1 VAL 96 2HG1 VAL 96 -6.404 0.259 -6.492 785 3HG1 VAL 96 3HG1 VAL 96 -4.886 -0.295 -7.198 786 1HG2 VAL 96 1HG2 VAL 96 -4.247 0.312 -4.969 787 2HG2 VAL 96 2HG2 VAL 96 -3.807 1.982 -4.617 788 3HG2 VAL 96 3HG2 VAL 96 -2.905 1.071 -5.825 789 H ASN 97 H ASN 97 -5.588 4.558 -7.196 790 HA ASN 97 HA ASN 97 -6.869 4.255 -9.825 791 1HB ASN 97 1HB ASN 97 -8.176 4.160 -7.518 792 2HB ASN 97 2HB ASN 97 -8.114 5.912 -7.678 793 1HD2 ASN 97 1HD2 ASN 97 -9.907 3.249 -8.328 794 2HD2 ASN 97 2HD2 ASN 97 -10.864 3.850 -9.636 795 H LYS 98 H LYS 98 -4.487 5.466 -9.944 796 HA LYS 98 HA LYS 98 -4.713 8.325 -9.625 797 1HB LYS 98 1HB LYS 98 -2.465 8.421 -10.490 798 2HB LYS 98 2HB LYS 98 -2.564 7.097 -9.336 799 1HG LYS 98 1HG LYS 98 -2.633 5.481 -11.100 800 2HG LYS 98 2HG LYS 98 -2.762 6.752 -12.312 801 1HD LYS 98 1HD LYS 98 -0.440 7.063 -10.575 802 2HD LYS 98 2HD LYS 98 -0.432 5.544 -11.473 803 1HE LYS 98 1HE LYS 98 -0.537 8.350 -12.552 804 2HE LYS 98 2HE LYS 98 0.697 7.122 -12.825 805 1HZ LYS 98 1HZ LYS 98 -0.863 7.471 -14.713 806 2HZ LYS 98 2HZ LYS 98 -2.107 6.854 -13.759 807 3HZ LYS 98 3HZ LYS 98 -0.794 5.873 -14.164 808 H PHE 99 H PHE 99 -5.662 6.098 -11.992 809 HA PHE 99 HA PHE 99 -5.248 7.641 -14.333 810 1HB PHE 99 1HB PHE 99 -6.318 5.093 -13.678 811 2HB PHE 99 2HB PHE 99 -7.542 5.949 -14.612 812 HD1 PHE 99 HD1 PHE 99 -3.823 5.611 -14.729 813 HD2 PHE 99 HD2 PHE 99 -7.516 5.449 -16.836 814 HE1 PHE 99 HE1 PHE 99 -2.612 5.071 -16.801 815 HE2 PHE 99 HE2 PHE 99 -6.313 4.908 -18.912 816 HZ PHE 99 HZ PHE 99 -3.858 4.718 -18.897 817 H VAL 100 H VAL 100 -8.154 7.101 -12.337 818 HA VAL 100 HA VAL 100 -9.646 9.107 -13.764 819 HB VAL 100 HB VAL 100 -10.420 7.859 -11.131 820 1HG1 VAL 100 1HG1 VAL 100 -12.669 8.158 -12.669 821 2HG1 VAL 100 2HG1 VAL 100 -11.717 9.576 -13.105 822 3HG1 VAL 100 3HG1 VAL 100 -12.129 9.276 -11.417 823 1HG2 VAL 100 1HG2 VAL 100 -10.198 5.904 -12.252 824 2HG2 VAL 100 2HG2 VAL 100 -10.292 6.674 -13.835 825 3HG2 VAL 100 3HG2 VAL 100 -11.765 6.372 -12.913 826 H ILE 101 H ILE 101 -7.571 9.051 -11.005 827 HA ILE 101 HA ILE 101 -8.600 11.579 -9.984 828 HB ILE 101 HB ILE 101 -6.433 9.735 -8.983 829 1HG1 ILE 101 1HG1 ILE 101 -9.141 10.539 -7.896 830 2HG1 ILE 101 2HG1 ILE 101 -8.709 8.971 -8.566 831 1HG2 ILE 101 1HG2 ILE 101 -6.408 11.285 -6.979 832 2HG2 ILE 101 2HG2 ILE 101 -7.241 12.460 -7.997 833 3HG2 ILE 101 3HG2 ILE 101 -5.632 11.890 -8.442 834 1HD1 ILE 101 1HD1 ILE 101 -7.252 8.520 -6.722 835 2HD1 ILE 101 2HD1 ILE 101 -8.824 9.021 -6.097 836 3HD1 ILE 101 3HD1 ILE 101 -7.472 10.153 -6.093 837 H CYS 102 H CYS 102 -5.499 10.294 -11.209 838 HA CYS 102 HA CYS 102 -4.463 12.998 -11.473 839 1HB CYS 102 1HB CYS 102 -3.137 10.921 -10.667 840 2HB CYS 102 2HB CYS 102 -3.024 10.521 -12.377 841 H HIS 103 H HIS 103 -6.614 11.508 -13.235 842 HA HIS 103 HA HIS 103 -7.272 11.489 -15.409 843 1HB HIS 103 1HB HIS 103 -5.663 13.966 -15.107 844 2HB HIS 103 2HB HIS 103 -6.054 13.470 -16.751 845 HD2 HIS 103 HD2 HIS 103 -8.492 14.315 -17.583 846 HE1 HIS 103 HE1 HIS 103 -10.157 15.153 -13.770 847 HE2 HIS 103 HE2 HIS 103 -10.458 15.359 -16.263 848 H GLU 104 H GLU 104 -5.607 9.493 -15.090 849 HA GLU 104 HA GLU 104 -3.925 8.190 -15.927 850 1HB GLU 104 1HB GLU 104 -4.039 8.093 -18.516 851 2HB GLU 104 2HB GLU 104 -5.414 7.554 -17.572 852 1HG GLU 104 1HG GLU 104 -6.754 9.046 -18.513 853 2HG GLU 104 2HG GLU 104 -5.624 10.359 -18.228 854 H CYS 105 H CYS 105 -2.283 9.624 -15.040 855 HA CYS 105 HA CYS 105 -1.018 11.583 -16.650 856 1HB CYS 105 1HB CYS 105 -0.924 11.014 -14.024 857 2HB CYS 105 2HB CYS 105 0.568 10.235 -14.537 858 H ASN 106 H ASN 106 -1.049 9.963 -18.557 859 HA ASN 106 HA ASN 106 1.017 7.991 -18.618 860 1HB ASN 106 1HB ASN 106 -0.960 9.087 -20.540 861 2HB ASN 106 2HB ASN 106 0.506 8.407 -21.239 862 1HD2 ASN 106 1HD2 ASN 106 -1.532 7.108 -22.017 863 2HD2 ASN 106 2HD2 ASN 106 -1.793 5.634 -21.152 864 H ARG 107 H ARG 107 1.049 10.109 -21.348 865 HA ARG 107 HA ARG 107 3.748 10.989 -20.604 866 1HB ARG 107 1HB ARG 107 3.978 11.389 -23.108 867 2HB ARG 107 2HB ARG 107 3.903 9.715 -22.573 868 1HG ARG 107 1HG ARG 107 2.207 9.357 -23.948 869 2HG ARG 107 2HG ARG 107 1.251 10.561 -23.086 870 1HD ARG 107 1HD ARG 107 2.968 12.059 -24.660 871 2HD ARG 107 2HD ARG 107 2.507 10.709 -25.693 872 HE ARG 107 HE ARG 107 0.144 11.351 -25.104 873 1HH1 ARG 107 1HH1 ARG 107 2.729 13.708 -25.145 874 2HH1 ARG 107 2HH1 ARG 107 1.668 15.040 -25.445 875 1HH2 ARG 107 1HH2 ARG 107 -1.239 13.108 -25.501 876 2HH2 ARG 107 2HH2 ARG 107 -0.579 14.704 -25.647 877 HA PRO 108 HA PRO 108 0.816 14.775 -20.698 878 1HB PRO 108 1HB PRO 108 2.518 15.412 -18.351 879 2HB PRO 108 2HB PRO 108 0.781 15.627 -18.572 880 1HG PRO 108 1HG PRO 108 1.770 13.662 -17.038 881 2HG PRO 108 2HG PRO 108 0.299 13.451 -17.999 882 1HD PRO 108 1HD PRO 108 3.033 12.385 -18.466 883 2HD PRO 108 2HD PRO 108 1.455 11.699 -18.888 884 H ASP 109 H ASP 109 1.435 16.833 -21.380 885 HA ASP 109 HA ASP 109 4.177 17.036 -22.357 886 1HB ASP 109 1HB ASP 109 3.278 19.036 -23.585 887 2HB ASP 109 2HB ASP 109 2.464 17.525 -23.981 888 H THR 110 H THR 110 3.720 17.281 -19.543 889 HA THR 110 HA THR 110 4.522 20.074 -19.116 890 HB THR 110 HB THR 110 3.572 19.429 -16.689 891 HG1 THR 110 HG1 THR 110 1.928 18.049 -16.785 892 1HG2 THR 110 1HG2 THR 110 1.255 20.150 -18.114 893 2HG2 THR 110 2HG2 THR 110 2.618 20.955 -18.891 894 3HG2 THR 110 3HG2 THR 110 2.327 21.184 -17.168 895 H ARG 111 H ARG 111 5.600 20.203 -16.786 896 HA ARG 111 HA ARG 111 7.884 18.425 -16.971 897 1HB ARG 111 1HB ARG 111 7.375 20.782 -15.149 898 2HB ARG 111 2HB ARG 111 8.905 19.929 -15.316 899 1HG ARG 111 1HG ARG 111 8.084 20.693 -17.905 900 2HG ARG 111 2HG ARG 111 7.887 22.096 -16.852 901 1HD ARG 111 1HD ARG 111 10.103 22.162 -17.734 902 2HD ARG 111 2HD ARG 111 10.220 21.698 -16.035 903 HE ARG 111 HE ARG 111 11.187 19.756 -16.721 904 1HH1 ARG 111 1HH1 ARG 111 9.251 21.006 -19.336 905 2HH1 ARG 111 2HH1 ARG 111 9.692 19.747 -20.439 906 1HH2 ARG 111 1HH2 ARG 111 11.776 18.089 -18.170 907 2HH2 ARG 111 2HH2 ARG 111 11.129 18.089 -19.776 908 H ILE 112 H ILE 112 7.488 16.490 -16.141 909 HA ILE 112 HA ILE 112 6.301 16.267 -13.462 910 HB ILE 112 HB ILE 112 6.724 14.158 -15.589 911 1HG1 ILE 112 1HG1 ILE 112 4.089 15.208 -14.575 912 2HG1 ILE 112 2HG1 ILE 112 4.930 15.971 -15.921 913 1HG2 ILE 112 1HG2 ILE 112 4.881 13.539 -13.413 914 2HG2 ILE 112 2HG2 ILE 112 6.550 13.723 -12.887 915 3HG2 ILE 112 3HG2 ILE 112 6.150 12.556 -14.141 916 1HD1 ILE 112 1HD1 ILE 112 3.643 13.288 -15.769 917 2HD1 ILE 112 2HD1 ILE 112 4.950 13.575 -16.918 918 3HD1 ILE 112 3HD1 ILE 112 3.483 14.548 -16.989 919 H ILE 113 H ILE 113 7.359 15.150 -11.828 920 HA ILE 113 HA ILE 113 10.082 14.190 -12.348 921 HB ILE 113 HB ILE 113 10.297 16.505 -11.535 922 1HG1 ILE 113 1HG1 ILE 113 11.119 14.409 -9.512 923 2HG1 ILE 113 2HG1 ILE 113 12.035 14.895 -10.936 924 1HG2 ILE 113 1HG2 ILE 113 8.103 15.939 -9.988 925 2HG2 ILE 113 2HG2 ILE 113 9.124 17.369 -9.842 926 3HG2 ILE 113 3HG2 ILE 113 9.413 15.969 -8.809 927 1HD1 ILE 113 1HD1 ILE 113 11.784 16.188 -8.316 928 2HD1 ILE 113 2HD1 ILE 113 11.738 17.276 -9.704 929 3HD1 ILE 113 3HD1 ILE 113 13.115 16.200 -9.471 930 H ARG 114 H ARG 114 10.627 12.399 -11.162 931 HA ARG 114 HA ARG 114 8.805 11.587 -9.005 932 1HB ARG 114 1HB ARG 114 8.527 10.417 -11.358 933 2HB ARG 114 2HB ARG 114 9.928 9.498 -10.819 934 1HG ARG 114 1HG ARG 114 8.778 8.433 -9.163 935 2HG ARG 114 2HG ARG 114 7.610 9.739 -8.982 936 1HD ARG 114 1HD ARG 114 6.663 7.676 -9.984 937 2HD ARG 114 2HD ARG 114 6.486 9.109 -10.989 938 HE ARG 114 HE ARG 114 8.583 7.087 -11.448 939 1HH1 ARG 114 1HH1 ARG 114 6.081 9.223 -12.639 940 2HH1 ARG 114 2HH1 ARG 114 6.378 8.838 -14.299 941 1HH2 ARG 114 1HH2 ARG 114 8.962 6.586 -13.634 942 2HH2 ARG 114 2HH2 ARG 114 8.008 7.344 -14.864 943 H GLU 115 H GLU 115 9.903 11.297 -7.190 944 HA GLU 115 HA GLU 115 12.653 10.260 -7.367 945 1HB GLU 115 1HB GLU 115 12.708 12.632 -6.802 946 2HB GLU 115 2HB GLU 115 11.606 12.356 -5.460 947 1HG GLU 115 1HG GLU 115 13.214 11.435 -4.142 948 2HG GLU 115 2HG GLU 115 14.135 10.809 -5.510 949 H GLY 116 H GLY 116 13.332 8.850 -5.755 950 1HA GLY 116 1HA GLY 116 13.077 7.577 -3.778 951 2HA GLY 116 2HA GLY 116 11.377 8.023 -3.737 952 H ARG 117 H ARG 117 12.474 7.073 -6.812 953 HA ARG 117 HA ARG 117 12.160 5.244 -8.097 954 1HB ARG 117 1HB ARG 117 12.772 4.132 -5.469 955 2HB ARG 117 2HB ARG 117 11.801 3.054 -6.464 956 1HG ARG 117 1HG ARG 117 14.302 4.351 -7.490 957 2HG ARG 117 2HG ARG 117 14.321 2.818 -6.615 958 1HD ARG 117 1HD ARG 117 13.459 1.671 -8.352 959 2HD ARG 117 2HD ARG 117 12.366 2.978 -8.805 960 HE ARG 117 HE ARG 117 15.075 2.548 -9.754 961 1HH1 ARG 117 1HH1 ARG 117 12.310 4.676 -9.623 962 2HH1 ARG 117 2HH1 ARG 117 12.870 5.686 -10.909 963 1HH2 ARG 117 1HH2 ARG 117 15.805 3.870 -11.452 964 2HH2 ARG 117 2HH2 ARG 117 14.851 5.226 -11.953 965 H ILE 118 H ILE 118 10.073 6.360 -8.480 966 HA ILE 118 HA ILE 118 7.823 6.310 -8.828 967 HB ILE 118 HB ILE 118 7.951 3.397 -8.057 968 1HG1 ILE 118 1HG1 ILE 118 8.056 3.906 -10.908 969 2HG1 ILE 118 2HG1 ILE 118 9.427 4.648 -10.090 970 1HG2 ILE 118 1HG2 ILE 118 5.836 5.051 -8.842 971 2HG2 ILE 118 2HG2 ILE 118 5.833 3.293 -8.707 972 3HG2 ILE 118 3HG2 ILE 118 6.216 4.057 -10.249 973 1HD1 ILE 118 1HD1 ILE 118 8.646 1.777 -9.688 974 2HD1 ILE 118 2HD1 ILE 118 10.152 2.573 -9.231 975 3HD1 ILE 118 3HD1 ILE 118 9.774 2.310 -10.934 976 H SER 119 H SER 119 8.655 7.140 -6.272 977 HA SER 119 HA SER 119 6.447 6.121 -4.598 978 1HB SER 119 1HB SER 119 9.182 6.121 -4.003 979 2HB SER 119 2HB SER 119 8.515 7.459 -3.067 980 HG SER 119 HG SER 119 8.373 5.520 -1.903 981 H LEU 120 H LEU 120 8.360 8.963 -5.464 982 HA LEU 120 HA LEU 120 6.084 10.646 -4.638 983 1HB LEU 120 1HB LEU 120 9.017 11.303 -4.381 984 2HB LEU 120 2HB LEU 120 7.702 12.411 -4.051 985 HG LEU 120 HG LEU 120 7.185 10.161 -2.458 986 1HD1 LEU 120 1HD1 LEU 120 9.213 9.184 -2.305 987 2HD1 LEU 120 2HD1 LEU 120 9.516 10.488 -1.157 988 3HD1 LEU 120 3HD1 LEU 120 10.070 10.635 -2.824 989 1HD2 LEU 120 1HD2 LEU 120 6.959 11.738 -0.874 990 2HD2 LEU 120 2HD2 LEU 120 7.204 12.870 -2.204 991 3HD2 LEU 120 3HD2 LEU 120 8.561 12.410 -1.177 992 H LEU 121 H LEU 121 5.851 12.652 -5.824 993 HA LEU 121 HA LEU 121 7.425 13.343 -8.036 994 1HB LEU 121 1HB LEU 121 5.952 12.699 -9.882 995 2HB LEU 121 2HB LEU 121 6.584 11.302 -9.035 996 HG LEU 121 HG LEU 121 4.244 11.571 -7.737 997 1HD1 LEU 121 1HD1 LEU 121 2.896 11.930 -10.181 998 2HD1 LEU 121 2HD1 LEU 121 4.010 13.287 -10.015 999 3HD1 LEU 121 3HD1 LEU 121 2.836 12.950 -8.745 1000 1HD2 LEU 121 1HD2 LEU 121 3.396 9.801 -9.182 1001 2HD2 LEU 121 2HD2 LEU 121 5.102 9.548 -8.815 1002 3HD2 LEU 121 3HD2 LEU 121 4.624 10.183 -10.390 1003 H LYS 122 H LYS 122 6.222 14.959 -9.520 1004 HA LYS 122 HA LYS 122 4.217 16.409 -7.920 1005 1HB LYS 122 1HB LYS 122 6.459 17.496 -7.910 1006 2HB LYS 122 2HB LYS 122 6.344 17.665 -9.658 1007 1HG LYS 122 1HG LYS 122 4.246 18.985 -9.302 1008 2HG LYS 122 2HG LYS 122 4.603 18.956 -7.575 1009 1HD LYS 122 1HD LYS 122 6.953 19.842 -8.433 1010 2HD LYS 122 2HD LYS 122 5.961 20.415 -9.777 1011 1HE LYS 122 1HE LYS 122 6.156 22.138 -8.079 1012 2HE LYS 122 2HE LYS 122 4.491 21.566 -8.185 1013 1HZ LYS 122 1HZ LYS 122 6.264 21.530 -5.964 1014 2HZ LYS 122 2HZ LYS 122 5.692 19.974 -6.291 1015 3HZ LYS 122 3HZ LYS 122 4.599 21.233 -6.009 1016 H CYS 123 H CYS 123 2.555 17.458 -9.005 1017 HA CYS 123 HA CYS 123 2.387 17.157 -11.909 1018 1HB CYS 123 1HB CYS 123 0.534 15.922 -9.894 1019 2HB CYS 123 2HB CYS 123 -0.052 16.358 -11.495 1020 H GLU 124 H GLU 124 2.837 19.550 -10.736 1021 HA GLU 124 HA GLU 124 0.711 21.047 -9.805 1022 1HB GLU 124 1HB GLU 124 1.924 23.014 -10.544 1023 2HB GLU 124 2HB GLU 124 3.045 21.837 -9.872 1024 1HG GLU 124 1HG GLU 124 3.541 21.102 -12.206 1025 2HG GLU 124 2HG GLU 124 2.569 22.458 -12.776 1026 H ALA 125 H ALA 125 1.374 19.988 -13.058 1027 HA ALA 125 HA ALA 125 -0.363 21.826 -14.370 1028 1HB ALA 125 1HB ALA 125 -0.163 19.568 -15.995 1029 2HB ALA 125 2HB ALA 125 1.373 19.658 -15.133 1030 3HB ALA 125 3HB ALA 125 0.807 21.037 -16.076 1031 H CYS 126 H CYS 126 -0.760 18.287 -14.264 1032 HA CYS 126 HA CYS 126 -3.619 18.554 -14.497 1033 1HB CYS 126 1HB CYS 126 -3.624 16.091 -14.476 1034 2HB CYS 126 2HB CYS 126 -2.458 16.724 -15.634 1035 H GLY 127 H GLY 127 -2.931 19.863 -12.225 1036 1HA GLY 127 1HA GLY 127 -4.318 19.755 -10.215 1037 2HA GLY 127 2HA GLY 127 -3.900 18.051 -10.111 1038 H ALA 128 H ALA 128 -2.575 17.675 -8.482 1039 HA ALA 128 HA ALA 128 -0.144 19.224 -8.198 1040 1HB ALA 128 1HB ALA 128 -2.368 19.879 -6.618 1041 2HB ALA 128 2HB ALA 128 -0.705 20.429 -6.417 1042 3HB ALA 128 3HB ALA 128 -1.267 18.991 -5.566 1043 H LYS 129 H LYS 129 1.449 18.169 -6.907 1044 HA LYS 129 HA LYS 129 0.827 15.601 -5.749 1045 1HB LYS 129 1HB LYS 129 2.220 15.863 -8.346 1046 2HB LYS 129 2HB LYS 129 2.886 14.706 -7.216 1047 1HG LYS 129 1HG LYS 129 -0.024 14.680 -7.841 1048 2HG LYS 129 2HG LYS 129 1.129 13.952 -8.952 1049 1HD LYS 129 1HD LYS 129 0.715 12.130 -7.658 1050 2HD LYS 129 2HD LYS 129 2.007 12.850 -6.697 1051 1HE LYS 129 1HE LYS 129 0.040 12.123 -5.364 1052 2HE LYS 129 2HE LYS 129 0.432 13.831 -5.188 1053 1HZ LYS 129 1HZ LYS 129 -1.327 14.128 -7.038 1054 2HZ LYS 129 2HZ LYS 129 -1.843 13.847 -5.456 1055 3HZ LYS 129 3HZ LYS 129 -1.845 12.586 -6.581 1056 H ALA 130 H ALA 130 2.427 14.828 -4.346 1057 HA ALA 130 HA ALA 130 4.178 16.889 -3.332 1058 1HB ALA 130 1HB ALA 130 3.950 15.847 -1.377 1059 2HB ALA 130 2HB ALA 130 4.406 14.286 -2.060 1060 3HB ALA 130 3HB ALA 130 2.739 14.847 -2.180 1061 HA PRO 131 HA PRO 131 7.607 15.203 -5.732 1062 1HB PRO 131 1HB PRO 131 9.391 17.143 -5.094 1063 2HB PRO 131 2HB PRO 131 8.133 17.356 -6.314 1064 1HG PRO 131 1HG PRO 131 8.197 18.286 -3.475 1065 2HG PRO 131 2HG PRO 131 7.620 19.133 -4.921 1066 1HD PRO 131 1HD PRO 131 5.957 17.911 -3.145 1067 2HD PRO 131 2HD PRO 131 5.576 18.092 -4.868 1068 H LEU 132 H LEU 132 8.325 16.610 -2.502 1069 HA LEU 132 HA LEU 132 9.028 14.268 -1.231 1070 1HB LEU 132 1HB LEU 132 11.506 14.350 -1.261 1071 2HB LEU 132 2HB LEU 132 10.795 13.900 -2.795 1072 HG LEU 132 HG LEU 132 11.327 16.772 -2.548 1073 1HD1 LEU 132 1HD1 LEU 132 13.557 16.808 -2.254 1074 2HD1 LEU 132 2HD1 LEU 132 13.793 15.232 -3.011 1075 3HD1 LEU 132 3HD1 LEU 132 13.236 15.333 -1.341 1076 1HD2 LEU 132 1HD2 LEU 132 11.158 16.497 -4.735 1077 2HD2 LEU 132 2HD2 LEU 132 11.142 14.744 -4.553 1078 3HD2 LEU 132 3HD2 LEU 132 12.673 15.601 -4.713 1079 H LYS 133 H LYS 133 10.255 17.578 -1.643 1080 HA LYS 133 HA LYS 133 9.756 18.054 1.197 1081 1HB LYS 133 1HB LYS 133 12.375 17.902 -0.056 1082 2HB LYS 133 2HB LYS 133 12.101 19.483 0.662 1083 1HG LYS 133 1HG LYS 133 11.650 18.477 2.809 1084 2HG LYS 133 2HG LYS 133 11.783 16.862 2.111 1085 1HD LYS 133 1HD LYS 133 14.114 17.187 1.646 1086 2HD LYS 133 2HD LYS 133 14.017 18.886 2.110 1087 1HE LYS 133 1HE LYS 133 13.734 18.356 4.386 1088 2HE LYS 133 2HE LYS 133 13.363 16.670 4.030 1089 1HZ LYS 133 1HZ LYS 133 15.968 18.030 4.061 1090 2HZ LYS 133 2HZ LYS 133 15.756 16.682 3.063 1091 3HZ LYS 133 3HZ LYS 133 15.528 16.541 4.732 1092 H ASN 134 H ASN 134 10.101 20.504 1.647 1093 HA ASN 134 HA ASN 134 8.726 21.931 -0.511 1094 1HB ASN 134 1HB ASN 134 9.024 22.662 2.411 1095 2HB ASN 134 2HB ASN 134 8.075 23.550 1.221 1096 1HD2 ASN 134 1HD2 ASN 134 5.997 23.137 1.265 1097 2HD2 ASN 134 2HD2 ASN 134 5.256 21.659 1.767 1098 H VAL 135 H VAL 135 10.831 22.059 -1.637 1099 HA VAL 135 HA VAL 135 13.024 23.500 -0.658 1100 HB VAL 135 HB VAL 135 13.193 22.120 -2.658 1101 1HG1 VAL 135 1HG1 VAL 135 10.835 23.336 -3.425 1102 2HG1 VAL 135 2HG1 VAL 135 11.820 22.255 -4.409 1103 3HG1 VAL 135 3HG1 VAL 135 12.029 24.002 -4.541 1104 1HG2 VAL 135 1HG2 VAL 135 14.701 24.119 -2.268 1105 2HG2 VAL 135 2HG2 VAL 135 13.734 24.962 -3.478 1106 3HG2 VAL 135 3HG2 VAL 135 14.627 23.508 -3.921 Start of MODEL 6 1 H MET 1 H MET 1 -22.872 -30.772 1.010 2 HA MET 1 HA MET 1 -22.431 -32.668 -1.148 3 1HB MET 1 1HB MET 1 -23.228 -30.290 -1.412 4 2HB MET 1 2HB MET 1 -21.675 -29.765 -0.777 5 1HG MET 1 1HG MET 1 -20.550 -30.898 -2.642 6 2HG MET 1 2HG MET 1 -22.123 -31.363 -3.287 7 1HE MET 1 1HE MET 1 -19.510 -29.854 -4.099 8 2HE MET 1 2HE MET 1 -19.513 -28.112 -3.827 9 3HE MET 1 3HE MET 1 -20.106 -28.765 -5.353 10 H ASP 2 H ASP 2 -20.834 -31.270 1.603 11 HA ASP 2 HA ASP 2 -18.246 -32.277 0.623 12 1HB ASP 2 1HB ASP 2 -19.002 -30.000 2.403 13 2HB ASP 2 2HB ASP 2 -17.453 -30.793 2.669 14 H ASP 3 H ASP 3 -20.235 -34.001 1.731 15 HA ASP 3 HA ASP 3 -19.298 -34.602 4.427 16 1HB ASP 3 1HB ASP 3 -21.539 -35.711 2.734 17 2HB ASP 3 2HB ASP 3 -21.087 -36.404 4.289 18 H TYR 4 H TYR 4 -19.464 -36.116 1.224 19 HA TYR 4 HA TYR 4 -17.272 -37.893 2.046 20 1HB TYR 4 1HB TYR 4 -19.943 -38.685 1.377 21 2HB TYR 4 2HB TYR 4 -18.847 -39.286 0.139 22 HD1 TYR 4 HD1 TYR 4 -20.330 -40.045 3.193 23 HD2 TYR 4 HD2 TYR 4 -16.612 -40.370 1.153 24 HE1 TYR 4 HE1 TYR 4 -19.685 -41.897 4.677 25 HE2 TYR 4 HE2 TYR 4 -15.957 -42.224 2.629 26 HH TYR 4 HH TYR 4 -17.310 -42.882 5.466 27 H GLU 5 H GLU 5 -15.696 -36.837 0.922 28 HA GLU 5 HA GLU 5 -16.102 -36.058 -1.834 29 1HB GLU 5 1HB GLU 5 -13.631 -35.960 -0.093 30 2HB GLU 5 2HB GLU 5 -13.759 -35.270 -1.704 31 1HG GLU 5 1HG GLU 5 -15.765 -34.422 0.299 32 2HG GLU 5 2HG GLU 5 -14.113 -33.839 0.500 33 H LYS 6 H LYS 6 -14.927 -36.865 -3.614 34 HA LYS 6 HA LYS 6 -14.257 -39.693 -3.356 35 1HB LYS 6 1HB LYS 6 -15.747 -38.484 -5.203 36 2HB LYS 6 2HB LYS 6 -14.186 -38.294 -5.986 37 1HG LYS 6 1HG LYS 6 -15.090 -40.272 -6.854 38 2HG LYS 6 2HG LYS 6 -13.881 -40.788 -5.676 39 1HD LYS 6 1HD LYS 6 -15.600 -42.139 -5.036 40 2HD LYS 6 2HD LYS 6 -15.986 -40.721 -4.060 41 1HE LYS 6 1HE LYS 6 -17.200 -40.237 -6.514 42 2HE LYS 6 2HE LYS 6 -17.481 -41.951 -6.211 43 1HZ LYS 6 1HZ LYS 6 -19.219 -40.456 -5.306 44 2HZ LYS 6 2HZ LYS 6 -18.072 -39.805 -4.248 45 3HZ LYS 6 3HZ LYS 6 -18.496 -41.438 -4.132 46 H LEU 7 H LEU 7 -12.860 -37.078 -5.332 47 HA LEU 7 HA LEU 7 -10.224 -37.555 -4.235 48 1HB LEU 7 1HB LEU 7 -11.087 -38.833 -6.653 49 2HB LEU 7 2HB LEU 7 -9.834 -37.669 -7.038 50 HG LEU 7 HG LEU 7 -9.108 -39.278 -4.733 51 1HD1 LEU 7 1HD1 LEU 7 -8.812 -41.392 -5.880 52 2HD1 LEU 7 2HD1 LEU 7 -9.586 -40.742 -7.325 53 3HD1 LEU 7 3HD1 LEU 7 -10.519 -40.952 -5.843 54 1HD2 LEU 7 1HD2 LEU 7 -7.064 -39.565 -5.995 55 2HD2 LEU 7 2HD2 LEU 7 -7.584 -37.883 -6.078 56 3HD2 LEU 7 3HD2 LEU 7 -7.846 -38.957 -7.453 57 H LEU 8 H LEU 8 -12.290 -35.366 -4.691 58 HA LEU 8 HA LEU 8 -10.861 -33.531 -6.433 59 1HB LEU 8 1HB LEU 8 -13.411 -33.249 -4.844 60 2HB LEU 8 2HB LEU 8 -12.727 -31.967 -5.827 61 HG LEU 8 HG LEU 8 -12.914 -34.236 -7.498 62 1HD1 LEU 8 1HD1 LEU 8 -15.621 -33.699 -6.365 63 2HD1 LEU 8 2HD1 LEU 8 -14.576 -34.903 -5.610 64 3HD1 LEU 8 3HD1 LEU 8 -15.047 -35.078 -7.301 65 1HD2 LEU 8 1HD2 LEU 8 -13.871 -32.755 -8.901 66 2HD2 LEU 8 2HD2 LEU 8 -13.324 -31.586 -7.699 67 3HD2 LEU 8 3HD2 LEU 8 -14.993 -32.156 -7.679 68 H GLU 9 H GLU 9 -9.028 -33.915 -4.742 69 HA GLU 9 HA GLU 9 -8.660 -31.486 -3.357 70 1HB GLU 9 1HB GLU 9 -8.608 -32.306 -1.053 71 2HB GLU 9 2HB GLU 9 -10.211 -32.490 -1.749 72 1HG GLU 9 1HG GLU 9 -9.098 -34.897 -2.330 73 2HG GLU 9 2HG GLU 9 -8.326 -34.511 -0.793 74 H ARG 10 H ARG 10 -7.228 -32.942 -5.251 75 HA ARG 10 HA ARG 10 -4.913 -33.965 -3.762 76 1HB ARG 10 1HB ARG 10 -6.213 -35.159 -5.790 77 2HB ARG 10 2HB ARG 10 -5.047 -34.227 -6.717 78 1HG ARG 10 1HG ARG 10 -4.291 -36.515 -6.255 79 2HG ARG 10 2HG ARG 10 -3.215 -35.297 -5.570 80 1HD ARG 10 1HD ARG 10 -3.378 -36.689 -3.774 81 2HD ARG 10 2HD ARG 10 -4.769 -35.660 -3.450 82 HE ARG 10 HE ARG 10 -5.863 -37.620 -4.907 83 1HH1 ARG 10 1HH1 ARG 10 -3.714 -37.722 -2.157 84 2HH1 ARG 10 2HH1 ARG 10 -4.363 -39.205 -1.546 85 1HH2 ARG 10 1HH2 ARG 10 -6.722 -39.564 -4.108 86 2HH2 ARG 10 2HH2 ARG 10 -6.079 -40.254 -2.656 87 H ALA 11 H ALA 11 -2.832 -33.223 -4.212 88 HA ALA 11 HA ALA 11 -1.222 -31.692 -4.689 89 1HB ALA 11 1HB ALA 11 -2.201 -30.186 -6.831 90 2HB ALA 11 2HB ALA 11 -2.854 -31.808 -7.056 91 3HB ALA 11 3HB ALA 11 -1.114 -31.573 -6.902 92 H ILE 12 H ILE 12 -3.106 -31.040 -2.729 93 HA ILE 12 HA ILE 12 -3.651 -28.189 -3.121 94 HB ILE 12 HB ILE 12 -4.559 -29.980 -0.867 95 1HG1 ILE 12 1HG1 ILE 12 -6.090 -29.013 -3.288 96 2HG1 ILE 12 2HG1 ILE 12 -5.491 -30.653 -3.053 97 1HG2 ILE 12 1HG2 ILE 12 -4.411 -27.263 -0.879 98 2HG2 ILE 12 2HG2 ILE 12 -5.553 -28.207 0.077 99 3HG2 ILE 12 3HG2 ILE 12 -6.048 -27.534 -1.476 100 1HD1 ILE 12 1HD1 ILE 12 -7.106 -31.174 -1.556 101 2HD1 ILE 12 2HD1 ILE 12 -7.976 -29.950 -2.481 102 3HD1 ILE 12 3HD1 ILE 12 -7.230 -29.526 -0.941 103 H ASP 13 H ASP 13 -3.148 -29.559 0.044 104 HA ASP 13 HA ASP 13 -0.671 -27.994 0.293 105 1HB ASP 13 1HB ASP 13 -3.085 -27.553 1.630 106 2HB ASP 13 2HB ASP 13 -2.060 -28.360 2.813 107 H GLN 14 H GLN 14 -2.339 -30.960 0.911 108 HA GLN 14 HA GLN 14 -0.434 -32.021 2.770 109 1HB GLN 14 1HB GLN 14 -2.999 -32.682 2.020 110 2HB GLN 14 2HB GLN 14 -2.045 -33.961 1.283 111 1HG GLN 14 1HG GLN 14 -1.510 -33.264 4.118 112 2HG GLN 14 2HG GLN 14 -2.981 -34.158 3.737 113 1HE2 GLN 14 1HE2 GLN 14 -2.072 -35.723 1.640 114 2HE2 GLN 14 2HE2 GLN 14 -0.905 -36.844 2.241 115 H LEU 15 H LEU 15 -0.391 -31.526 -0.564 116 HA LEU 15 HA LEU 15 1.529 -33.711 -0.981 117 1HB LEU 15 1HB LEU 15 -0.652 -32.855 -2.509 118 2HB LEU 15 2HB LEU 15 0.759 -32.295 -3.385 119 HG LEU 15 HG LEU 15 1.266 -34.983 -2.640 120 1HD1 LEU 15 1HD1 LEU 15 -0.721 -35.878 -4.120 121 2HD1 LEU 15 2HD1 LEU 15 -1.538 -34.455 -3.475 122 3HD1 LEU 15 3HD1 LEU 15 -0.896 -35.675 -2.376 123 1HD2 LEU 15 1HD2 LEU 15 0.984 -33.358 -5.083 124 2HD2 LEU 15 2HD2 LEU 15 0.775 -35.097 -5.287 125 3HD2 LEU 15 3HD2 LEU 15 2.267 -34.463 -4.593 126 HA PRO 16 HA PRO 16 4.826 -30.717 -0.826 127 1HB PRO 16 1HB PRO 16 6.534 -32.146 -2.521 128 2HB PRO 16 2HB PRO 16 6.452 -32.297 -0.764 129 1HG PRO 16 1HG PRO 16 5.213 -33.996 -2.876 130 2HG PRO 16 2HG PRO 16 5.888 -34.465 -1.305 131 1HD PRO 16 1HD PRO 16 3.243 -34.338 -1.706 132 2HD PRO 16 2HD PRO 16 3.966 -33.852 -0.157 133 HA PRO 17 HA PRO 17 4.101 -28.294 -4.462 134 1HB PRO 17 1HB PRO 17 6.425 -26.808 -4.411 135 2HB PRO 17 2HB PRO 17 4.983 -26.449 -3.457 136 1HG PRO 17 1HG PRO 17 7.488 -27.865 -2.650 137 2HG PRO 17 2HG PRO 17 6.518 -26.692 -1.739 138 1HD PRO 17 1HD PRO 17 6.374 -29.327 -1.242 139 2HD PRO 17 2HD PRO 17 4.944 -28.281 -1.130 140 H GLU 18 H GLU 18 4.347 -30.208 -5.826 141 HA GLU 18 HA GLU 18 6.759 -29.995 -7.470 142 1HB GLU 18 1HB GLU 18 6.635 -32.009 -5.717 143 2HB GLU 18 2HB GLU 18 5.695 -32.734 -7.014 144 1HG GLU 18 1HG GLU 18 7.872 -33.450 -7.403 145 2HG GLU 18 2HG GLU 18 7.637 -32.125 -8.541 146 H VAL 19 H VAL 19 3.898 -32.130 -7.391 147 HA VAL 19 HA VAL 19 3.414 -31.432 -10.196 148 HB VAL 19 HB VAL 19 2.205 -33.690 -8.592 149 1HG1 VAL 19 1HG1 VAL 19 1.234 -32.598 -10.874 150 2HG1 VAL 19 2HG1 VAL 19 1.032 -34.290 -10.419 151 3HG1 VAL 19 3HG1 VAL 19 2.322 -33.823 -11.526 152 1HG2 VAL 19 1HG2 VAL 19 4.581 -33.608 -10.438 153 2HG2 VAL 19 2HG2 VAL 19 3.748 -35.101 -10.004 154 3HG2 VAL 19 3HG2 VAL 19 4.530 -34.133 -8.754 155 H PHE 20 H PHE 20 2.682 -29.341 -8.807 156 HA PHE 20 HA PHE 20 -0.123 -29.584 -8.037 157 1HB PHE 20 1HB PHE 20 0.183 -27.101 -7.476 158 2HB PHE 20 2HB PHE 20 1.061 -28.264 -6.492 159 HD1 PHE 20 HD1 PHE 20 3.145 -27.582 -5.898 160 HD2 PHE 20 HD2 PHE 20 1.665 -26.488 -9.732 161 HE1 PHE 20 HE1 PHE 20 5.254 -26.410 -6.369 162 HE2 PHE 20 HE2 PHE 20 3.773 -25.313 -10.213 163 HZ PHE 20 HZ PHE 20 5.571 -25.273 -8.530 164 H GLU 21 H GLU 21 -1.695 -27.992 -8.870 165 HA GLU 21 HA GLU 21 -1.069 -27.133 -11.611 166 1HB GLU 21 1HB GLU 21 -2.854 -29.194 -10.885 167 2HB GLU 21 2HB GLU 21 -3.850 -27.837 -11.386 168 1HG GLU 21 1HG GLU 21 -2.013 -27.847 -13.359 169 2HG GLU 21 2HG GLU 21 -2.078 -29.563 -12.960 170 H THR 22 H THR 22 -4.171 -26.877 -9.921 171 HA THR 22 HA THR 22 -3.827 -23.956 -9.978 172 HB THR 22 HB THR 22 -6.456 -25.441 -9.892 173 HG1 THR 22 HG1 THR 22 -5.384 -24.234 -12.200 174 1HG2 THR 22 1HG2 THR 22 -7.110 -23.345 -9.378 175 2HG2 THR 22 2HG2 THR 22 -7.001 -23.146 -11.127 176 3HG2 THR 22 3HG2 THR 22 -5.679 -22.602 -10.093 177 H LYS 23 H LYS 23 -3.432 -23.080 -8.060 178 HA LYS 23 HA LYS 23 -4.330 -24.467 -5.648 179 1HB LYS 23 1HB LYS 23 -1.936 -23.714 -5.949 180 2HB LYS 23 2HB LYS 23 -2.521 -22.061 -5.815 181 1HG LYS 23 1HG LYS 23 -2.623 -22.178 -3.599 182 2HG LYS 23 2HG LYS 23 -3.473 -23.723 -3.643 183 1HD LYS 23 1HD LYS 23 -0.497 -23.363 -3.971 184 2HD LYS 23 2HD LYS 23 -1.305 -23.877 -2.488 185 1HE LYS 23 1HE LYS 23 -1.366 -25.983 -3.194 186 2HE LYS 23 2HE LYS 23 -2.173 -25.503 -4.687 187 1HZ LYS 23 1HZ LYS 23 -0.259 -26.375 -5.517 188 2HZ LYS 23 2HZ LYS 23 0.673 -25.952 -4.170 189 3HZ LYS 23 3HZ LYS 23 0.255 -24.776 -5.311 190 H ARG 24 H ARG 24 -5.274 -23.250 -3.878 191 HA ARG 24 HA ARG 24 -7.292 -21.415 -4.831 192 1HB ARG 24 1HB ARG 24 -6.866 -22.223 -1.964 193 2HB ARG 24 2HB ARG 24 -8.359 -21.728 -2.751 194 1HG ARG 24 1HG ARG 24 -8.309 -23.811 -4.078 195 2HG ARG 24 2HG ARG 24 -6.873 -24.312 -3.181 196 1HD ARG 24 1HD ARG 24 -8.304 -23.951 -1.083 197 2HD ARG 24 2HD ARG 24 -9.678 -23.939 -2.187 198 HE ARG 24 HE ARG 24 -7.831 -26.218 -2.205 199 1HH1 ARG 24 1HH1 ARG 24 -11.020 -24.934 -1.554 200 2HH1 ARG 24 2HH1 ARG 24 -11.753 -26.496 -1.431 201 1HH2 ARG 24 1HH2 ARG 24 -8.801 -28.261 -2.035 202 2HH2 ARG 24 2HH2 ARG 24 -10.496 -28.383 -1.702 203 H PHE 25 H PHE 25 -5.093 -20.073 -5.287 204 HA PHE 25 HA PHE 25 -4.484 -18.385 -2.981 205 1HB PHE 25 1HB PHE 25 -3.103 -19.107 -5.469 206 2HB PHE 25 2HB PHE 25 -2.986 -17.398 -5.070 207 HD1 PHE 25 HD1 PHE 25 -2.954 -17.626 -2.073 208 HD2 PHE 25 HD2 PHE 25 -0.917 -19.821 -5.099 209 HE1 PHE 25 HE1 PHE 25 -1.140 -18.125 -0.487 210 HE2 PHE 25 HE2 PHE 25 0.898 -20.324 -3.518 211 HZ PHE 25 HZ PHE 25 0.789 -19.476 -1.209 212 H GLU 26 H GLU 26 -6.833 -17.681 -3.226 213 HA GLU 26 HA GLU 26 -6.840 -15.080 -4.431 214 1HB GLU 26 1HB GLU 26 -7.617 -17.057 -6.133 215 2HB GLU 26 2HB GLU 26 -9.159 -16.626 -5.404 216 1HG GLU 26 1HG GLU 26 -9.154 -14.520 -6.300 217 2HG GLU 26 2HG GLU 26 -7.396 -14.454 -6.413 218 H VAL 27 H VAL 27 -7.810 -13.822 -2.999 219 HA VAL 27 HA VAL 27 -10.295 -14.648 -1.735 220 HB VAL 27 HB VAL 27 -7.946 -13.787 -0.040 221 1HG1 VAL 27 1HG1 VAL 27 -10.724 -14.694 0.704 222 2HG1 VAL 27 2HG1 VAL 27 -10.092 -13.053 0.833 223 3HG1 VAL 27 3HG1 VAL 27 -9.423 -14.338 1.841 224 1HG2 VAL 27 1HG2 VAL 27 -8.406 -16.197 0.902 225 2HG2 VAL 27 2HG2 VAL 27 -7.360 -15.959 -0.498 226 3HG2 VAL 27 3HG2 VAL 27 -9.030 -16.478 -0.722 227 HA PRO 28 HA PRO 28 -10.975 -10.360 -2.917 228 1HB PRO 28 1HB PRO 28 -13.359 -10.777 -1.190 229 2HB PRO 28 2HB PRO 28 -13.256 -10.149 -2.837 230 1HG PRO 28 1HG PRO 28 -14.138 -12.621 -2.369 231 2HG PRO 28 2HG PRO 28 -13.127 -12.257 -3.779 232 1HD PRO 28 1HD PRO 28 -12.401 -13.614 -1.224 233 2HD PRO 28 2HD PRO 28 -11.817 -13.918 -2.873 234 H LYS 29 H LYS 29 -9.386 -9.287 -1.750 235 HA LYS 29 HA LYS 29 -10.306 -7.948 0.618 236 1HB LYS 29 1HB LYS 29 -8.167 -10.018 0.750 237 2HB LYS 29 2HB LYS 29 -7.962 -8.562 1.713 238 1HG LYS 29 1HG LYS 29 -10.433 -10.265 1.838 239 2HG LYS 29 2HG LYS 29 -9.032 -10.517 2.877 240 1HD LYS 29 1HD LYS 29 -10.263 -9.154 4.230 241 2HD LYS 29 2HD LYS 29 -9.364 -7.930 3.331 242 1HE LYS 29 1HE LYS 29 -11.240 -7.619 1.827 243 2HE LYS 29 2HE LYS 29 -12.129 -8.913 2.623 244 1HZ LYS 29 1HZ LYS 29 -12.766 -7.551 4.254 245 2HZ LYS 29 2HZ LYS 29 -12.323 -6.293 3.214 246 3HZ LYS 29 3HZ LYS 29 -11.243 -6.826 4.400 247 H ALA 30 H ALA 30 -9.406 -5.961 0.867 248 HA ALA 30 HA ALA 30 -6.921 -5.211 -0.349 249 1HB ALA 30 1HB ALA 30 -7.769 -4.824 -2.388 250 2HB ALA 30 2HB ALA 30 -8.422 -3.361 -1.653 251 3HB ALA 30 3HB ALA 30 -9.432 -4.798 -1.802 252 H TYR 31 H TYR 31 -6.181 -3.200 0.381 253 HA TYR 31 HA TYR 31 -5.921 -1.597 1.972 254 1HB TYR 31 1HB TYR 31 -8.484 -0.444 2.158 255 2HB TYR 31 2HB TYR 31 -7.106 0.124 1.231 256 HD1 TYR 31 HD1 TYR 31 -10.409 -1.263 1.089 257 HD2 TYR 31 HD2 TYR 31 -6.850 -0.659 -1.161 258 HE1 TYR 31 HE1 TYR 31 -11.668 -1.632 -0.989 259 HE2 TYR 31 HE2 TYR 31 -8.098 -1.026 -3.249 260 HH TYR 31 HH TYR 31 -11.099 -2.411 -3.380 261 H SER 32 H SER 32 -7.262 -0.515 3.962 262 HA SER 32 HA SER 32 -7.598 -2.735 5.783 263 1HB SER 32 1HB SER 32 -7.654 0.256 6.238 264 2HB SER 32 2HB SER 32 -7.776 -0.953 7.515 265 HG SER 32 HG SER 32 -5.661 -0.463 7.418 266 H VAL 33 H VAL 33 -9.381 -2.183 7.582 267 HA VAL 33 HA VAL 33 -11.909 -1.479 6.278 268 HB VAL 33 HB VAL 33 -12.853 -3.525 7.666 269 1HG1 VAL 33 1HG1 VAL 33 -11.848 -3.248 4.919 270 2HG1 VAL 33 2HG1 VAL 33 -13.438 -3.738 5.505 271 3HG1 VAL 33 3HG1 VAL 33 -12.118 -4.907 5.455 272 1HG2 VAL 33 1HG2 VAL 33 -10.375 -3.968 8.377 273 2HG2 VAL 33 2HG2 VAL 33 -10.278 -4.766 6.808 274 3HG2 VAL 33 3HG2 VAL 33 -11.448 -5.317 8.007 275 H ILE 34 H ILE 34 -13.263 -0.350 7.550 276 HA ILE 34 HA ILE 34 -12.413 0.313 10.238 277 HB ILE 34 HB ILE 34 -13.086 2.132 8.793 278 1HG1 ILE 34 1HG1 ILE 34 -13.731 1.984 11.328 279 2HG1 ILE 34 2HG1 ILE 34 -14.329 3.313 10.345 280 1HG2 ILE 34 1HG2 ILE 34 -14.597 0.886 7.329 281 2HG2 ILE 34 2HG2 ILE 34 -15.352 2.359 7.932 282 3HG2 ILE 34 3HG2 ILE 34 -15.785 0.799 8.628 283 1HD1 ILE 34 1HD1 ILE 34 -15.793 0.957 11.442 284 2HD1 ILE 34 2HD1 ILE 34 -16.404 1.793 10.018 285 3HD1 ILE 34 3HD1 ILE 34 -16.194 2.670 11.531 286 H GLN 35 H GLN 35 -13.497 -0.160 12.096 287 HA GLN 35 HA GLN 35 -16.125 -1.348 12.041 288 1HB GLN 35 1HB GLN 35 -14.133 -3.129 11.715 289 2HB GLN 35 2HB GLN 35 -14.158 -3.046 13.471 290 1HG GLN 35 1HG GLN 35 -15.988 -4.291 13.585 291 2HG GLN 35 2HG GLN 35 -16.825 -3.291 12.399 292 1HE2 GLN 35 1HE2 GLN 35 -15.602 -6.307 13.026 293 2HE2 GLN 35 2HE2 GLN 35 -15.547 -6.923 11.414 294 H GLY 36 H GLY 36 -16.897 0.170 13.429 295 1HA GLY 36 1HA GLY 36 -17.392 1.050 15.503 296 2HA GLY 36 2HA GLY 36 -16.304 -0.139 16.204 297 H ASN 37 H ASN 37 -13.939 0.330 15.900 298 HA ASN 37 HA ASN 37 -13.139 3.038 15.430 299 1HB ASN 37 1HB ASN 37 -14.194 3.004 17.782 300 2HB ASN 37 2HB ASN 37 -12.765 2.094 18.265 301 1HD2 ASN 37 1HD2 ASN 37 -12.141 3.746 19.653 302 2HD2 ASN 37 2HD2 ASN 37 -11.445 5.216 19.069 303 H ARG 38 H ARG 38 -12.469 0.198 14.735 304 HA ARG 38 HA ARG 38 -9.579 0.436 15.155 305 1HB ARG 38 1HB ARG 38 -9.601 -2.143 15.403 306 2HB ARG 38 2HB ARG 38 -10.013 -1.161 16.801 307 1HG ARG 38 1HG ARG 38 -12.395 -1.535 16.328 308 2HG ARG 38 2HG ARG 38 -11.945 -2.556 14.961 309 1HD ARG 38 1HD ARG 38 -10.686 -4.008 16.554 310 2HD ARG 38 2HD ARG 38 -11.350 -3.045 17.874 311 HE ARG 38 HE ARG 38 -13.219 -4.297 16.013 312 1HH1 ARG 38 1HH1 ARG 38 -11.734 -4.290 19.179 313 2HH1 ARG 38 2HH1 ARG 38 -12.943 -5.311 19.878 314 1HH2 ARG 38 1HH2 ARG 38 -14.794 -5.643 16.936 315 2HH2 ARG 38 2HH2 ARG 38 -14.678 -6.077 18.608 316 H THR 39 H THR 39 -8.299 -0.682 13.588 317 HA THR 39 HA THR 39 -9.755 -1.126 11.077 318 HB THR 39 HB THR 39 -7.545 0.505 11.677 319 HG1 THR 39 HG1 THR 39 -7.908 0.063 9.026 320 1HG2 THR 39 1HG2 THR 39 -5.720 -0.709 11.254 321 2HG2 THR 39 2HG2 THR 39 -6.182 -0.503 9.569 322 3HG2 THR 39 3HG2 THR 39 -6.611 -1.979 10.424 323 H PHE 40 H PHE 40 -9.890 -3.106 10.302 324 HA PHE 40 HA PHE 40 -8.289 -5.229 11.499 325 1HB PHE 40 1HB PHE 40 -10.808 -5.127 9.890 326 2HB PHE 40 2HB PHE 40 -9.882 -6.620 9.927 327 HD1 PHE 40 HD1 PHE 40 -11.276 -8.033 11.110 328 HD2 PHE 40 HD2 PHE 40 -10.371 -4.186 12.681 329 HE1 PHE 40 HE1 PHE 40 -12.374 -8.645 13.223 330 HE2 PHE 40 HE2 PHE 40 -11.463 -4.790 14.802 331 HZ PHE 40 HZ PHE 40 -12.468 -7.023 15.074 332 H ILE 41 H ILE 41 -6.381 -4.216 10.299 333 HA ILE 41 HA ILE 41 -6.137 -4.363 7.510 334 HB ILE 41 HB ILE 41 -4.359 -3.872 9.740 335 1HG1 ILE 41 1HG1 ILE 41 -3.402 -3.065 7.125 336 2HG1 ILE 41 2HG1 ILE 41 -5.111 -2.686 7.337 337 1HG2 ILE 41 1HG2 ILE 41 -3.505 -6.070 8.217 338 2HG2 ILE 41 2HG2 ILE 41 -2.579 -5.129 9.377 339 3HG2 ILE 41 3HG2 ILE 41 -2.554 -4.694 7.672 340 1HD1 ILE 41 1HD1 ILE 41 -2.827 -1.343 8.382 341 2HD1 ILE 41 2HD1 ILE 41 -3.816 -1.936 9.716 342 3HD1 ILE 41 3HD1 ILE 41 -4.526 -0.893 8.491 343 H GLN 42 H GLN 42 -5.947 -5.970 6.145 344 HA GLN 42 HA GLN 42 -5.198 -8.624 7.179 345 1HB GLN 42 1HB GLN 42 -7.597 -7.808 5.818 346 2HB GLN 42 2HB GLN 42 -6.728 -8.979 4.836 347 1HG GLN 42 1HG GLN 42 -6.567 -10.267 7.127 348 2HG GLN 42 2HG GLN 42 -7.998 -9.305 7.497 349 1HE2 GLN 42 1HE2 GLN 42 -6.803 -10.898 4.570 350 2HE2 GLN 42 2HE2 GLN 42 -8.237 -11.815 4.271 351 H ASN 43 H ASN 43 -5.002 -6.309 4.550 352 HA ASN 43 HA ASN 43 -2.980 -8.004 3.252 353 1HB ASN 43 1HB ASN 43 -5.076 -6.219 2.219 354 2HB ASN 43 2HB ASN 43 -3.509 -6.018 1.440 355 1HD2 ASN 43 1HD2 ASN 43 -6.331 -7.521 1.128 356 2HD2 ASN 43 2HD2 ASN 43 -5.844 -8.948 0.284 357 H PHE 44 H PHE 44 -2.084 -6.713 5.473 358 HA PHE 44 HA PHE 44 -1.179 -4.147 5.385 359 1HB PHE 44 1HB PHE 44 -0.720 -6.178 7.067 360 2HB PHE 44 2HB PHE 44 0.830 -6.172 6.237 361 HD1 PHE 44 HD1 PHE 44 1.898 -3.719 6.007 362 HD2 PHE 44 HD2 PHE 44 -0.906 -4.931 8.961 363 HE1 PHE 44 HE1 PHE 44 2.636 -1.879 7.460 364 HE2 PHE 44 HE2 PHE 44 -0.184 -3.092 10.417 365 HZ PHE 44 HZ PHE 44 1.592 -1.559 9.668 366 H ARG 45 H ARG 45 -0.174 -6.712 3.275 367 HA ARG 45 HA ARG 45 2.293 -5.446 2.495 368 1HB ARG 45 1HB ARG 45 1.465 -7.992 2.341 369 2HB ARG 45 2HB ARG 45 1.025 -7.457 0.726 370 1HG ARG 45 1HG ARG 45 3.730 -6.723 1.625 371 2HG ARG 45 2HG ARG 45 3.437 -8.444 1.366 372 1HD ARG 45 1HD ARG 45 2.988 -6.221 -0.622 373 2HD ARG 45 2HD ARG 45 4.280 -7.416 -0.663 374 HE ARG 45 HE ARG 45 1.422 -7.990 -1.096 375 1HH1 ARG 45 1HH1 ARG 45 4.794 -8.821 -1.528 376 2HH1 ARG 45 2HH1 ARG 45 4.453 -10.141 -2.592 377 1HH2 ARG 45 1HH2 ARG 45 0.986 -9.732 -2.486 378 2HH2 ARG 45 2HH2 ARG 45 2.297 -10.659 -3.137 379 H GLU 46 H GLU 46 -0.744 -6.148 0.732 380 HA GLU 46 HA GLU 46 -0.153 -4.466 -1.460 381 1HB GLU 46 1HB GLU 46 -1.874 -6.298 -1.453 382 2HB GLU 46 2HB GLU 46 -2.893 -5.251 -0.481 383 1HG GLU 46 1HG GLU 46 -3.695 -4.322 -2.314 384 2HG GLU 46 2HG GLU 46 -2.077 -3.762 -2.734 385 H VAL 47 H VAL 47 -2.096 -4.001 1.448 386 HA VAL 47 HA VAL 47 -2.939 -1.371 0.923 387 HB VAL 47 HB VAL 47 -2.345 -2.363 3.705 388 1HG1 VAL 47 1HG1 VAL 47 -4.841 -1.066 3.535 389 2HG1 VAL 47 2HG1 VAL 47 -3.698 -0.093 2.612 390 3HG1 VAL 47 3HG1 VAL 47 -3.361 -0.485 4.295 391 1HG2 VAL 47 1HG2 VAL 47 -4.980 -2.930 2.448 392 2HG2 VAL 47 2HG2 VAL 47 -4.189 -3.719 3.803 393 3HG2 VAL 47 3HG2 VAL 47 -3.643 -4.028 2.159 394 H ALA 48 H ALA 48 -0.041 -2.680 2.465 395 HA ALA 48 HA ALA 48 1.000 -0.290 3.446 396 1HB ALA 48 1HB ALA 48 1.963 -2.195 4.319 397 2HB ALA 48 2HB ALA 48 3.228 -1.546 3.279 398 3HB ALA 48 3HB ALA 48 2.245 -2.902 2.727 399 H ASP 49 H ASP 49 1.150 -1.676 0.247 400 HA ASP 49 HA ASP 49 3.278 0.050 -0.629 401 1HB ASP 49 1HB ASP 49 1.825 -2.189 -1.699 402 2HB ASP 49 2HB ASP 49 1.857 -0.890 -2.887 403 H ALA 50 H ALA 50 -0.085 -0.163 -1.811 404 HA ALA 50 HA ALA 50 -0.107 2.211 -3.171 405 1HB ALA 50 1HB ALA 50 -2.673 2.138 -2.438 406 2HB ALA 50 2HB ALA 50 -2.198 0.498 -2.004 407 3HB ALA 50 3HB ALA 50 -1.986 1.070 -3.659 408 H LEU 51 H LEU 51 -1.054 1.801 0.250 409 HA LEU 51 HA LEU 51 -1.693 4.515 0.605 410 1HB LEU 51 1HB LEU 51 -2.654 3.208 2.223 411 2HB LEU 51 2HB LEU 51 -1.248 2.174 2.382 412 HG LEU 51 HG LEU 51 -0.099 3.914 3.645 413 1HD1 LEU 51 1HD1 LEU 51 -2.540 5.449 2.942 414 2HD1 LEU 51 2HD1 LEU 51 -0.847 5.927 2.859 415 3HD1 LEU 51 3HD1 LEU 51 -1.655 5.821 4.421 416 1HD2 LEU 51 1HD2 LEU 51 -2.152 4.077 5.436 417 2HD2 LEU 51 2HD2 LEU 51 -1.043 2.721 5.293 418 3HD2 LEU 51 3HD2 LEU 51 -2.602 2.667 4.483 419 H ASN 52 H ASN 52 1.295 2.653 1.053 420 HA ASN 52 HA ASN 52 2.812 5.110 0.908 421 1HB ASN 52 1HB ASN 52 2.214 3.987 3.464 422 2HB ASN 52 2HB ASN 52 3.925 3.746 3.148 423 1HD2 ASN 52 1HD2 ASN 52 1.727 5.804 4.440 424 2HD2 ASN 52 2HD2 ASN 52 2.621 7.280 4.349 425 H ARG 53 H ARG 53 3.837 4.363 -0.871 426 HA ARG 53 HA ARG 53 4.670 1.945 -1.648 427 1HB ARG 53 1HB ARG 53 5.418 4.626 -2.226 428 2HB ARG 53 2HB ARG 53 6.893 3.673 -2.123 429 1HG ARG 53 1HG ARG 53 6.425 3.340 -4.309 430 2HG ARG 53 2HG ARG 53 5.465 2.022 -3.636 431 1HD ARG 53 1HD ARG 53 4.250 3.365 -5.328 432 2HD ARG 53 2HD ARG 53 3.467 3.345 -3.750 433 HE ARG 53 HE ARG 53 5.155 5.602 -4.609 434 1HH1 ARG 53 1HH1 ARG 53 2.122 4.366 -3.377 435 2HH1 ARG 53 2HH1 ARG 53 1.477 5.939 -3.054 436 1HH2 ARG 53 1HH2 ARG 53 4.294 7.662 -4.187 437 2HH2 ARG 53 2HH2 ARG 53 2.705 7.806 -3.513 438 H ASP 54 H ASP 54 6.073 3.779 0.973 439 HA ASP 54 HA ASP 54 8.251 1.864 1.289 440 1HB ASP 54 1HB ASP 54 7.715 4.615 2.172 441 2HB ASP 54 2HB ASP 54 8.442 3.599 3.413 442 HA PRO 55 HA PRO 55 5.968 -0.426 4.340 443 1HB PRO 55 1HB PRO 55 7.999 -1.793 5.483 444 2HB PRO 55 2HB PRO 55 7.399 -2.168 3.862 445 1HG PRO 55 1HG PRO 55 9.807 -0.588 4.672 446 2HG PRO 55 2HG PRO 55 9.640 -1.790 3.380 447 1HD PRO 55 1HD PRO 55 9.585 0.897 2.933 448 2HD PRO 55 2HD PRO 55 8.718 -0.275 1.919 449 H GLN 56 H GLN 56 9.026 1.024 5.459 450 HA GLN 56 HA GLN 56 8.321 1.113 8.185 451 1HB GLN 56 1HB GLN 56 10.494 2.074 6.506 452 2HB GLN 56 2HB GLN 56 10.105 3.213 7.789 453 1HG GLN 56 1HG GLN 56 10.129 0.693 9.000 454 2HG GLN 56 2HG GLN 56 11.524 0.724 7.922 455 1HE2 GLN 56 1HE2 GLN 56 9.961 3.269 9.823 456 2HE2 GLN 56 2HE2 GLN 56 11.368 3.701 10.728 457 H HIS 57 H HIS 57 7.594 3.207 5.503 458 HA HIS 57 HA HIS 57 6.914 5.514 7.000 459 1HB HIS 57 1HB HIS 57 7.084 4.892 4.311 460 2HB HIS 57 2HB HIS 57 5.359 5.150 4.554 461 HD2 HIS 57 HD2 HIS 57 4.752 7.793 5.633 462 HE1 HIS 57 HE1 HIS 57 8.386 9.430 4.172 463 HE2 HIS 57 HE2 HIS 57 6.134 9.935 5.187 464 H LEU 58 H LEU 58 4.765 3.223 5.344 465 HA LEU 58 HA LEU 58 2.359 3.981 6.319 466 1HB LEU 58 1HB LEU 58 3.223 1.857 4.901 467 2HB LEU 58 2HB LEU 58 2.776 1.063 6.402 468 HG LEU 58 HG LEU 58 0.699 2.877 5.649 469 1HD1 LEU 58 1HD1 LEU 58 1.148 2.804 3.403 470 2HD1 LEU 58 2HD1 LEU 58 0.079 1.412 3.576 471 3HD1 LEU 58 3HD1 LEU 58 1.832 1.186 3.490 472 1HD2 LEU 58 1HD2 LEU 58 -0.463 1.240 6.588 473 2HD2 LEU 58 2HD2 LEU 58 1.009 0.277 6.706 474 3HD2 LEU 58 3HD2 LEU 58 -0.024 0.139 5.283 475 H LEU 59 H LEU 59 4.773 2.087 8.034 476 HA LEU 59 HA LEU 59 3.209 1.349 10.242 477 1HB LEU 59 1HB LEU 59 5.775 0.889 9.411 478 2HB LEU 59 2HB LEU 59 6.029 1.911 10.813 479 HG LEU 59 HG LEU 59 4.109 -0.232 11.308 480 1HD1 LEU 59 1HD1 LEU 59 6.657 -1.504 11.421 481 2HD1 LEU 59 2HD1 LEU 59 6.374 -0.937 9.776 482 3HD1 LEU 59 3HD1 LEU 59 5.205 -2.001 10.555 483 1HD2 LEU 59 1HD2 LEU 59 5.454 1.395 12.869 484 2HD2 LEU 59 2HD2 LEU 59 6.684 0.136 12.754 485 3HD2 LEU 59 3HD2 LEU 59 5.082 -0.252 13.381 486 H LYS 60 H LYS 60 5.568 4.028 9.977 487 HA LYS 60 HA LYS 60 5.038 5.155 12.461 488 1HB LYS 60 1HB LYS 60 6.235 7.046 11.760 489 2HB LYS 60 2HB LYS 60 6.918 5.725 10.826 490 1HG LYS 60 1HG LYS 60 5.065 6.552 9.091 491 2HG LYS 60 2HG LYS 60 5.347 8.067 9.944 492 1HD LYS 60 1HD LYS 60 7.893 7.077 9.519 493 2HD LYS 60 2HD LYS 60 7.034 6.659 8.041 494 1HE LYS 60 1HE LYS 60 8.160 8.880 7.982 495 2HE LYS 60 2HE LYS 60 6.428 8.930 7.655 496 1HZ LYS 60 1HZ LYS 60 6.882 9.226 10.423 497 2HZ LYS 60 2HZ LYS 60 6.157 10.310 9.345 498 3HZ LYS 60 3HZ LYS 60 7.830 10.347 9.582 499 H PHE 61 H PHE 61 3.352 5.561 9.398 500 HA PHE 61 HA PHE 61 1.708 7.726 10.259 501 1HB PHE 61 1HB PHE 61 2.118 6.258 7.849 502 2HB PHE 61 2HB PHE 61 0.394 6.247 8.206 503 HD1 PHE 61 HD1 PHE 61 -0.854 8.358 8.362 504 HD2 PHE 61 HD2 PHE 61 3.241 8.259 7.212 505 HE1 PHE 61 HE1 PHE 61 -1.057 10.636 7.467 506 HE2 PHE 61 HE2 PHE 61 3.048 10.541 6.318 507 HZ PHE 61 HZ PHE 61 0.897 11.734 6.445 508 H LEU 62 H LEU 62 1.310 4.221 10.179 509 HA LEU 62 HA LEU 62 -1.379 4.055 10.834 510 1HB LEU 62 1HB LEU 62 0.303 2.213 10.191 511 2HB LEU 62 2HB LEU 62 0.699 2.158 11.895 512 HG LEU 62 HG LEU 62 -0.950 0.431 11.044 513 1HD1 LEU 62 1HD1 LEU 62 -0.664 0.789 13.391 514 2HD1 LEU 62 2HD1 LEU 62 -2.386 0.634 13.052 515 3HD1 LEU 62 3HD1 LEU 62 -1.688 2.223 13.344 516 1HD2 LEU 62 1HD2 LEU 62 -2.274 1.906 9.623 517 2HD2 LEU 62 2HD2 LEU 62 -2.799 2.812 11.042 518 3HD2 LEU 62 3HD2 LEU 62 -3.276 1.128 10.846 519 H LEU 63 H LEU 63 1.437 4.052 13.043 520 HA LEU 63 HA LEU 63 -0.238 4.175 15.381 521 1HB LEU 63 1HB LEU 63 2.345 3.400 14.917 522 2HB LEU 63 2HB LEU 63 2.579 4.963 15.674 523 HG LEU 63 HG LEU 63 2.697 3.311 17.387 524 1HD1 LEU 63 1HD1 LEU 63 1.547 4.568 18.798 525 2HD1 LEU 63 2HD1 LEU 63 0.019 3.947 18.175 526 3HD1 LEU 63 3HD1 LEU 63 0.773 5.349 17.423 527 1HD2 LEU 63 1HD2 LEU 63 0.486 1.933 17.755 528 2HD2 LEU 63 2HD2 LEU 63 1.747 1.368 16.659 529 3HD2 LEU 63 3HD2 LEU 63 0.317 2.175 16.016 530 H ARG 64 H ARG 64 1.240 6.462 13.243 531 HA ARG 64 HA ARG 64 1.513 8.688 14.889 532 1HB ARG 64 1HB ARG 64 2.073 8.299 12.349 533 2HB ARG 64 2HB ARG 64 0.499 9.026 12.100 534 1HG ARG 64 1HG ARG 64 2.585 10.346 13.794 535 2HG ARG 64 2HG ARG 64 2.555 10.538 12.040 536 1HD ARG 64 1HD ARG 64 0.329 11.233 13.953 537 2HD ARG 64 2HD ARG 64 1.395 12.372 13.137 538 HE ARG 64 HE ARG 64 -0.332 10.590 11.567 539 1HH1 ARG 64 1HH1 ARG 64 0.578 13.828 12.535 540 2HH1 ARG 64 2HH1 ARG 64 -0.350 14.585 11.287 541 1HH2 ARG 64 1HH2 ARG 64 -1.549 11.594 9.942 542 2HH2 ARG 64 2HH2 ARG 64 -1.556 13.322 9.818 543 H GLU 65 H GLU 65 -1.295 7.868 12.833 544 HA GLU 65 HA GLU 65 -2.891 9.901 14.117 545 1HB GLU 65 1HB GLU 65 -3.470 7.843 12.000 546 2HB GLU 65 2HB GLU 65 -4.723 8.892 12.649 547 1HG GLU 65 1HG GLU 65 -2.213 10.084 11.578 548 2HG GLU 65 2HG GLU 65 -3.451 9.521 10.460 549 H LEU 66 H LEU 66 -2.304 6.503 14.499 550 HA LEU 66 HA LEU 66 -4.696 5.777 15.828 551 1HB LEU 66 1HB LEU 66 -2.088 4.589 15.312 552 2HB LEU 66 2HB LEU 66 -2.706 4.154 16.891 553 HG LEU 66 HG LEU 66 -4.775 3.325 15.827 554 1HD1 LEU 66 1HD1 LEU 66 -4.226 4.867 13.747 555 2HD1 LEU 66 2HD1 LEU 66 -5.213 3.411 13.615 556 3HD1 LEU 66 3HD1 LEU 66 -3.511 3.366 13.157 557 1HD2 LEU 66 1HD2 LEU 66 -3.457 1.485 14.430 558 2HD2 LEU 66 2HD2 LEU 66 -3.454 1.529 16.193 559 3HD2 LEU 66 3HD2 LEU 66 -2.096 2.204 15.291 560 H GLY 67 H GLY 67 -5.145 7.452 17.322 561 1HA GLY 67 1HA GLY 67 -3.309 8.209 19.365 562 2HA GLY 67 2HA GLY 67 -5.033 8.554 19.341 563 H THR 68 H THR 68 -5.128 5.402 18.934 564 HA THR 68 HA THR 68 -5.414 4.874 21.787 565 HB THR 68 HB THR 68 -6.769 3.013 21.192 566 HG1 THR 68 HG1 THR 68 -5.601 2.121 19.539 567 1HG2 THR 68 1HG2 THR 68 -8.401 3.940 19.535 568 2HG2 THR 68 2HG2 THR 68 -7.314 5.315 19.341 569 3HG2 THR 68 3HG2 THR 68 -8.046 4.984 20.912 570 H ALA 69 H ALA 69 -4.876 2.576 22.453 571 HA ALA 69 HA ALA 69 -2.253 2.132 22.711 572 1HB ALA 69 1HB ALA 69 -4.205 -0.120 22.302 573 2HB ALA 69 2HB ALA 69 -4.079 0.834 23.781 574 3HB ALA 69 3HB ALA 69 -2.716 -0.149 23.246 575 H GLY 70 H GLY 70 -4.043 0.159 20.326 576 1HA GLY 70 1HA GLY 70 -3.424 -0.317 18.117 577 2HA GLY 70 2HA GLY 70 -1.915 0.547 18.377 578 H ASN 71 H ASN 71 -3.373 -2.467 18.110 579 HA ASN 71 HA ASN 71 -0.865 -3.815 18.468 580 1HB ASN 71 1HB ASN 71 -1.744 -3.637 20.815 581 2HB ASN 71 2HB ASN 71 -3.133 -4.599 20.316 582 1HD2 ASN 71 1HD2 ASN 71 0.384 -4.618 20.499 583 2HD2 ASN 71 2HD2 ASN 71 0.544 -6.323 20.730 584 H LEU 72 H LEU 72 -1.001 -6.114 17.889 585 HA LEU 72 HA LEU 72 -2.886 -6.485 15.738 586 1HB LEU 72 1HB LEU 72 -1.598 -8.300 15.044 587 2HB LEU 72 2HB LEU 72 -0.443 -7.135 15.651 588 HG LEU 72 HG LEU 72 0.376 -9.151 16.442 589 1HD1 LEU 72 1HD1 LEU 72 -1.283 -7.871 18.586 590 2HD1 LEU 72 2HD1 LEU 72 0.457 -7.797 18.330 591 3HD1 LEU 72 3HD1 LEU 72 -0.285 -9.283 18.920 592 1HD2 LEU 72 1HD2 LEU 72 -2.229 -10.073 16.055 593 2HD2 LEU 72 2HD2 LEU 72 -1.875 -10.367 17.758 594 3HD2 LEU 72 3HD2 LEU 72 -0.813 -11.018 16.512 595 H GLU 73 H GLU 73 -4.840 -7.233 16.038 596 HA GLU 73 HA GLU 73 -5.360 -9.081 18.267 597 1HB GLU 73 1HB GLU 73 -6.895 -6.936 16.985 598 2HB GLU 73 2HB GLU 73 -7.823 -8.397 17.267 599 1HG GLU 73 1HG GLU 73 -8.065 -6.863 19.108 600 2HG GLU 73 2HG GLU 73 -7.223 -8.322 19.626 601 H GLY 74 H GLY 74 -6.787 -10.912 17.882 602 1HA GLY 74 1HA GLY 74 -7.313 -12.833 16.724 603 2HA GLY 74 2HA GLY 74 -7.783 -11.736 15.434 604 H GLY 75 H GLY 75 -6.931 -14.024 14.533 605 1HA GLY 75 1HA GLY 75 -4.189 -14.480 14.269 606 2HA GLY 75 2HA GLY 75 -5.412 -15.004 13.121 607 H ARG 76 H ARG 76 -6.191 -12.087 12.775 608 HA ARG 76 HA ARG 76 -4.163 -11.509 10.751 609 1HB ARG 76 1HB ARG 76 -6.762 -10.030 11.112 610 2HB ARG 76 2HB ARG 76 -5.775 -10.162 9.664 611 1HG ARG 76 1HG ARG 76 -7.349 -12.392 10.936 612 2HG ARG 76 2HG ARG 76 -7.802 -11.497 9.483 613 1HD ARG 76 1HD ARG 76 -5.205 -12.376 9.000 614 2HD ARG 76 2HD ARG 76 -5.994 -13.736 9.792 615 HE ARG 76 HE ARG 76 -6.837 -12.485 7.269 616 1HH1 ARG 76 1HH1 ARG 76 -7.005 -15.148 9.536 617 2HH1 ARG 76 2HH1 ARG 76 -7.865 -16.177 8.443 618 1HH2 ARG 76 1HH2 ARG 76 -7.990 -13.828 5.856 619 2HH2 ARG 76 2HH2 ARG 76 -8.424 -15.430 6.353 620 H ALA 77 H ALA 77 -4.696 -8.711 10.552 621 HA ALA 77 HA ALA 77 -3.282 -7.804 12.964 622 1HB ALA 77 1HB ALA 77 -2.513 -5.920 11.558 623 2HB ALA 77 2HB ALA 77 -3.358 -6.644 10.190 624 3HB ALA 77 3HB ALA 77 -2.012 -7.494 10.941 625 H ILE 78 H ILE 78 -5.414 -7.724 14.030 626 HA ILE 78 HA ILE 78 -7.159 -5.559 13.168 627 HB ILE 78 HB ILE 78 -7.400 -7.685 15.281 628 1HG1 ILE 78 1HG1 ILE 78 -9.673 -7.794 13.901 629 2HG1 ILE 78 2HG1 ILE 78 -8.661 -7.047 12.670 630 1HG2 ILE 78 1HG2 ILE 78 -8.276 -5.763 16.391 631 2HG2 ILE 78 2HG2 ILE 78 -9.649 -6.699 15.803 632 3HG2 ILE 78 3HG2 ILE 78 -9.138 -5.250 14.940 633 1HD1 ILE 78 1HD1 ILE 78 -7.398 -8.907 12.394 634 2HD1 ILE 78 2HD1 ILE 78 -8.918 -9.656 12.879 635 3HD1 ILE 78 3HD1 ILE 78 -7.622 -9.449 14.055 636 H LEU 79 H LEU 79 -5.983 -3.721 13.563 637 HA LEU 79 HA LEU 79 -4.987 -3.236 16.271 638 1HB LEU 79 1HB LEU 79 -3.929 -1.250 15.306 639 2HB LEU 79 2HB LEU 79 -3.481 -2.708 14.442 640 HG LEU 79 HG LEU 79 -5.531 -1.966 12.907 641 1HD1 LEU 79 1HD1 LEU 79 -4.772 0.712 12.894 642 2HD1 LEU 79 2HD1 LEU 79 -5.035 0.321 14.592 643 3HD1 LEU 79 3HD1 LEU 79 -6.318 0.044 13.415 644 1HD2 LEU 79 1HD2 LEU 79 -3.559 -2.315 11.802 645 2HD2 LEU 79 2HD2 LEU 79 -2.641 -1.254 12.869 646 3HD2 LEU 79 3HD2 LEU 79 -3.704 -0.566 11.641 647 H GLN 80 H GLN 80 -5.279 -0.720 16.848 648 HA GLN 80 HA GLN 80 -8.039 0.082 16.278 649 1HB GLN 80 1HB GLN 80 -8.123 -1.178 18.382 650 2HB GLN 80 2HB GLN 80 -6.880 -0.134 19.063 651 1HG GLN 80 1HG GLN 80 -8.305 1.649 19.290 652 2HG GLN 80 2HG GLN 80 -9.385 1.085 18.020 653 1HE2 GLN 80 1HE2 GLN 80 -11.270 0.423 18.722 654 2HE2 GLN 80 2HE2 GLN 80 -11.595 -0.305 20.255 655 H GLY 81 H GLY 81 -8.465 2.293 16.504 656 1HA GLY 81 1HA GLY 81 -7.096 4.307 17.626 657 2HA GLY 81 2HA GLY 81 -6.109 3.958 16.221 658 H LYS 82 H LYS 82 -6.463 5.336 14.634 659 HA LYS 82 HA LYS 82 -9.234 6.181 14.108 660 1HB LYS 82 1HB LYS 82 -7.300 7.841 15.073 661 2HB LYS 82 2HB LYS 82 -7.131 8.088 13.339 662 1HG LYS 82 1HG LYS 82 -9.869 8.178 13.786 663 2HG LYS 82 2HG LYS 82 -9.163 9.045 15.152 664 1HD LYS 82 1HD LYS 82 -7.979 10.523 13.684 665 2HD LYS 82 2HD LYS 82 -8.454 9.576 12.272 666 1HE LYS 82 1HE LYS 82 -9.826 11.543 12.386 667 2HE LYS 82 2HE LYS 82 -10.819 10.134 12.753 668 1HZ LYS 82 1HZ LYS 82 -11.443 11.568 14.402 669 2HZ LYS 82 2HZ LYS 82 -9.918 12.289 14.531 670 3HZ LYS 82 3HZ LYS 82 -10.185 10.754 15.190 671 H PHE 83 H PHE 83 -6.451 4.727 12.868 672 HA PHE 83 HA PHE 83 -6.693 5.536 10.133 673 1HB PHE 83 1HB PHE 83 -4.960 3.840 11.711 674 2HB PHE 83 2HB PHE 83 -5.401 3.041 10.214 675 HD1 PHE 83 HD1 PHE 83 -4.131 6.300 11.483 676 HD2 PHE 83 HD2 PHE 83 -4.195 3.472 8.326 677 HE1 PHE 83 HE1 PHE 83 -2.419 7.606 10.285 678 HE2 PHE 83 HE2 PHE 83 -2.491 4.762 7.116 679 HZ PHE 83 HZ PHE 83 -1.598 6.830 8.093 680 H THR 84 H THR 84 -9.229 4.916 10.850 681 HA THR 84 HA THR 84 -9.806 2.182 10.091 682 HB THR 84 HB THR 84 -12.047 2.621 10.712 683 HG1 THR 84 HG1 THR 84 -12.713 4.473 9.940 684 1HG2 THR 84 1HG2 THR 84 -10.563 2.523 12.642 685 2HG2 THR 84 2HG2 THR 84 -11.936 3.594 12.926 686 3HG2 THR 84 3HG2 THR 84 -10.348 4.272 12.563 687 H HIS 85 H HIS 85 -8.810 2.523 7.963 688 HA HIS 85 HA HIS 85 -8.923 2.780 5.697 689 1HB HIS 85 1HB HIS 85 -11.321 1.732 6.512 690 2HB HIS 85 2HB HIS 85 -11.852 3.163 5.644 691 HD2 HIS 85 HD2 HIS 85 -8.942 2.116 3.653 692 HE1 HIS 85 HE1 HIS 85 -12.111 -0.312 2.206 693 HE2 HIS 85 HE2 HIS 85 -9.839 0.662 1.707 694 H PHE 86 H PHE 86 -8.553 5.105 7.292 695 HA PHE 86 HA PHE 86 -10.085 7.188 5.951 696 1HB PHE 86 1HB PHE 86 -8.697 6.977 8.492 697 2HB PHE 86 2HB PHE 86 -8.237 8.439 7.624 698 HD1 PHE 86 HD1 PHE 86 -10.742 6.853 9.616 699 HD2 PHE 86 HD2 PHE 86 -10.082 9.968 6.791 700 HE1 PHE 86 HE1 PHE 86 -12.842 7.926 10.315 701 HE2 PHE 86 HE2 PHE 86 -12.180 11.049 7.488 702 HZ PHE 86 HZ PHE 86 -13.563 10.028 9.251 703 H LEU 87 H LEU 87 -6.711 7.459 6.919 704 HA LEU 87 HA LEU 87 -5.984 8.803 4.542 705 1HB LEU 87 1HB LEU 87 -4.588 7.804 6.959 706 2HB LEU 87 2HB LEU 87 -3.594 8.022 5.534 707 HG LEU 87 HG LEU 87 -3.451 9.992 6.900 708 1HD1 LEU 87 1HD1 LEU 87 -3.331 10.485 4.591 709 2HD1 LEU 87 2HD1 LEU 87 -4.370 11.711 5.319 710 3HD1 LEU 87 3HD1 LEU 87 -5.081 10.383 4.404 711 1HD2 LEU 87 1HD2 LEU 87 -5.890 11.251 6.853 712 2HD2 LEU 87 2HD2 LEU 87 -5.182 10.419 8.235 713 3HD2 LEU 87 3HD2 LEU 87 -6.318 9.572 7.185 714 H ILE 88 H ILE 88 -5.837 5.466 5.581 715 HA ILE 88 HA ILE 88 -4.059 4.436 3.697 716 HB ILE 88 HB ILE 88 -6.514 3.024 4.734 717 1HG1 ILE 88 1HG1 ILE 88 -3.779 3.338 6.015 718 2HG1 ILE 88 2HG1 ILE 88 -5.321 3.900 6.650 719 1HG2 ILE 88 1HG2 ILE 88 -4.602 2.210 2.895 720 2HG2 ILE 88 2HG2 ILE 88 -5.747 1.181 3.757 721 3HG2 ILE 88 3HG2 ILE 88 -4.125 1.429 4.403 722 1HD1 ILE 88 1HD1 ILE 88 -4.283 1.758 7.614 723 2HD1 ILE 88 2HD1 ILE 88 -4.858 0.994 6.135 724 3HD1 ILE 88 3HD1 ILE 88 -6.004 1.766 7.230 725 H ASN 89 H ASN 89 -7.624 4.270 3.527 726 HA ASN 89 HA ASN 89 -7.832 3.359 0.924 727 1HB ASN 89 1HB ASN 89 -9.629 3.918 2.843 728 2HB ASN 89 2HB ASN 89 -9.888 5.310 1.800 729 1HD2 ASN 89 1HD2 ASN 89 -9.402 4.126 -0.677 730 2HD2 ASN 89 2HD2 ASN 89 -10.661 2.990 -1.001 731 H GLU 90 H GLU 90 -7.799 6.725 2.056 732 HA GLU 90 HA GLU 90 -8.185 7.936 -0.440 733 1HB GLU 90 1HB GLU 90 -8.426 9.111 1.703 734 2HB GLU 90 2HB GLU 90 -6.689 9.001 1.957 735 1HG GLU 90 1HG GLU 90 -6.774 10.189 -0.471 736 2HG GLU 90 2HG GLU 90 -8.244 10.824 0.267 737 H ARG 91 H ARG 91 -5.109 7.484 1.338 738 HA ARG 91 HA ARG 91 -3.421 8.448 -0.652 739 1HB ARG 91 1HB ARG 91 -3.136 6.893 1.783 740 2HB ARG 91 2HB ARG 91 -1.991 6.381 0.556 741 1HG ARG 91 1HG ARG 91 -0.713 8.144 0.920 742 2HG ARG 91 2HG ARG 91 -2.071 9.246 0.689 743 1HD ARG 91 1HD ARG 91 -2.667 9.142 2.972 744 2HD ARG 91 2HD ARG 91 -1.636 7.745 3.255 745 HE ARG 91 HE ARG 91 0.196 9.138 3.414 746 1HH1 ARG 91 1HH1 ARG 91 -2.599 10.946 2.360 747 2HH1 ARG 91 2HH1 ARG 91 -1.847 12.486 2.605 748 1HH2 ARG 91 1HH2 ARG 91 1.188 11.156 3.723 749 2HH2 ARG 91 2HH2 ARG 91 0.305 12.607 3.379 750 H ILE 92 H ILE 92 -4.633 5.157 -0.121 751 HA ILE 92 HA ILE 92 -3.180 3.865 -2.118 752 HB ILE 92 HB ILE 92 -5.905 3.288 -0.956 753 1HG1 ILE 92 1HG1 ILE 92 -3.230 1.922 -0.600 754 2HG1 ILE 92 2HG1 ILE 92 -3.942 3.061 0.535 755 1HG2 ILE 92 1HG2 ILE 92 -6.024 1.219 -2.060 756 2HG2 ILE 92 2HG2 ILE 92 -4.363 1.328 -2.632 757 3HG2 ILE 92 3HG2 ILE 92 -5.600 2.375 -3.320 758 1HD1 ILE 92 1HD1 ILE 92 -5.291 0.507 -0.268 759 2HD1 ILE 92 2HD1 ILE 92 -5.671 1.561 1.094 760 3HD1 ILE 92 3HD1 ILE 92 -4.178 0.623 1.091 761 H GLU 93 H GLU 93 -6.518 5.109 -2.284 762 HA GLU 93 HA GLU 93 -7.036 4.623 -4.949 763 1HB GLU 93 1HB GLU 93 -8.668 5.461 -3.235 764 2HB GLU 93 2HB GLU 93 -7.978 7.065 -3.436 765 1HG GLU 93 1HG GLU 93 -9.600 7.338 -4.945 766 2HG GLU 93 2HG GLU 93 -8.543 6.410 -6.008 767 H ASP 94 H ASP 94 -5.029 7.095 -3.551 768 HA ASP 94 HA ASP 94 -4.927 8.720 -5.912 769 1HB ASP 94 1HB ASP 94 -4.533 9.595 -3.607 770 2HB ASP 94 2HB ASP 94 -3.021 8.694 -3.565 771 H TYR 95 H TYR 95 -3.046 6.070 -4.594 772 HA TYR 95 HA TYR 95 -0.958 6.374 -6.584 773 1HB TYR 95 1HB TYR 95 -0.254 5.615 -4.418 774 2HB TYR 95 2HB TYR 95 -1.438 4.313 -4.428 775 HD1 TYR 95 HD1 TYR 95 1.392 5.524 -6.563 776 HD2 TYR 95 HD2 TYR 95 -0.636 2.201 -4.851 777 HE1 TYR 95 HE1 TYR 95 3.078 4.009 -7.518 778 HE2 TYR 95 HE2 TYR 95 1.044 0.677 -5.791 779 HH TYR 95 HH TYR 95 3.132 0.585 -6.732 780 H VAL 96 H VAL 96 -3.222 3.755 -5.716 781 HA VAL 96 HA VAL 96 -2.776 2.198 -7.986 782 HB VAL 96 HB VAL 96 -5.358 2.381 -6.421 783 1HG1 VAL 96 1HG1 VAL 96 -4.219 0.231 -8.202 784 2HG1 VAL 96 2HG1 VAL 96 -5.692 1.167 -8.460 785 3HG1 VAL 96 3HG1 VAL 96 -5.605 0.004 -7.136 786 1HG2 VAL 96 1HG2 VAL 96 -4.458 0.507 -5.098 787 2HG2 VAL 96 2HG2 VAL 96 -3.504 1.979 -4.913 788 3HG2 VAL 96 3HG2 VAL 96 -2.919 0.671 -5.942 789 H ASN 97 H ASN 97 -5.119 4.814 -7.413 790 HA ASN 97 HA ASN 97 -5.837 4.677 -10.263 791 1HB ASN 97 1HB ASN 97 -7.397 6.015 -8.046 792 2HB ASN 97 2HB ASN 97 -7.922 5.767 -9.707 793 1HD2 ASN 97 1HD2 ASN 97 -7.735 3.358 -10.375 794 2HD2 ASN 97 2HD2 ASN 97 -8.423 2.239 -9.251 795 H LYS 98 H LYS 98 -3.465 5.843 -9.792 796 HA LYS 98 HA LYS 98 -3.724 8.696 -9.417 797 1HB LYS 98 1HB LYS 98 -1.692 7.053 -8.934 798 2HB LYS 98 2HB LYS 98 -1.263 7.506 -10.579 799 1HG LYS 98 1HG LYS 98 -1.744 9.933 -9.593 800 2HG LYS 98 2HG LYS 98 -1.260 9.119 -8.106 801 1HD LYS 98 1HD LYS 98 0.637 8.251 -9.863 802 2HD LYS 98 2HD LYS 98 0.333 9.892 -10.440 803 1HE LYS 98 1HE LYS 98 2.013 10.203 -8.871 804 2HE LYS 98 2HE LYS 98 0.547 10.562 -7.959 805 1HZ LYS 98 1HZ LYS 98 1.000 7.839 -7.694 806 2HZ LYS 98 2HZ LYS 98 1.177 9.032 -6.508 807 3HZ LYS 98 3HZ LYS 98 2.500 8.586 -7.460 808 H PHE 99 H PHE 99 -4.439 6.711 -11.962 809 HA PHE 99 HA PHE 99 -3.366 8.323 -14.083 810 1HB PHE 99 1HB PHE 99 -4.786 6.888 -15.559 811 2HB PHE 99 2HB PHE 99 -3.658 6.000 -14.545 812 HD1 PHE 99 HD1 PHE 99 -4.492 4.737 -12.586 813 HD2 PHE 99 HD2 PHE 99 -7.131 6.592 -15.363 814 HE1 PHE 99 HE1 PHE 99 -6.336 3.333 -11.765 815 HE2 PHE 99 HE2 PHE 99 -8.981 5.193 -14.546 816 HZ PHE 99 HZ PHE 99 -8.586 3.562 -12.745 817 H VAL 100 H VAL 100 -6.619 7.830 -12.723 818 HA VAL 100 HA VAL 100 -7.711 9.911 -14.407 819 HB VAL 100 HB VAL 100 -9.095 7.973 -13.876 820 1HG1 VAL 100 1HG1 VAL 100 -9.918 8.522 -11.229 821 2HG1 VAL 100 2HG1 VAL 100 -8.157 8.451 -11.227 822 3HG1 VAL 100 3HG1 VAL 100 -9.093 7.090 -11.842 823 1HG2 VAL 100 1HG2 VAL 100 -10.981 9.192 -13.923 824 2HG2 VAL 100 2HG2 VAL 100 -9.893 10.579 -13.917 825 3HG2 VAL 100 3HG2 VAL 100 -10.605 10.011 -12.407 826 H ILE 101 H ILE 101 -6.601 9.602 -11.090 827 HA ILE 101 HA ILE 101 -7.749 12.119 -10.277 828 HB ILE 101 HB ILE 101 -7.408 10.284 -8.656 829 1HG1 ILE 101 1HG1 ILE 101 -5.998 11.816 -7.000 830 2HG1 ILE 101 2HG1 ILE 101 -6.242 13.000 -8.281 831 1HG2 ILE 101 1HG2 ILE 101 -5.312 9.541 -7.962 832 2HG2 ILE 101 2HG2 ILE 101 -4.483 10.919 -8.688 833 3HG2 ILE 101 3HG2 ILE 101 -5.163 9.658 -9.715 834 1HD1 ILE 101 1HD1 ILE 101 -8.415 13.254 -7.802 835 2HD1 ILE 101 2HD1 ILE 101 -7.939 12.608 -6.232 836 3HD1 ILE 101 3HD1 ILE 101 -8.649 11.543 -7.446 837 H CYS 102 H CYS 102 -4.472 10.925 -10.999 838 HA CYS 102 HA CYS 102 -3.452 13.638 -10.854 839 1HB CYS 102 1HB CYS 102 -2.244 11.603 -9.900 840 2HB CYS 102 2HB CYS 102 -1.837 11.207 -11.566 841 H HIS 103 H HIS 103 -4.911 11.785 -13.168 842 HA HIS 103 HA HIS 103 -5.142 11.951 -15.418 843 1HB HIS 103 1HB HIS 103 -3.724 14.563 -14.895 844 2HB HIS 103 2HB HIS 103 -4.293 14.091 -16.493 845 HD2 HIS 103 HD2 HIS 103 -7.065 12.823 -14.555 846 HE1 HIS 103 HE1 HIS 103 -7.917 16.973 -14.790 847 HE2 HIS 103 HE2 HIS 103 -8.858 14.675 -14.360 848 H GLU 104 H GLU 104 -3.200 10.253 -14.641 849 HA GLU 104 HA GLU 104 -1.211 9.264 -15.155 850 1HB GLU 104 1HB GLU 104 -0.871 8.897 -17.550 851 2HB GLU 104 2HB GLU 104 -2.550 8.669 -17.093 852 1HG GLU 104 1HG GLU 104 -1.799 11.352 -18.068 853 2HG GLU 104 2HG GLU 104 -1.777 10.041 -19.242 854 H CYS 105 H CYS 105 0.006 10.911 -13.989 855 HA CYS 105 HA CYS 105 1.176 13.128 -15.297 856 1HB CYS 105 1HB CYS 105 1.023 12.248 -12.703 857 2HB CYS 105 2HB CYS 105 2.723 11.992 -13.076 858 H ASN 106 H ASN 106 1.641 11.504 -17.228 859 HA ASN 106 HA ASN 106 4.039 9.972 -17.037 860 1HB ASN 106 1HB ASN 106 2.203 10.795 -19.254 861 2HB ASN 106 2HB ASN 106 3.797 10.166 -19.657 862 1HD2 ASN 106 1HD2 ASN 106 3.139 8.270 -20.551 863 2HD2 ASN 106 2HD2 ASN 106 2.366 7.008 -19.659 864 H ARG 107 H ARG 107 3.739 12.307 -19.635 865 HA ARG 107 HA ARG 107 6.296 13.481 -18.792 866 1HB ARG 107 1HB ARG 107 5.011 13.170 -21.498 867 2HB ARG 107 2HB ARG 107 6.369 14.252 -21.231 868 1HG ARG 107 1HG ARG 107 7.228 12.215 -22.089 869 2HG ARG 107 2HG ARG 107 7.661 12.288 -20.380 870 1HD ARG 107 1HD ARG 107 5.096 11.023 -20.754 871 2HD ARG 107 2HD ARG 107 6.338 10.221 -21.707 872 HE ARG 107 HE ARG 107 6.574 10.669 -18.803 873 1HH1 ARG 107 1HH1 ARG 107 6.992 8.636 -21.621 874 2HH1 ARG 107 2HH1 ARG 107 7.692 7.335 -20.721 875 1HH2 ARG 107 1HH2 ARG 107 7.499 8.961 -17.637 876 2HH2 ARG 107 2HH2 ARG 107 7.978 7.517 -18.464 877 HA PRO 108 HA PRO 108 2.831 16.759 -18.277 878 1HB PRO 108 1HB PRO 108 4.586 17.318 -15.941 879 2HB PRO 108 2HB PRO 108 2.823 17.324 -16.050 880 1HG PRO 108 1HG PRO 108 4.141 15.328 -14.855 881 2HG PRO 108 2HG PRO 108 2.664 15.041 -15.792 882 1HD PRO 108 1HD PRO 108 5.494 14.456 -16.493 883 2HD PRO 108 2HD PRO 108 4.006 13.610 -16.952 884 H ASP 109 H ASP 109 3.093 18.786 -19.089 885 HA ASP 109 HA ASP 109 5.722 19.574 -19.974 886 1HB ASP 109 1HB ASP 109 2.984 20.186 -20.668 887 2HB ASP 109 2HB ASP 109 3.910 21.670 -20.470 888 H THR 110 H THR 110 5.128 19.530 -17.073 889 HA THR 110 HA THR 110 5.791 22.324 -16.473 890 HB THR 110 HB THR 110 4.453 20.695 -14.381 891 HG1 THR 110 HG1 THR 110 3.108 21.820 -16.606 892 1HG2 THR 110 1HG2 THR 110 5.212 23.313 -14.537 893 2HG2 THR 110 2HG2 THR 110 4.014 22.656 -13.421 894 3HG2 THR 110 3HG2 THR 110 3.497 23.391 -14.939 895 H ARG 111 H ARG 111 6.696 22.350 -14.067 896 HA ARG 111 HA ARG 111 9.042 20.656 -14.176 897 1HB ARG 111 1HB ARG 111 8.251 22.990 -12.439 898 2HB ARG 111 2HB ARG 111 9.724 22.068 -12.168 899 1HG ARG 111 1HG ARG 111 9.119 23.319 -14.820 900 2HG ARG 111 2HG ARG 111 9.899 24.220 -13.517 901 1HD ARG 111 1HD ARG 111 11.839 23.375 -14.198 902 2HD ARG 111 2HD ARG 111 11.274 21.797 -13.662 903 HE ARG 111 HE ARG 111 10.558 21.341 -15.898 904 1HH1 ARG 111 1HH1 ARG 111 12.481 24.244 -15.559 905 2HH1 ARG 111 2HH1 ARG 111 12.920 24.291 -17.232 906 1HH2 ARG 111 1HH2 ARG 111 11.145 21.405 -18.089 907 2HH2 ARG 111 2HH2 ARG 111 12.162 22.683 -18.669 908 H ILE 112 H ILE 112 8.620 18.646 -13.495 909 HA ILE 112 HA ILE 112 7.199 18.248 -10.961 910 HB ILE 112 HB ILE 112 7.989 16.250 -13.089 911 1HG1 ILE 112 1HG1 ILE 112 6.165 17.820 -13.720 912 2HG1 ILE 112 2HG1 ILE 112 5.628 16.146 -13.617 913 1HG2 ILE 112 1HG2 ILE 112 6.473 15.890 -10.512 914 2HG2 ILE 112 2HG2 ILE 112 8.001 15.140 -10.974 915 3HG2 ILE 112 3HG2 ILE 112 6.513 14.697 -11.810 916 1HD1 ILE 112 1HD1 ILE 112 4.994 18.453 -11.848 917 2HD1 ILE 112 2HD1 ILE 112 4.946 16.816 -11.192 918 3HD1 ILE 112 3HD1 ILE 112 3.922 17.248 -12.562 919 H ILE 113 H ILE 113 8.106 17.038 -9.276 920 HA ILE 113 HA ILE 113 10.913 16.255 -9.507 921 HB ILE 113 HB ILE 113 11.049 17.374 -7.059 922 1HG1 ILE 113 1HG1 ILE 113 9.753 19.638 -8.453 923 2HG1 ILE 113 2HG1 ILE 113 8.661 18.390 -7.861 924 1HG2 ILE 113 1HG2 ILE 113 12.456 19.008 -8.017 925 2HG2 ILE 113 2HG2 ILE 113 11.562 18.995 -9.538 926 3HG2 ILE 113 3HG2 ILE 113 12.548 17.605 -9.081 927 1HD1 ILE 113 1HD1 ILE 113 9.365 20.453 -6.383 928 2HD1 ILE 113 2HD1 ILE 113 10.728 19.402 -6.003 929 3HD1 ILE 113 3HD1 ILE 113 9.082 18.860 -5.687 930 H ARG 114 H ARG 114 11.364 14.428 -8.410 931 HA ARG 114 HA ARG 114 9.388 13.490 -6.431 932 1HB ARG 114 1HB ARG 114 9.580 12.364 -8.835 933 2HB ARG 114 2HB ARG 114 10.909 11.514 -8.060 934 1HG ARG 114 1HG ARG 114 9.271 10.899 -6.233 935 2HG ARG 114 2HG ARG 114 8.007 11.479 -7.317 936 1HD ARG 114 1HD ARG 114 8.418 9.024 -7.434 937 2HD ARG 114 2HD ARG 114 8.580 9.870 -8.973 938 HE ARG 114 HE ARG 114 11.069 9.623 -7.594 939 1HH1 ARG 114 1HH1 ARG 114 8.816 7.932 -9.651 940 2HH1 ARG 114 2HH1 ARG 114 10.022 6.887 -10.321 941 1HH2 ARG 114 1HH2 ARG 114 12.656 8.261 -8.472 942 2HH2 ARG 114 2HH2 ARG 114 12.208 7.074 -9.651 943 H GLU 115 H GLU 115 10.228 13.114 -4.491 944 HA GLU 115 HA GLU 115 13.078 12.392 -4.289 945 1HB GLU 115 1HB GLU 115 12.925 14.657 -3.558 946 2HB GLU 115 2HB GLU 115 11.477 14.329 -2.618 947 1HG GLU 115 1HG GLU 115 12.633 13.471 -0.870 948 2HG GLU 115 2HG GLU 115 13.925 12.836 -1.887 949 H GLY 116 H GLY 116 13.622 10.852 -2.744 950 1HA GLY 116 1HA GLY 116 13.162 9.484 -0.848 951 2HA GLY 116 2HA GLY 116 11.447 9.764 -1.098 952 H ARG 117 H ARG 117 13.462 8.931 -3.812 953 HA ARG 117 HA ARG 117 13.366 7.156 -5.250 954 1HB ARG 117 1HB ARG 117 13.569 5.918 -2.532 955 2HB ARG 117 2HB ARG 117 13.364 4.879 -3.936 956 1HG ARG 117 1HG ARG 117 15.568 6.906 -3.620 957 2HG ARG 117 2HG ARG 117 15.721 5.184 -3.262 958 1HD ARG 117 1HD ARG 117 14.928 4.803 -5.660 959 2HD ARG 117 2HD ARG 117 15.264 6.514 -5.915 960 HE ARG 117 HE ARG 117 17.591 5.782 -4.976 961 1HH1 ARG 117 1HH1 ARG 117 15.548 4.012 -7.197 962 2HH1 ARG 117 2HH1 ARG 117 16.874 3.206 -7.962 963 1HH2 ARG 117 1HH2 ARG 117 19.326 4.722 -5.989 964 2HH2 ARG 117 2HH2 ARG 117 19.017 3.609 -7.280 965 H ILE 118 H ILE 118 11.152 7.967 -5.800 966 HA ILE 118 HA ILE 118 8.980 7.569 -6.353 967 HB ILE 118 HB ILE 118 9.385 4.696 -5.561 968 1HG1 ILE 118 1HG1 ILE 118 10.172 5.894 -8.221 969 2HG1 ILE 118 2HG1 ILE 118 11.326 5.559 -6.934 970 1HG2 ILE 118 1HG2 ILE 118 7.137 5.577 -6.283 971 2HG2 ILE 118 2HG2 ILE 118 7.762 4.214 -7.212 972 3HG2 ILE 118 3HG2 ILE 118 7.848 5.846 -7.875 973 1HD1 ILE 118 1HD1 ILE 118 10.240 3.795 -8.905 974 2HD1 ILE 118 2HD1 ILE 118 9.870 3.199 -7.287 975 3HD1 ILE 118 3HD1 ILE 118 11.542 3.519 -7.749 976 H SER 119 H SER 119 9.020 8.743 -4.021 977 HA SER 119 HA SER 119 6.945 7.352 -2.500 978 1HB SER 119 1HB SER 119 9.203 6.917 -1.448 979 2HB SER 119 2HB SER 119 9.287 8.640 -1.096 980 HG SER 119 HG SER 119 7.971 6.698 0.222 981 H LEU 120 H LEU 120 8.712 10.368 -3.083 982 HA LEU 120 HA LEU 120 6.237 11.821 -2.425 983 1HB LEU 120 1HB LEU 120 9.064 12.648 -1.759 984 2HB LEU 120 2HB LEU 120 7.676 13.706 -1.628 985 HG LEU 120 HG LEU 120 6.773 11.750 -0.074 986 1HD1 LEU 120 1HD1 LEU 120 8.658 10.267 -0.409 987 2HD1 LEU 120 2HD1 LEU 120 8.598 10.808 1.268 988 3HD1 LEU 120 3HD1 LEU 120 9.769 11.514 0.154 989 1HD2 LEU 120 1HD2 LEU 120 7.540 14.262 0.344 990 2HD2 LEU 120 2HD2 LEU 120 8.827 13.443 1.231 991 3HD2 LEU 120 3HD2 LEU 120 7.141 13.164 1.666 992 H LEU 121 H LEU 121 5.895 13.801 -3.615 993 HA LEU 121 HA LEU 121 7.639 14.680 -5.648 994 1HB LEU 121 1HB LEU 121 6.049 14.033 -7.566 995 2HB LEU 121 2HB LEU 121 7.183 12.842 -6.971 996 HG LEU 121 HG LEU 121 4.578 12.724 -5.635 997 1HD1 LEU 121 1HD1 LEU 121 4.412 13.256 -8.328 998 2HD1 LEU 121 2HD1 LEU 121 3.185 12.445 -7.357 999 3HD1 LEU 121 3HD1 LEU 121 4.360 11.495 -8.265 1000 1HD2 LEU 121 1HD2 LEU 121 6.400 11.041 -5.439 1001 2HD2 LEU 121 2HD2 LEU 121 6.152 10.637 -7.135 1002 3HD2 LEU 121 3HD2 LEU 121 4.862 10.363 -5.965 1003 H LYS 122 H LYS 122 6.650 16.343 -7.045 1004 HA LYS 122 HA LYS 122 4.379 17.633 -5.682 1005 1HB LYS 122 1HB LYS 122 6.526 18.825 -5.469 1006 2HB LYS 122 2HB LYS 122 6.637 18.918 -7.219 1007 1HG LYS 122 1HG LYS 122 4.217 20.037 -6.831 1008 2HG LYS 122 2HG LYS 122 5.035 20.504 -5.336 1009 1HD LYS 122 1HD LYS 122 6.981 21.188 -6.910 1010 2HD LYS 122 2HD LYS 122 5.748 21.163 -8.171 1011 1HE LYS 122 1HE LYS 122 6.174 23.397 -7.086 1012 2HE LYS 122 2HE LYS 122 4.501 22.861 -7.109 1013 1HZ LYS 122 1HZ LYS 122 6.058 22.147 -4.764 1014 2HZ LYS 122 2HZ LYS 122 4.441 22.629 -4.884 1015 3HZ LYS 122 3HZ LYS 122 5.673 23.786 -4.943 1016 H CYS 123 H CYS 123 2.724 18.537 -6.919 1017 HA CYS 123 HA CYS 123 2.874 18.246 -9.835 1018 1HB CYS 123 1HB CYS 123 0.775 17.029 -8.047 1019 2HB CYS 123 2HB CYS 123 0.453 17.387 -9.735 1020 H GLU 124 H GLU 124 3.158 20.654 -8.673 1021 HA GLU 124 HA GLU 124 0.874 22.098 -8.020 1022 1HB GLU 124 1HB GLU 124 3.025 23.044 -7.621 1023 2HB GLU 124 2HB GLU 124 3.449 22.976 -9.325 1024 1HG GLU 124 1HG GLU 124 1.080 24.523 -9.048 1025 2HG GLU 124 2HG GLU 124 2.261 25.087 -7.868 1026 H ALA 125 H ALA 125 2.003 20.994 -11.101 1027 HA ALA 125 HA ALA 125 0.508 22.794 -12.724 1028 1HB ALA 125 1HB ALA 125 0.885 21.054 -14.504 1029 2HB ALA 125 2HB ALA 125 1.719 20.095 -13.282 1030 3HB ALA 125 3HB ALA 125 2.341 21.679 -13.736 1031 H CYS 126 H CYS 126 0.037 19.290 -12.480 1032 HA CYS 126 HA CYS 126 -2.766 19.551 -13.086 1033 1HB CYS 126 1HB CYS 126 -2.768 17.084 -12.968 1034 2HB CYS 126 2HB CYS 126 -1.489 17.695 -14.013 1035 H GLY 127 H GLY 127 -2.230 20.897 -10.715 1036 1HA GLY 127 1HA GLY 127 -3.888 20.876 -8.905 1037 2HA GLY 127 2HA GLY 127 -3.570 19.155 -8.744 1038 H ALA 128 H ALA 128 -2.392 18.659 -7.034 1039 HA ALA 128 HA ALA 128 -0.021 20.195 -6.388 1040 1HB ALA 128 1HB ALA 128 -2.432 20.727 -5.027 1041 2HB ALA 128 2HB ALA 128 -0.816 21.325 -4.650 1042 3HB ALA 128 3HB ALA 128 -1.400 19.836 -3.907 1043 H LYS 129 H LYS 129 1.438 19.092 -5.037 1044 HA LYS 129 HA LYS 129 0.775 16.459 -4.052 1045 1HB LYS 129 1HB LYS 129 1.520 16.417 -6.592 1046 2HB LYS 129 2HB LYS 129 3.120 16.529 -5.894 1047 1HG LYS 129 1HG LYS 129 2.489 14.228 -6.355 1048 2HG LYS 129 2HG LYS 129 2.749 14.499 -4.631 1049 1HD LYS 129 1HD LYS 129 0.782 13.144 -4.941 1050 2HD LYS 129 2HD LYS 129 0.298 14.733 -4.348 1051 1HE LYS 129 1HE LYS 129 -0.991 15.050 -6.132 1052 2HE LYS 129 2HE LYS 129 0.372 14.755 -7.212 1053 1HZ LYS 129 1HZ LYS 129 -0.072 12.433 -7.182 1054 2HZ LYS 129 2HZ LYS 129 -1.531 13.219 -7.524 1055 3HZ LYS 129 3HZ LYS 129 -1.246 12.601 -5.975 1056 H ALA 130 H ALA 130 2.424 15.583 -2.657 1057 HA ALA 130 HA ALA 130 4.005 17.704 -1.427 1058 1HB ALA 130 1HB ALA 130 3.857 16.556 0.532 1059 2HB ALA 130 2HB ALA 130 3.887 14.980 -0.260 1060 3HB ALA 130 3HB ALA 130 2.410 15.944 -0.270 1061 HA PRO 131 HA PRO 131 7.480 15.775 -3.696 1062 1HB PRO 131 1HB PRO 131 9.113 17.943 -3.492 1063 2HB PRO 131 2HB PRO 131 7.893 17.752 -4.754 1064 1HG PRO 131 1HG PRO 131 7.775 19.354 -2.236 1065 2HG PRO 131 2HG PRO 131 7.179 19.760 -3.852 1066 1HD PRO 131 1HD PRO 131 5.566 18.887 -1.848 1067 2HD PRO 131 2HD PRO 131 5.236 18.585 -3.564 1068 H LEU 132 H LEU 132 7.517 17.483 -0.598 1069 HA LEU 132 HA LEU 132 9.104 15.451 0.602 1070 1HB LEU 132 1HB LEU 132 11.063 16.814 1.190 1071 2HB LEU 132 2HB LEU 132 10.927 16.535 -0.533 1072 HG LEU 132 HG LEU 132 10.006 19.096 0.755 1073 1HD1 LEU 132 1HD1 LEU 132 12.146 19.514 1.207 1074 2HD1 LEU 132 2HD1 LEU 132 12.337 19.697 -0.536 1075 3HD1 LEU 132 3HD1 LEU 132 12.715 18.157 0.236 1076 1HD2 LEU 132 1HD2 LEU 132 10.310 19.951 -1.543 1077 2HD2 LEU 132 2HD2 LEU 132 9.098 18.681 -1.434 1078 3HD2 LEU 132 3HD2 LEU 132 10.697 18.315 -2.071 1079 H LYS 133 H LYS 133 8.237 18.895 0.929 1080 HA LYS 133 HA LYS 133 6.450 18.727 2.958 1081 1HB LYS 133 1HB LYS 133 9.010 18.002 3.982 1082 2HB LYS 133 2HB LYS 133 8.579 19.557 4.674 1083 1HG LYS 133 1HG LYS 133 6.645 18.708 5.678 1084 2HG LYS 133 2HG LYS 133 6.669 17.248 4.687 1085 1HD LYS 133 1HD LYS 133 7.737 16.230 6.356 1086 2HD LYS 133 2HD LYS 133 9.124 17.267 6.017 1087 1HE LYS 133 1HE LYS 133 6.871 17.876 7.927 1088 2HE LYS 133 2HE LYS 133 8.502 17.377 8.372 1089 1HZ LYS 133 1HZ LYS 133 8.780 19.578 6.714 1090 2HZ LYS 133 2HZ LYS 133 9.051 19.509 8.381 1091 3HZ LYS 133 3HZ LYS 133 7.534 19.969 7.791 1092 H ASN 134 H ASN 134 5.986 20.482 1.441 1093 HA ASN 134 HA ASN 134 5.765 22.681 0.912 1094 1HB ASN 134 1HB ASN 134 6.846 23.036 3.715 1095 2HB ASN 134 2HB ASN 134 6.096 24.310 2.757 1096 1HD2 ASN 134 1HD2 ASN 134 4.673 24.409 4.640 1097 2HD2 ASN 134 2HD2 ASN 134 3.305 23.356 4.699 1098 H VAL 135 H VAL 135 7.905 21.709 -0.302 1099 HA VAL 135 HA VAL 135 9.732 23.983 -0.275 1100 HB VAL 135 HB VAL 135 10.845 21.181 -0.290 1101 1HG1 VAL 135 1HG1 VAL 135 12.758 23.068 0.503 1102 2HG1 VAL 135 2HG1 VAL 135 11.915 23.781 -0.873 1103 3HG1 VAL 135 3HG1 VAL 135 12.674 22.197 -1.027 1104 1HG2 VAL 135 1HG2 VAL 135 10.343 23.046 1.984 1105 2HG2 VAL 135 2HG2 VAL 135 11.764 22.000 2.011 1106 3HG2 VAL 135 3HG2 VAL 135 10.152 21.295 1.901 Start of MODEL 7 1 H MET 1 H MET 1 -3.941 -11.496 -14.860 2 HA MET 1 HA MET 1 -5.711 -12.611 -16.927 3 1HB MET 1 1HB MET 1 -6.048 -12.011 -14.023 4 2HB MET 1 2HB MET 1 -7.392 -11.655 -15.100 5 1HG MET 1 1HG MET 1 -7.993 -13.765 -14.713 6 2HG MET 1 2HG MET 1 -6.738 -14.171 -15.881 7 1HE MET 1 1HE MET 1 -8.163 -14.144 -12.662 8 2HE MET 1 2HE MET 1 -6.862 -14.141 -11.470 9 3HE MET 1 3HE MET 1 -7.513 -15.670 -12.061 10 H ASP 2 H ASP 2 -4.004 -10.621 -17.627 11 HA ASP 2 HA ASP 2 -5.793 -8.297 -17.748 12 1HB ASP 2 1HB ASP 2 -2.826 -8.211 -17.165 13 2HB ASP 2 2HB ASP 2 -3.801 -6.799 -17.561 14 H ASP 3 H ASP 3 -4.521 -6.648 -19.389 15 HA ASP 3 HA ASP 3 -4.768 -7.880 -21.914 16 1HB ASP 3 1HB ASP 3 -3.594 -5.208 -21.120 17 2HB ASP 3 2HB ASP 3 -3.867 -5.706 -22.787 18 H TYR 4 H TYR 4 -1.852 -6.050 -21.090 19 HA TYR 4 HA TYR 4 -0.020 -8.153 -21.062 20 1HB TYR 4 1HB TYR 4 -0.932 -8.248 -23.494 21 2HB TYR 4 2HB TYR 4 0.051 -6.811 -23.751 22 HD1 TYR 4 HD1 TYR 4 0.640 -9.992 -21.873 23 HD2 TYR 4 HD2 TYR 4 1.938 -7.362 -24.955 24 HE1 TYR 4 HE1 TYR 4 2.611 -11.415 -22.249 25 HE2 TYR 4 HE2 TYR 4 3.912 -8.778 -25.341 26 HH TYR 4 HH TYR 4 5.192 -10.705 -23.444 27 H GLU 5 H GLU 5 0.098 -6.229 -19.423 28 HA GLU 5 HA GLU 5 1.594 -3.953 -20.398 29 1HB GLU 5 1HB GLU 5 -0.134 -3.827 -18.556 30 2HB GLU 5 2HB GLU 5 1.014 -4.673 -17.526 31 1HG GLU 5 1HG GLU 5 2.627 -2.851 -17.859 32 2HG GLU 5 2HG GLU 5 1.435 -1.997 -18.836 33 H LYS 6 H LYS 6 3.730 -3.695 -20.348 34 HA LYS 6 HA LYS 6 5.384 -5.919 -19.543 35 1HB LYS 6 1HB LYS 6 7.253 -4.435 -20.383 36 2HB LYS 6 2HB LYS 6 6.037 -4.876 -21.571 37 1HG LYS 6 1HG LYS 6 4.950 -2.657 -21.150 38 2HG LYS 6 2HG LYS 6 6.347 -2.239 -20.158 39 1HD LYS 6 1HD LYS 6 7.522 -1.697 -21.969 40 2HD LYS 6 2HD LYS 6 7.229 -3.284 -22.680 41 1HE LYS 6 1HE LYS 6 6.309 -1.836 -24.242 42 2HE LYS 6 2HE LYS 6 4.910 -2.331 -23.291 43 1HZ LYS 6 1HZ LYS 6 5.507 0.206 -23.833 44 2HZ LYS 6 2HZ LYS 6 6.296 0.037 -22.346 45 3HZ LYS 6 3HZ LYS 6 4.638 -0.274 -22.463 46 H LEU 7 H LEU 7 7.124 -5.801 -18.048 47 HA LEU 7 HA LEU 7 6.830 -3.674 -16.027 48 1HB LEU 7 1HB LEU 7 5.979 -5.969 -15.361 49 2HB LEU 7 2HB LEU 7 7.644 -6.514 -15.439 50 HG LEU 7 HG LEU 7 7.931 -4.391 -13.793 51 1HD1 LEU 7 1HD1 LEU 7 5.263 -5.553 -13.032 52 2HD1 LEU 7 2HD1 LEU 7 5.452 -4.017 -13.877 53 3HD1 LEU 7 3HD1 LEU 7 6.125 -4.223 -12.259 54 1HD2 LEU 7 1HD2 LEU 7 7.701 -7.277 -13.511 55 2HD2 LEU 7 2HD2 LEU 7 7.280 -6.412 -12.033 56 3HD2 LEU 7 3HD2 LEU 7 8.854 -6.156 -12.786 57 H LEU 8 H LEU 8 8.577 -2.458 -15.863 58 HA LEU 8 HA LEU 8 11.034 -3.109 -17.120 59 1HB LEU 8 1HB LEU 8 9.976 -0.796 -16.533 60 2HB LEU 8 2HB LEU 8 10.798 -1.009 -14.999 61 HG LEU 8 HG LEU 8 12.632 -1.516 -17.160 62 1HD1 LEU 8 1HD1 LEU 8 11.783 -0.083 -18.675 63 2HD1 LEU 8 2HD1 LEU 8 12.545 1.130 -17.647 64 3HD1 LEU 8 3HD1 LEU 8 10.823 0.786 -17.479 65 1HD2 LEU 8 1HD2 LEU 8 12.418 0.276 -14.787 66 2HD2 LEU 8 2HD2 LEU 8 13.663 0.594 -15.995 67 3HD2 LEU 8 3HD2 LEU 8 13.618 -0.961 -15.164 68 H GLU 9 H GLU 9 12.678 -4.268 -16.396 69 HA GLU 9 HA GLU 9 12.723 -5.030 -13.571 70 1HB GLU 9 1HB GLU 9 13.886 -6.237 -16.062 71 2HB GLU 9 2HB GLU 9 14.506 -6.685 -14.479 72 1HG GLU 9 1HG GLU 9 11.646 -6.819 -14.468 73 2HG GLU 9 2HG GLU 9 12.287 -7.740 -15.829 74 H ARG 10 H ARG 10 14.314 -3.010 -15.812 75 HA ARG 10 HA ARG 10 16.913 -3.013 -14.674 76 1HB ARG 10 1HB ARG 10 16.470 -2.172 -16.940 77 2HB ARG 10 2HB ARG 10 15.512 -0.860 -16.271 78 1HG ARG 10 1HG ARG 10 17.459 0.253 -16.550 79 2HG ARG 10 2HG ARG 10 17.772 -0.410 -14.944 80 1HD ARG 10 1HD ARG 10 19.660 -0.692 -16.542 81 2HD ARG 10 2HD ARG 10 19.056 -2.203 -15.865 82 HE ARG 10 HE ARG 10 18.134 -1.310 -18.506 83 1HH1 ARG 10 1HH1 ARG 10 19.859 -3.632 -16.539 84 2HH1 ARG 10 2HH1 ARG 10 19.933 -4.818 -17.796 85 1HH2 ARG 10 1HH2 ARG 10 18.243 -2.875 -20.153 86 2HH2 ARG 10 2HH2 ARG 10 19.021 -4.391 -19.842 87 H ALA 11 H ALA 11 17.096 -2.632 -12.551 88 HA ALA 11 HA ALA 11 17.051 -1.556 -10.555 89 1HB ALA 11 1HB ALA 11 16.403 1.103 -11.244 90 2HB ALA 11 2HB ALA 11 17.393 0.450 -12.549 91 3HB ALA 11 3HB ALA 11 17.991 0.423 -10.890 92 H ILE 12 H ILE 12 15.182 -2.645 -9.853 93 HA ILE 12 HA ILE 12 12.684 -1.098 -10.005 94 HB ILE 12 HB ILE 12 12.817 -3.917 -8.990 95 1HG1 ILE 12 1HG1 ILE 12 12.101 -3.484 -11.840 96 2HG1 ILE 12 2HG1 ILE 12 13.813 -3.419 -11.439 97 1HG2 ILE 12 1HG2 ILE 12 10.749 -2.822 -8.594 98 2HG2 ILE 12 2HG2 ILE 12 10.492 -3.927 -9.944 99 3HG2 ILE 12 3HG2 ILE 12 10.687 -2.200 -10.243 100 1HD1 ILE 12 1HD1 ILE 12 13.841 -5.621 -11.603 101 2HD1 ILE 12 2HD1 ILE 12 12.083 -5.691 -11.724 102 3HD1 ILE 12 3HD1 ILE 12 12.858 -5.683 -10.139 103 H ASP 13 H ASP 13 15.105 -2.365 -7.885 104 HA ASP 13 HA ASP 13 14.434 -0.680 -5.756 105 1HB ASP 13 1HB ASP 13 12.505 -2.363 -5.683 106 2HB ASP 13 2HB ASP 13 13.699 -3.538 -5.142 107 H GLN 14 H GLN 14 15.631 -4.009 -6.251 108 HA GLN 14 HA GLN 14 17.671 -3.777 -4.291 109 1HB GLN 14 1HB GLN 14 16.719 -5.794 -6.172 110 2HB GLN 14 2HB GLN 14 18.462 -5.845 -5.945 111 1HG GLN 14 1HG GLN 14 17.830 -7.229 -4.262 112 2HG GLN 14 2HG GLN 14 17.775 -5.692 -3.399 113 1HE2 GLN 14 1HE2 GLN 14 15.537 -4.549 -3.825 114 2HE2 GLN 14 2HE2 GLN 14 14.166 -5.550 -3.505 115 H LEU 15 H LEU 15 17.724 -3.579 -7.837 116 HA LEU 15 HA LEU 15 20.455 -3.327 -8.285 117 1HB LEU 15 1HB LEU 15 18.179 -3.205 -9.794 118 2HB LEU 15 2HB LEU 15 18.720 -1.543 -9.864 119 HG LEU 15 HG LEU 15 21.014 -2.947 -10.477 120 1HD1 LEU 15 1HD1 LEU 15 18.657 -4.547 -11.207 121 2HD1 LEU 15 2HD1 LEU 15 20.333 -5.034 -10.959 122 3HD1 LEU 15 3HD1 LEU 15 19.846 -4.299 -12.486 123 1HD2 LEU 15 1HD2 LEU 15 18.972 -1.383 -11.919 124 2HD2 LEU 15 2HD2 LEU 15 20.069 -2.342 -12.914 125 3HD2 LEU 15 3HD2 LEU 15 20.714 -1.138 -11.798 126 HA PRO 16 HA PRO 16 21.995 0.484 -6.559 127 1HB PRO 16 1HB PRO 16 22.929 1.677 -8.944 128 2HB PRO 16 2HB PRO 16 23.861 0.666 -7.836 129 1HG PRO 16 1HG PRO 16 22.433 -0.088 -10.349 130 2HG PRO 16 2HG PRO 16 23.990 -0.669 -9.723 131 1HD PRO 16 1HD PRO 16 21.860 -2.209 -9.513 132 2HD PRO 16 2HD PRO 16 22.951 -2.054 -8.124 133 HA PRO 17 HA PRO 17 19.225 3.879 -7.066 134 1HB PRO 17 1HB PRO 17 20.831 6.041 -7.695 135 2HB PRO 17 2HB PRO 17 20.566 5.420 -6.063 136 1HG PRO 17 1HG PRO 17 22.844 4.925 -7.935 137 2HG PRO 17 2HG PRO 17 22.869 5.195 -6.183 138 1HD PRO 17 1HD PRO 17 23.136 2.743 -7.219 139 2HD PRO 17 2HD PRO 17 22.236 3.013 -5.712 140 H GLU 18 H GLU 18 21.576 5.106 -9.419 141 HA GLU 18 HA GLU 18 21.403 5.622 -11.626 142 1HB GLU 18 1HB GLU 18 20.717 3.036 -11.505 143 2HB GLU 18 2HB GLU 18 19.192 3.686 -12.090 144 1HG GLU 18 1HG GLU 18 20.330 4.684 -13.993 145 2HG GLU 18 2HG GLU 18 21.875 4.079 -13.398 146 H VAL 19 H VAL 19 19.898 6.509 -13.304 147 HA VAL 19 HA VAL 19 17.883 8.135 -11.980 148 HB VAL 19 HB VAL 19 17.687 9.157 -14.350 149 1HG1 VAL 19 1HG1 VAL 19 18.905 10.020 -12.247 150 2HG1 VAL 19 2HG1 VAL 19 19.299 10.739 -13.809 151 3HG1 VAL 19 3HG1 VAL 19 20.377 9.542 -13.091 152 1HG2 VAL 19 1HG2 VAL 19 19.429 8.809 -15.879 153 2HG2 VAL 19 2HG2 VAL 19 18.972 7.190 -15.354 154 3HG2 VAL 19 3HG2 VAL 19 20.418 7.954 -14.695 155 H PHE 20 H PHE 20 15.941 7.296 -11.751 156 HA PHE 20 HA PHE 20 14.813 5.687 -13.935 157 1HB PHE 20 1HB PHE 20 13.473 4.519 -12.338 158 2HB PHE 20 2HB PHE 20 15.121 4.536 -11.728 159 HD1 PHE 20 HD1 PHE 20 15.504 6.900 -10.276 160 HD2 PHE 20 HD2 PHE 20 11.907 4.663 -10.689 161 HE1 PHE 20 HE1 PHE 20 14.694 7.821 -8.148 162 HE2 PHE 20 HE2 PHE 20 11.091 5.582 -8.557 163 HZ PHE 20 HZ PHE 20 12.482 7.162 -7.285 164 H GLU 21 H GLU 21 12.716 6.048 -14.635 165 HA GLU 21 HA GLU 21 11.188 8.242 -13.513 166 1HB GLU 21 1HB GLU 21 10.957 9.236 -15.879 167 2HB GLU 21 2HB GLU 21 12.415 9.591 -14.964 168 1HG GLU 21 1HG GLU 21 13.691 8.722 -16.545 169 2HG GLU 21 2HG GLU 21 12.791 7.206 -16.508 170 H THR 22 H THR 22 11.479 5.712 -15.961 171 HA THR 22 HA THR 22 8.566 5.620 -16.235 172 HB THR 22 HB THR 22 9.737 5.585 -18.332 173 HG1 THR 22 HG1 THR 22 9.070 3.515 -19.113 174 1HG2 THR 22 1HG2 THR 22 11.431 3.522 -17.032 175 2HG2 THR 22 2HG2 THR 22 11.886 4.874 -18.069 176 3HG2 THR 22 3HG2 THR 22 11.153 3.431 -18.770 177 H LYS 23 H LYS 23 8.469 4.832 -13.963 178 HA LYS 23 HA LYS 23 9.234 2.026 -13.660 179 1HB LYS 23 1HB LYS 23 8.557 2.362 -11.265 180 2HB LYS 23 2HB LYS 23 9.909 3.348 -11.799 181 1HG LYS 23 1HG LYS 23 7.920 5.073 -12.264 182 2HG LYS 23 2HG LYS 23 7.191 4.140 -10.956 183 1HD LYS 23 1HD LYS 23 8.325 5.492 -9.579 184 2HD LYS 23 2HD LYS 23 9.752 4.565 -10.049 185 1HE LYS 23 1HE LYS 23 10.311 6.845 -10.345 186 2HE LYS 23 2HE LYS 23 10.031 6.190 -11.957 187 1HZ LYS 23 1HZ LYS 23 7.956 7.247 -12.088 188 2HZ LYS 23 2HZ LYS 23 9.000 8.417 -11.455 189 3HZ LYS 23 3HZ LYS 23 7.924 7.605 -10.434 190 H ARG 24 H ARG 24 7.798 0.388 -13.347 191 HA ARG 24 HA ARG 24 5.123 0.834 -14.304 192 1HB ARG 24 1HB ARG 24 6.902 -1.429 -13.935 193 2HB ARG 24 2HB ARG 24 5.278 -1.794 -13.370 194 1HG ARG 24 1HG ARG 24 5.292 -2.455 -15.606 195 2HG ARG 24 2HG ARG 24 4.475 -0.890 -15.610 196 1HD ARG 24 1HD ARG 24 7.415 -0.898 -15.991 197 2HD ARG 24 2HD ARG 24 6.424 -1.492 -17.321 198 HE ARG 24 HE ARG 24 6.804 1.198 -16.618 199 1HH1 ARG 24 1HH1 ARG 24 4.261 -1.001 -17.549 200 2HH1 ARG 24 2HH1 ARG 24 3.284 0.233 -18.269 201 1HH2 ARG 24 1HH2 ARG 24 5.525 2.825 -17.573 202 2HH2 ARG 24 2HH2 ARG 24 4.005 2.405 -18.289 203 H PHE 25 H PHE 25 4.237 2.164 -12.674 204 HA PHE 25 HA PHE 25 3.944 1.038 -10.001 205 1HB PHE 25 1HB PHE 25 4.490 3.493 -10.488 206 2HB PHE 25 2HB PHE 25 2.806 3.654 -10.973 207 HD1 PHE 25 HD1 PHE 25 5.089 3.766 -8.273 208 HD2 PHE 25 HD2 PHE 25 1.033 2.925 -9.246 209 HE1 PHE 25 HE1 PHE 25 4.453 4.134 -5.925 210 HE2 PHE 25 HE2 PHE 25 0.389 3.291 -6.900 211 HZ PHE 25 HZ PHE 25 2.101 3.898 -5.236 212 H GLU 26 H GLU 26 2.518 -0.652 -10.254 213 HA GLU 26 HA GLU 26 -0.252 0.127 -10.832 214 1HB GLU 26 1HB GLU 26 1.394 -1.763 -12.314 215 2HB GLU 26 2HB GLU 26 -0.071 -2.516 -11.701 216 1HG GLU 26 1HG GLU 26 -0.198 0.089 -13.163 217 2HG GLU 26 2HG GLU 26 -0.080 -1.433 -14.042 218 H VAL 27 H VAL 27 -1.726 -0.672 -9.431 219 HA VAL 27 HA VAL 27 -1.114 -2.967 -7.750 220 HB VAL 27 HB VAL 27 -1.789 -0.283 -6.523 221 1HG1 VAL 27 1HG1 VAL 27 -1.840 -3.043 -5.495 222 2HG1 VAL 27 2HG1 VAL 27 -2.744 -1.621 -4.980 223 3HG1 VAL 27 3HG1 VAL 27 -1.079 -1.849 -4.447 224 1HG2 VAL 27 1HG2 VAL 27 0.541 -1.154 -5.362 225 2HG2 VAL 27 2HG2 VAL 27 0.414 0.072 -6.621 226 3HG2 VAL 27 3HG2 VAL 27 0.754 -1.602 -7.050 227 HA PRO 28 HA PRO 28 -5.404 -3.696 -8.665 228 1HB PRO 28 1HB PRO 28 -5.262 -5.227 -6.100 229 2HB PRO 28 2HB PRO 28 -5.859 -5.737 -7.681 230 1HG PRO 28 1HG PRO 28 -3.501 -6.573 -6.817 231 2HG PRO 28 2HG PRO 28 -3.710 -6.090 -8.512 232 1HD PRO 28 1HD PRO 28 -2.447 -4.590 -6.255 233 2HD PRO 28 2HD PRO 28 -1.936 -4.713 -7.950 234 H LYS 29 H LYS 29 -6.047 -4.208 -5.345 235 HA LYS 29 HA LYS 29 -6.526 -1.545 -4.522 236 1HB LYS 29 1HB LYS 29 -8.416 -2.329 -6.296 237 2HB LYS 29 2HB LYS 29 -9.134 -2.918 -4.802 238 1HG LYS 29 1HG LYS 29 -9.582 -0.851 -4.041 239 2HG LYS 29 2HG LYS 29 -8.095 -0.170 -4.702 240 1HD LYS 29 1HD LYS 29 -10.485 -0.927 -6.377 241 2HD LYS 29 2HD LYS 29 -10.206 0.694 -5.739 242 1HE LYS 29 1HE LYS 29 -8.128 -0.713 -7.379 243 2HE LYS 29 2HE LYS 29 -9.446 0.177 -8.141 244 1HZ LYS 29 1HZ LYS 29 -7.462 1.293 -6.233 245 2HZ LYS 29 2HZ LYS 29 -8.747 2.153 -6.917 246 3HZ LYS 29 3HZ LYS 29 -7.503 1.568 -7.902 247 H ALA 30 H ALA 30 -6.771 -1.485 -2.334 248 HA ALA 30 HA ALA 30 -7.898 -3.675 -0.863 249 1HB ALA 30 1HB ALA 30 -6.087 -4.879 -0.448 250 2HB ALA 30 2HB ALA 30 -5.316 -3.473 0.275 251 3HB ALA 30 3HB ALA 30 -5.122 -3.790 -1.444 252 H TYR 31 H TYR 31 -8.126 -3.250 1.374 253 HA TYR 31 HA TYR 31 -7.138 -0.854 2.572 254 1HB TYR 31 1HB TYR 31 -9.281 0.309 2.811 255 2HB TYR 31 2HB TYR 31 -8.865 0.120 1.110 256 HD1 TYR 31 HD1 TYR 31 -9.793 -2.273 0.142 257 HD2 TYR 31 HD2 TYR 31 -11.502 -0.004 3.310 258 HE1 TYR 31 HE1 TYR 31 -11.963 -3.354 -0.263 259 HE2 TYR 31 HE2 TYR 31 -13.678 -1.078 2.912 260 HH TYR 31 HH TYR 31 -14.172 -3.301 0.211 261 H SER 32 H SER 32 -8.133 -0.509 4.762 262 HA SER 32 HA SER 32 -8.346 -3.036 6.113 263 1HB SER 32 1HB SER 32 -8.206 -1.802 8.126 264 2HB SER 32 2HB SER 32 -7.201 -0.907 6.986 265 HG SER 32 HG SER 32 -8.417 0.710 7.537 266 H VAL 33 H VAL 33 -10.129 -2.759 8.102 267 HA VAL 33 HA VAL 33 -12.713 -2.188 6.826 268 HB VAL 33 HB VAL 33 -13.343 -4.335 8.403 269 1HG1 VAL 33 1HG1 VAL 33 -12.790 -5.353 5.821 270 2HG1 VAL 33 2HG1 VAL 33 -13.295 -3.673 5.637 271 3HG1 VAL 33 3HG1 VAL 33 -14.335 -4.818 6.482 272 1HG2 VAL 33 1HG2 VAL 33 -10.735 -4.601 8.497 273 2HG2 VAL 33 2HG2 VAL 33 -10.968 -5.336 6.912 274 3HG2 VAL 33 3HG2 VAL 33 -11.780 -6.010 8.325 275 H ILE 34 H ILE 34 -14.170 -1.199 8.092 276 HA ILE 34 HA ILE 34 -13.375 -0.088 10.558 277 HB ILE 34 HB ILE 34 -15.070 0.857 8.922 278 1HG1 ILE 34 1HG1 ILE 34 -16.570 1.157 11.341 279 2HG1 ILE 34 2HG1 ILE 34 -14.859 1.072 11.746 280 1HG2 ILE 34 1HG2 ILE 34 -16.409 -1.234 8.757 281 2HG2 ILE 34 2HG2 ILE 34 -17.365 0.207 9.104 282 3HG2 ILE 34 3HG2 ILE 34 -16.990 -0.936 10.395 283 1HD1 ILE 34 1HD1 ILE 34 -14.887 3.263 11.334 284 2HD1 ILE 34 2HD1 ILE 34 -16.369 3.168 10.385 285 3HD1 ILE 34 3HD1 ILE 34 -14.819 2.776 9.641 286 H GLN 35 H GLN 35 -14.079 -0.471 12.653 287 HA GLN 35 HA GLN 35 -15.890 -2.556 13.342 288 1HB GLN 35 1HB GLN 35 -13.298 -3.419 12.773 289 2HB GLN 35 2HB GLN 35 -13.350 -3.327 14.528 290 1HG GLN 35 1HG GLN 35 -15.644 -4.631 13.206 291 2HG GLN 35 2HG GLN 35 -14.101 -5.482 13.145 292 1HE2 GLN 35 1HE2 GLN 35 -14.088 -6.996 14.637 293 2HE2 GLN 35 2HE2 GLN 35 -14.625 -6.824 16.270 294 H GLY 36 H GLY 36 -16.818 -0.986 14.644 295 1HA GLY 36 1HA GLY 36 -17.131 0.259 16.550 296 2HA GLY 36 2HA GLY 36 -15.914 -0.775 17.286 297 H ASN 37 H ASN 37 -13.792 -0.076 17.426 298 HA ASN 37 HA ASN 37 -13.214 2.626 16.436 299 1HB ASN 37 1HB ASN 37 -11.986 3.018 18.638 300 2HB ASN 37 2HB ASN 37 -13.747 3.064 18.698 301 1HD2 ASN 37 1HD2 ASN 37 -14.081 2.450 20.747 302 2HD2 ASN 37 2HD2 ASN 37 -13.604 0.924 21.404 303 H ARG 38 H ARG 38 -12.426 -0.112 15.603 304 HA ARG 38 HA ARG 38 -9.537 0.355 15.623 305 1HB ARG 38 1HB ARG 38 -9.128 -2.072 15.945 306 2HB ARG 38 2HB ARG 38 -9.850 -1.310 17.348 307 1HG ARG 38 1HG ARG 38 -11.643 -2.592 15.366 308 2HG ARG 38 2HG ARG 38 -10.691 -3.626 16.432 309 1HD ARG 38 1HD ARG 38 -11.600 -2.398 18.373 310 2HD ARG 38 2HD ARG 38 -12.601 -1.455 17.276 311 HE ARG 38 HE ARG 38 -13.936 -3.337 16.890 312 1HH1 ARG 38 1HH1 ARG 38 -11.278 -4.094 19.025 313 2HH1 ARG 38 2HH1 ARG 38 -12.011 -5.543 19.624 314 1HH2 ARG 38 1HH2 ARG 38 -14.890 -5.246 17.660 315 2HH2 ARG 38 2HH2 ARG 38 -14.068 -6.199 18.850 316 H THR 39 H THR 39 -8.401 -0.698 13.899 317 HA THR 39 HA THR 39 -10.136 -1.195 11.577 318 HB THR 39 HB THR 39 -7.955 0.553 11.900 319 HG1 THR 39 HG1 THR 39 -8.849 -0.175 9.352 320 1HG2 THR 39 1HG2 THR 39 -6.162 -0.110 10.746 321 2HG2 THR 39 2HG2 THR 39 -7.110 -1.039 9.591 322 3HG2 THR 39 3HG2 THR 39 -6.703 -1.731 11.154 323 H PHE 40 H PHE 40 -10.205 -3.167 10.756 324 HA PHE 40 HA PHE 40 -8.372 -5.192 11.803 325 1HB PHE 40 1HB PHE 40 -10.993 -5.309 11.685 326 2HB PHE 40 2HB PHE 40 -10.707 -5.760 10.016 327 HD1 PHE 40 HD1 PHE 40 -8.439 -7.529 10.114 328 HD2 PHE 40 HD2 PHE 40 -11.701 -7.140 12.818 329 HE1 PHE 40 HE1 PHE 40 -8.188 -9.883 10.766 330 HE2 PHE 40 HE2 PHE 40 -11.441 -9.489 13.484 331 HZ PHE 40 HZ PHE 40 -9.678 -10.870 12.457 332 H ILE 41 H ILE 41 -6.618 -4.229 10.400 333 HA ILE 41 HA ILE 41 -6.854 -4.454 7.574 334 HB ILE 41 HB ILE 41 -5.338 -2.846 8.627 335 1HG1 ILE 41 1HG1 ILE 41 -3.288 -3.474 7.189 336 2HG1 ILE 41 2HG1 ILE 41 -4.245 -4.870 6.700 337 1HG2 ILE 41 1HG2 ILE 41 -4.245 -5.243 9.853 338 2HG2 ILE 41 2HG2 ILE 41 -4.154 -3.561 10.366 339 3HG2 ILE 41 3HG2 ILE 41 -3.019 -4.181 9.169 340 1HD1 ILE 41 1HD1 ILE 41 -6.036 -2.917 6.302 341 2HD1 ILE 41 2HD1 ILE 41 -4.908 -3.482 5.073 342 3HD1 ILE 41 3HD1 ILE 41 -4.541 -2.030 6.003 343 H GLN 42 H GLN 42 -6.870 -6.197 6.443 344 HA GLN 42 HA GLN 42 -5.640 -8.639 7.488 345 1HB GLN 42 1HB GLN 42 -7.646 -9.482 6.943 346 2HB GLN 42 2HB GLN 42 -8.091 -8.025 6.073 347 1HG GLN 42 1HG GLN 42 -8.190 -9.433 4.333 348 2HG GLN 42 2HG GLN 42 -6.457 -9.143 4.259 349 1HE2 GLN 42 1HE2 GLN 42 -8.544 -11.139 6.308 350 2HE2 GLN 42 2HE2 GLN 42 -7.692 -12.618 6.037 351 H ASN 43 H ASN 43 -5.804 -6.590 4.610 352 HA ASN 43 HA ASN 43 -3.703 -8.179 3.350 353 1HB ASN 43 1HB ASN 43 -5.889 -6.633 2.359 354 2HB ASN 43 2HB ASN 43 -4.397 -5.936 1.739 355 1HD2 ASN 43 1HD2 ASN 43 -6.051 -9.040 2.141 356 2HD2 ASN 43 2HD2 ASN 43 -5.455 -9.740 0.680 357 H PHE 44 H PHE 44 -2.848 -6.881 5.613 358 HA PHE 44 HA PHE 44 -1.819 -4.357 5.446 359 1HB PHE 44 1HB PHE 44 -0.116 -5.019 7.033 360 2HB PHE 44 2HB PHE 44 -1.627 -5.822 7.436 361 HD1 PHE 44 HD1 PHE 44 1.797 -6.268 7.145 362 HD2 PHE 44 HD2 PHE 44 -1.877 -8.221 6.246 363 HE1 PHE 44 HE1 PHE 44 2.956 -8.439 7.128 364 HE2 PHE 44 HE2 PHE 44 -0.725 -10.391 6.227 365 HZ PHE 44 HZ PHE 44 1.696 -10.503 6.669 366 H ARG 45 H ARG 45 -0.883 -7.078 3.539 367 HA ARG 45 HA ARG 45 1.703 -6.012 2.831 368 1HB ARG 45 1HB ARG 45 0.571 -8.520 2.752 369 2HB ARG 45 2HB ARG 45 0.576 -8.052 1.056 370 1HG ARG 45 1HG ARG 45 3.040 -7.751 2.724 371 2HG ARG 45 2HG ARG 45 2.607 -9.311 2.022 372 1HD ARG 45 1HD ARG 45 2.620 -8.352 -0.201 373 2HD ARG 45 2HD ARG 45 2.926 -6.749 0.463 374 HE ARG 45 HE ARG 45 5.139 -7.328 0.814 375 1HH1 ARG 45 1HH1 ARG 45 3.320 -10.112 -0.259 376 2HH1 ARG 45 2HH1 ARG 45 4.732 -11.064 -0.573 377 1HH2 ARG 45 1HH2 ARG 45 6.990 -8.583 0.407 378 2HH2 ARG 45 2HH2 ARG 45 6.813 -10.199 -0.194 379 H GLU 46 H GLU 46 -1.303 -6.640 1.031 380 HA GLU 46 HA GLU 46 -0.512 -5.210 -1.286 381 1HB GLU 46 1HB GLU 46 -2.393 -6.945 -1.036 382 2HB GLU 46 2HB GLU 46 -3.363 -5.608 -0.443 383 1HG GLU 46 1HG GLU 46 -3.752 -4.862 -2.492 384 2HG GLU 46 2HG GLU 46 -2.043 -4.927 -2.917 385 H VAL 47 H VAL 47 -2.292 -4.365 1.613 386 HA VAL 47 HA VAL 47 -3.019 -1.745 0.794 387 HB VAL 47 HB VAL 47 -2.776 -2.927 3.569 388 1HG1 VAL 47 1HG1 VAL 47 -2.859 -0.279 3.102 389 2HG1 VAL 47 2HG1 VAL 47 -3.626 -1.042 4.493 390 3HG1 VAL 47 3HG1 VAL 47 -4.582 -0.646 3.068 391 1HG2 VAL 47 1HG2 VAL 47 -5.366 -2.380 2.221 392 2HG2 VAL 47 2HG2 VAL 47 -4.946 -3.613 3.407 393 3HG2 VAL 47 3HG2 VAL 47 -4.441 -3.797 1.732 394 H ALA 48 H ALA 48 -0.342 -3.063 2.707 395 HA ALA 48 HA ALA 48 0.785 -0.651 3.515 396 1HB ALA 48 1HB ALA 48 1.568 -2.553 4.598 397 2HB ALA 48 2HB ALA 48 2.942 -1.989 3.649 398 3HB ALA 48 3HB ALA 48 1.983 -3.356 3.082 399 H ASP 49 H ASP 49 1.112 -2.366 0.485 400 HA ASP 49 HA ASP 49 3.304 -0.753 -0.462 401 1HB ASP 49 1HB ASP 49 2.164 -3.149 -1.262 402 2HB ASP 49 2HB ASP 49 1.695 -2.038 -2.544 403 H ALA 50 H ALA 50 -0.017 -1.062 -1.751 404 HA ALA 50 HA ALA 50 -0.029 1.172 -3.331 405 1HB ALA 50 1HB ALA 50 -2.538 1.223 -2.872 406 2HB ALA 50 2HB ALA 50 -2.247 -0.156 -1.816 407 3HB ALA 50 3HB ALA 50 -1.864 -0.264 -3.532 408 H LEU 51 H LEU 51 -0.957 1.053 0.113 409 HA LEU 51 HA LEU 51 -1.646 3.770 0.292 410 1HB LEU 51 1HB LEU 51 -2.545 2.424 1.965 411 2HB LEU 51 2HB LEU 51 -1.025 1.607 2.263 412 HG LEU 51 HG LEU 51 -0.161 3.475 3.446 413 1HD1 LEU 51 1HD1 LEU 51 -0.749 5.538 2.960 414 2HD1 LEU 51 2HD1 LEU 51 -2.358 5.243 3.617 415 3HD1 LEU 51 3HD1 LEU 51 -2.025 4.922 1.915 416 1HD2 LEU 51 1HD2 LEU 51 -2.790 3.624 4.688 417 2HD2 LEU 51 2HD2 LEU 51 -1.270 3.021 5.338 418 3HD2 LEU 51 3HD2 LEU 51 -2.276 1.973 4.342 419 H ASN 52 H ASN 52 1.401 2.042 0.682 420 HA ASN 52 HA ASN 52 2.883 4.445 0.315 421 1HB ASN 52 1HB ASN 52 2.174 3.836 2.992 422 2HB ASN 52 2HB ASN 52 3.892 3.517 2.825 423 1HD2 ASN 52 1HD2 ASN 52 4.505 5.454 0.912 424 2HD2 ASN 52 2HD2 ASN 52 4.331 7.014 1.636 425 H ARG 53 H ARG 53 4.056 3.453 -1.242 426 HA ARG 53 HA ARG 53 4.988 0.953 -1.550 427 1HB ARG 53 1HB ARG 53 5.410 3.045 -2.991 428 2HB ARG 53 2HB ARG 53 6.850 3.275 -2.010 429 1HG ARG 53 1HG ARG 53 7.796 1.232 -2.763 430 2HG ARG 53 2HG ARG 53 6.283 0.742 -3.529 431 1HD ARG 53 1HD ARG 53 6.678 1.969 -5.371 432 2HD ARG 53 2HD ARG 53 7.328 3.323 -4.447 433 HE ARG 53 HE ARG 53 8.995 0.943 -4.756 434 1HH1 ARG 53 1HH1 ARG 53 8.329 4.229 -5.716 435 2HH1 ARG 53 2HH1 ARG 53 9.918 4.504 -6.340 436 1HH2 ARG 53 1HH2 ARG 53 11.083 1.304 -5.576 437 2HH2 ARG 53 2HH2 ARG 53 11.480 2.842 -6.264 438 H ASP 54 H ASP 54 6.275 3.330 0.685 439 HA ASP 54 HA ASP 54 8.420 1.544 1.514 440 1HB ASP 54 1HB ASP 54 7.666 4.346 2.361 441 2HB ASP 54 2HB ASP 54 8.989 3.437 3.083 442 HA PRO 55 HA PRO 55 5.869 -0.158 4.741 443 1HB PRO 55 1HB PRO 55 7.786 -1.485 6.106 444 2HB PRO 55 2HB PRO 55 7.172 -2.046 4.547 445 1HG PRO 55 1HG PRO 55 9.678 -0.526 5.160 446 2HG PRO 55 2HG PRO 55 9.442 -1.899 4.063 447 1HD PRO 55 1HD PRO 55 9.574 0.673 3.200 448 2HD PRO 55 2HD PRO 55 8.614 -0.571 2.376 449 H GLN 56 H GLN 56 8.909 1.470 5.533 450 HA GLN 56 HA GLN 56 8.474 1.860 8.264 451 1HB GLN 56 1HB GLN 56 10.364 2.697 6.313 452 2HB GLN 56 2HB GLN 56 9.839 4.128 7.187 453 1HG GLN 56 1HG GLN 56 10.281 2.168 9.133 454 2HG GLN 56 2HG GLN 56 11.630 2.046 8.004 455 1HE2 GLN 56 1HE2 GLN 56 13.303 3.183 8.640 456 2HE2 GLN 56 2HE2 GLN 56 13.259 4.714 9.439 457 H HIS 57 H HIS 57 7.232 3.556 5.476 458 HA HIS 57 HA HIS 57 6.328 5.855 6.887 459 1HB HIS 57 1HB HIS 57 6.413 5.011 4.190 460 2HB HIS 57 2HB HIS 57 4.725 5.345 4.556 461 HD2 HIS 57 HD2 HIS 57 7.753 7.213 3.409 462 HE1 HIS 57 HE1 HIS 57 5.263 10.119 5.243 463 HE2 HIS 57 HE2 HIS 57 7.223 9.727 3.709 464 H LEU 58 H LEU 58 4.462 3.190 5.447 465 HA LEU 58 HA LEU 58 1.991 3.718 6.469 466 1HB LEU 58 1HB LEU 58 3.290 1.501 5.305 467 2HB LEU 58 2HB LEU 58 2.491 0.900 6.744 468 HG LEU 58 HG LEU 58 0.568 2.491 5.505 469 1HD1 LEU 58 1HD1 LEU 58 1.189 2.640 3.364 470 2HD1 LEU 58 2HD1 LEU 58 0.763 0.944 3.254 471 3HD1 LEU 58 3HD1 LEU 58 2.435 1.413 3.539 472 1HD2 LEU 58 1HD2 LEU 58 1.042 -0.472 5.648 473 2HD2 LEU 58 2HD2 LEU 58 -0.417 0.216 4.934 474 3HD2 LEU 58 3HD2 LEU 58 -0.038 0.519 6.629 475 H LEU 59 H LEU 59 4.607 1.974 8.105 476 HA LEU 59 HA LEU 59 3.232 1.244 10.412 477 1HB LEU 59 1HB LEU 59 5.765 0.902 9.488 478 2HB LEU 59 2HB LEU 59 6.043 2.042 10.789 479 HG LEU 59 HG LEU 59 6.318 -0.352 11.434 480 1HD1 LEU 59 1HD1 LEU 59 5.310 -0.113 13.556 481 2HD1 LEU 59 2HD1 LEU 59 4.066 0.964 12.924 482 3HD1 LEU 59 3HD1 LEU 59 5.740 1.510 13.019 483 1HD2 LEU 59 1HD2 LEU 59 4.593 -1.386 10.128 484 2HD2 LEU 59 2HD2 LEU 59 3.347 -0.430 10.927 485 3HD2 LEU 59 3HD2 LEU 59 4.236 -1.650 11.833 486 H LYS 60 H LYS 60 5.269 4.112 9.886 487 HA LYS 60 HA LYS 60 4.672 5.282 12.390 488 1HB LYS 60 1HB LYS 60 5.660 6.531 9.823 489 2HB LYS 60 2HB LYS 60 5.598 7.358 11.373 490 1HG LYS 60 1HG LYS 60 7.240 4.920 10.722 491 2HG LYS 60 2HG LYS 60 7.837 6.571 10.909 492 1HD LYS 60 1HD LYS 60 6.482 4.951 13.067 493 2HD LYS 60 2HD LYS 60 8.222 5.196 12.918 494 1HE LYS 60 1HE LYS 60 7.878 6.936 14.290 495 2HE LYS 60 2HE LYS 60 7.317 7.755 12.833 496 1HZ LYS 60 1HZ LYS 60 5.665 6.420 14.901 497 2HZ LYS 60 2HZ LYS 60 5.048 6.925 13.410 498 3HZ LYS 60 3HZ LYS 60 5.679 8.061 14.491 499 H PHE 61 H PHE 61 3.048 5.287 9.312 500 HA PHE 61 HA PHE 61 1.417 7.571 9.764 501 1HB PHE 61 1HB PHE 61 1.828 5.683 7.672 502 2HB PHE 61 2HB PHE 61 0.103 5.732 8.018 503 HD1 PHE 61 HD1 PHE 61 -1.209 7.668 7.524 504 HD2 PHE 61 HD2 PHE 61 3.008 7.700 6.934 505 HE1 PHE 61 HE1 PHE 61 -1.408 9.756 6.234 506 HE2 PHE 61 HE2 PHE 61 2.815 9.787 5.647 507 HZ PHE 61 HZ PHE 61 0.605 10.818 5.297 508 H LEU 62 H LEU 62 0.793 4.086 10.028 509 HA LEU 62 HA LEU 62 -1.833 4.214 10.915 510 1HB LEU 62 1HB LEU 62 0.379 2.236 11.403 511 2HB LEU 62 2HB LEU 62 -1.238 1.986 12.031 512 HG LEU 62 HG LEU 62 -1.179 2.580 9.160 513 1HD1 LEU 62 1HD1 LEU 62 -0.513 0.062 8.818 514 2HD1 LEU 62 2HD1 LEU 62 0.420 0.335 10.289 515 3HD1 LEU 62 3HD1 LEU 62 0.714 1.324 8.859 516 1HD2 LEU 62 1HD2 LEU 62 -2.635 0.969 11.099 517 2HD2 LEU 62 2HD2 LEU 62 -2.419 0.178 9.542 518 3HD2 LEU 62 3HD2 LEU 62 -3.203 1.752 9.633 519 H LEU 63 H LEU 63 1.199 4.318 12.762 520 HA LEU 63 HA LEU 63 -0.126 4.449 15.301 521 1HB LEU 63 1HB LEU 63 2.685 4.627 14.345 522 2HB LEU 63 2HB LEU 63 2.316 5.309 15.918 523 HG LEU 63 HG LEU 63 1.567 2.482 15.216 524 1HD1 LEU 63 1HD1 LEU 63 3.967 2.718 14.849 525 2HD1 LEU 63 2HD1 LEU 63 3.634 1.758 16.290 526 3HD1 LEU 63 3HD1 LEU 63 4.148 3.438 16.448 527 1HD2 LEU 63 1HD2 LEU 63 0.516 3.568 17.181 528 2HD2 LEU 63 2HD2 LEU 63 2.122 3.819 17.862 529 3HD2 LEU 63 3HD2 LEU 63 1.521 2.182 17.605 530 H ARG 64 H ARG 64 1.155 6.777 13.016 531 HA ARG 64 HA ARG 64 1.244 9.039 14.647 532 1HB ARG 64 1HB ARG 64 1.997 8.759 12.184 533 2HB ARG 64 2HB ARG 64 0.352 9.225 11.784 534 1HG ARG 64 1HG ARG 64 1.736 11.164 11.680 535 2HG ARG 64 2HG ARG 64 0.690 11.310 13.093 536 1HD ARG 64 1HD ARG 64 2.716 10.219 14.337 537 2HD ARG 64 2HD ARG 64 3.630 10.799 12.946 538 HE ARG 64 HE ARG 64 2.116 12.934 13.857 539 1HH1 ARG 64 1HH1 ARG 64 4.675 10.890 15.068 540 2HH1 ARG 64 2HH1 ARG 64 5.334 12.114 16.102 541 1HH2 ARG 64 1HH2 ARG 64 2.983 14.545 15.217 542 2HH2 ARG 64 2HH2 ARG 64 4.374 14.189 16.186 543 H GLU 65 H GLU 65 -1.490 7.537 13.006 544 HA GLU 65 HA GLU 65 -3.245 9.636 14.063 545 1HB GLU 65 1HB GLU 65 -3.590 7.559 11.927 546 2HB GLU 65 2HB GLU 65 -4.987 8.337 12.650 547 1HG GLU 65 1HG GLU 65 -4.548 10.350 11.691 548 2HG GLU 65 2HG GLU 65 -2.807 10.078 11.652 549 H LEU 66 H LEU 66 -2.337 6.339 14.536 550 HA LEU 66 HA LEU 66 -4.704 5.589 15.985 551 1HB LEU 66 1HB LEU 66 -2.099 4.321 15.337 552 2HB LEU 66 2HB LEU 66 -2.934 3.734 16.756 553 HG LEU 66 HG LEU 66 -4.772 2.960 15.501 554 1HD1 LEU 66 1HD1 LEU 66 -4.645 5.088 13.962 555 2HD1 LEU 66 2HD1 LEU 66 -5.418 3.605 13.410 556 3HD1 LEU 66 3HD1 LEU 66 -3.777 3.985 12.896 557 1HD2 LEU 66 1HD2 LEU 66 -2.095 2.358 14.383 558 2HD2 LEU 66 2HD2 LEU 66 -3.511 1.734 13.537 559 3HD2 LEU 66 3HD2 LEU 66 -3.234 1.310 15.227 560 H GLY 67 H GLY 67 -4.666 7.492 17.427 561 1HA GLY 67 1HA GLY 67 -2.600 7.814 19.356 562 2HA GLY 67 2HA GLY 67 -4.209 8.516 19.437 563 H THR 68 H THR 68 -4.856 5.387 19.021 564 HA THR 68 HA THR 68 -5.232 4.941 21.871 565 HB THR 68 HB THR 68 -6.872 3.348 21.280 566 HG1 THR 68 HG1 THR 68 -5.723 2.175 19.739 567 1HG2 THR 68 1HG2 THR 68 -8.198 4.409 19.404 568 2HG2 THR 68 2HG2 THR 68 -6.895 5.593 19.293 569 3HG2 THR 68 3HG2 THR 68 -7.820 5.437 20.787 570 H ALA 69 H ALA 69 -4.978 2.619 22.610 571 HA ALA 69 HA ALA 69 -2.577 1.754 23.069 572 1HB ALA 69 1HB ALA 69 -5.023 0.506 23.076 573 2HB ALA 69 2HB ALA 69 -3.519 -0.156 23.714 574 3HB ALA 69 3HB ALA 69 -4.034 -0.558 22.076 575 H GLY 70 H GLY 70 -4.110 0.647 20.029 576 1HA GLY 70 1HA GLY 70 -3.179 0.131 17.989 577 2HA GLY 70 2HA GLY 70 -1.775 1.064 18.482 578 H ASN 71 H ASN 71 -3.113 -2.078 18.073 579 HA ASN 71 HA ASN 71 -0.530 -3.285 18.235 580 1HB ASN 71 1HB ASN 71 -2.125 -3.259 20.619 581 2HB ASN 71 2HB ASN 71 -1.980 -4.917 20.041 582 1HD2 ASN 71 1HD2 ASN 71 0.359 -5.415 19.271 583 2HD2 ASN 71 2HD2 ASN 71 1.601 -4.946 20.373 584 H LEU 72 H LEU 72 -0.613 -5.628 17.723 585 HA LEU 72 HA LEU 72 -2.647 -6.096 15.722 586 1HB LEU 72 1HB LEU 72 -0.775 -6.863 14.767 587 2HB LEU 72 2HB LEU 72 0.053 -7.011 16.298 588 HG LEU 72 HG LEU 72 -0.194 -9.104 14.871 589 1HD1 LEU 72 1HD1 LEU 72 -1.229 -10.168 17.252 590 2HD1 LEU 72 2HD1 LEU 72 -0.338 -8.713 17.701 591 3HD1 LEU 72 3HD1 LEU 72 0.462 -9.989 16.786 592 1HD2 LEU 72 1HD2 LEU 72 -2.784 -9.724 16.040 593 2HD2 LEU 72 2HD2 LEU 72 -2.181 -9.989 14.406 594 3HD2 LEU 72 3HD2 LEU 72 -2.851 -8.420 14.855 595 H GLU 73 H GLU 73 -4.540 -6.940 16.268 596 HA GLU 73 HA GLU 73 -4.675 -8.857 18.493 597 1HB GLU 73 1HB GLU 73 -6.641 -6.900 17.354 598 2HB GLU 73 2HB GLU 73 -7.234 -8.333 18.176 599 1HG GLU 73 1HG GLU 73 -5.558 -6.114 19.307 600 2HG GLU 73 2HG GLU 73 -7.205 -6.565 19.741 601 H GLY 74 H GLY 74 -5.883 -10.797 18.235 602 1HA GLY 74 1HA GLY 74 -6.631 -12.649 17.097 603 2HA GLY 74 2HA GLY 74 -7.217 -11.533 15.869 604 H GLY 75 H GLY 75 -6.434 -13.783 14.825 605 1HA GLY 75 1HA GLY 75 -3.703 -14.194 14.368 606 2HA GLY 75 2HA GLY 75 -4.993 -14.736 13.307 607 H ARG 76 H ARG 76 -5.967 -12.019 12.816 608 HA ARG 76 HA ARG 76 -4.012 -11.291 10.789 609 1HB ARG 76 1HB ARG 76 -6.893 -10.648 11.268 610 2HB ARG 76 2HB ARG 76 -5.951 -9.638 10.179 611 1HG ARG 76 1HG ARG 76 -5.897 -12.589 9.788 612 2HG ARG 76 2HG ARG 76 -7.343 -11.700 9.304 613 1HD ARG 76 1HD ARG 76 -5.559 -12.056 7.530 614 2HD ARG 76 2HD ARG 76 -6.151 -10.411 7.741 615 HE ARG 76 HE ARG 76 -4.046 -9.786 8.363 616 1HH1 ARG 76 1HH1 ARG 76 -4.318 -13.248 8.726 617 2HH1 ARG 76 2HH1 ARG 76 -2.641 -13.464 9.101 618 1HH2 ARG 76 1HH2 ARG 76 -1.851 -10.067 8.871 619 2HH2 ARG 76 2HH2 ARG 76 -1.240 -11.657 9.185 620 H ALA 77 H ALA 77 -4.232 -8.612 10.426 621 HA ALA 77 HA ALA 77 -3.027 -7.636 12.896 622 1HB ALA 77 1HB ALA 77 -1.622 -6.961 11.250 623 2HB ALA 77 2HB ALA 77 -2.683 -5.555 11.290 624 3HB ALA 77 3HB ALA 77 -2.908 -6.793 10.056 625 H ILE 78 H ILE 78 -4.980 -7.552 14.096 626 HA ILE 78 HA ILE 78 -6.968 -5.577 13.302 627 HB ILE 78 HB ILE 78 -6.817 -7.311 15.766 628 1HG1 ILE 78 1HG1 ILE 78 -8.721 -7.710 13.480 629 2HG1 ILE 78 2HG1 ILE 78 -7.107 -8.414 13.445 630 1HG2 ILE 78 1HG2 ILE 78 -8.253 -5.708 16.483 631 2HG2 ILE 78 2HG2 ILE 78 -9.401 -6.715 15.600 632 3HG2 ILE 78 3HG2 ILE 78 -8.744 -5.262 14.848 633 1HD1 ILE 78 1HD1 ILE 78 -8.099 -9.103 15.938 634 2HD1 ILE 78 2HD1 ILE 78 -7.966 -10.149 14.525 635 3HD1 ILE 78 3HD1 ILE 78 -9.472 -9.288 14.847 636 H LEU 79 H LEU 79 -5.754 -3.638 13.470 637 HA LEU 79 HA LEU 79 -4.557 -2.974 16.035 638 1HB LEU 79 1HB LEU 79 -3.750 -0.978 14.969 639 2HB LEU 79 2HB LEU 79 -3.413 -2.364 13.950 640 HG LEU 79 HG LEU 79 -5.640 -1.690 12.761 641 1HD1 LEU 79 1HD1 LEU 79 -5.129 0.557 14.570 642 2HD1 LEU 79 2HD1 LEU 79 -6.610 0.077 13.746 643 3HD1 LEU 79 3HD1 LEU 79 -5.394 1.023 12.889 644 1HD2 LEU 79 1HD2 LEU 79 -4.369 -0.725 11.114 645 2HD2 LEU 79 2HD2 LEU 79 -3.120 -1.532 12.063 646 3HD2 LEU 79 3HD2 LEU 79 -3.400 0.194 12.263 647 H GLN 80 H GLN 80 -4.985 -0.468 16.594 648 HA GLN 80 HA GLN 80 -7.873 0.055 16.511 649 1HB GLN 80 1HB GLN 80 -6.961 -1.194 18.643 650 2HB GLN 80 2HB GLN 80 -6.404 0.410 19.093 651 1HG GLN 80 1HG GLN 80 -8.534 1.227 19.363 652 2HG GLN 80 2HG GLN 80 -9.246 0.027 18.289 653 1HE2 GLN 80 1HE2 GLN 80 -10.296 0.608 20.796 654 2HE2 GLN 80 2HE2 GLN 80 -10.101 -0.771 21.818 655 H GLY 81 H GLY 81 -8.318 2.148 16.107 656 1HA GLY 81 1HA GLY 81 -7.174 4.384 17.198 657 2HA GLY 81 2HA GLY 81 -6.170 4.026 15.806 658 H LYS 82 H LYS 82 -6.671 5.248 14.129 659 HA LYS 82 HA LYS 82 -9.500 5.642 13.461 660 1HB LYS 82 1HB LYS 82 -7.916 7.640 14.579 661 2HB LYS 82 2HB LYS 82 -7.907 8.001 12.859 662 1HG LYS 82 1HG LYS 82 -10.565 7.353 13.788 663 2HG LYS 82 2HG LYS 82 -9.859 8.688 14.702 664 1HD LYS 82 1HD LYS 82 -9.963 10.094 12.954 665 2HD LYS 82 2HD LYS 82 -9.424 8.862 11.811 666 1HE LYS 82 1HE LYS 82 -11.611 7.994 11.571 667 2HE LYS 82 2HE LYS 82 -12.200 8.897 12.965 668 1HZ LYS 82 1HZ LYS 82 -11.479 10.927 11.532 669 2HZ LYS 82 2HZ LYS 82 -12.964 10.171 11.243 670 3HZ LYS 82 3HZ LYS 82 -11.640 9.842 10.243 671 H PHE 83 H PHE 83 -7.788 3.801 12.250 672 HA PHE 83 HA PHE 83 -7.131 5.072 9.675 673 1HB PHE 83 1HB PHE 83 -5.829 3.020 11.266 674 2HB PHE 83 2HB PHE 83 -6.119 2.474 9.618 675 HD1 PHE 83 HD1 PHE 83 -4.430 2.830 8.130 676 HD2 PHE 83 HD2 PHE 83 -4.943 5.580 11.334 677 HE1 PHE 83 HE1 PHE 83 -2.465 4.084 7.357 678 HE2 PHE 83 HE2 PHE 83 -2.973 6.842 10.562 679 HZ PHE 83 HZ PHE 83 -1.736 6.095 8.577 680 H THR 84 H THR 84 -9.787 4.654 10.151 681 HA THR 84 HA THR 84 -10.644 2.134 9.059 682 HB THR 84 HB THR 84 -12.854 2.912 9.387 683 HG1 THR 84 HG1 THR 84 -11.929 5.560 9.718 684 1HG2 THR 84 1HG2 THR 84 -11.460 4.487 11.513 685 2HG2 THR 84 2HG2 THR 84 -11.421 2.724 11.499 686 3HG2 THR 84 3HG2 THR 84 -12.964 3.572 11.610 687 H HIS 85 H HIS 85 -9.347 2.285 7.119 688 HA HIS 85 HA HIS 85 -8.904 2.788 4.936 689 1HB HIS 85 1HB HIS 85 -10.837 2.585 3.468 690 2HB HIS 85 2HB HIS 85 -10.947 1.410 4.773 691 HD2 HIS 85 HD2 HIS 85 -13.203 1.608 6.332 692 HE1 HIS 85 HE1 HIS 85 -14.738 5.150 4.570 693 HE2 HIS 85 HE2 HIS 85 -15.124 3.340 6.281 694 H PHE 86 H PHE 86 -8.836 5.072 6.603 695 HA PHE 86 HA PHE 86 -10.109 7.189 5.056 696 1HB PHE 86 1HB PHE 86 -9.194 6.909 7.783 697 2HB PHE 86 2HB PHE 86 -8.502 8.351 7.044 698 HD1 PHE 86 HD1 PHE 86 -9.939 10.154 6.249 699 HD2 PHE 86 HD2 PHE 86 -11.546 6.731 8.199 700 HE1 PHE 86 HE1 PHE 86 -12.062 11.350 6.589 701 HE2 PHE 86 HE2 PHE 86 -13.671 7.921 8.545 702 HZ PHE 86 HZ PHE 86 -13.931 10.233 7.740 703 H LEU 87 H LEU 87 -6.910 7.195 6.547 704 HA LEU 87 HA LEU 87 -5.751 8.665 4.426 705 1HB LEU 87 1HB LEU 87 -5.010 7.783 7.032 706 2HB LEU 87 2HB LEU 87 -3.737 7.309 5.925 707 HG LEU 87 HG LEU 87 -3.160 9.435 6.832 708 1HD1 LEU 87 1HD1 LEU 87 -3.297 10.899 4.750 709 2HD1 LEU 87 2HD1 LEU 87 -4.142 9.545 4.001 710 3HD1 LEU 87 3HD1 LEU 87 -2.495 9.337 4.594 711 1HD2 LEU 87 1HD2 LEU 87 -5.571 10.800 5.762 712 2HD2 LEU 87 2HD2 LEU 87 -4.549 11.214 7.139 713 3HD2 LEU 87 3HD2 LEU 87 -5.721 9.903 7.273 714 H ILE 88 H ILE 88 -5.938 5.244 5.194 715 HA ILE 88 HA ILE 88 -3.963 4.270 3.472 716 HB ILE 88 HB ILE 88 -6.562 2.856 4.040 717 1HG1 ILE 88 1HG1 ILE 88 -4.094 3.037 5.803 718 2HG1 ILE 88 2HG1 ILE 88 -5.722 3.586 6.194 719 1HG2 ILE 88 1HG2 ILE 88 -4.433 2.131 2.481 720 2HG2 ILE 88 2HG2 ILE 88 -5.617 1.031 3.184 721 3HG2 ILE 88 3HG2 ILE 88 -4.087 1.324 4.009 722 1HD1 ILE 88 1HD1 ILE 88 -6.523 1.417 6.457 723 2HD1 ILE 88 2HD1 ILE 88 -4.919 1.366 7.183 724 3HD1 ILE 88 3HD1 ILE 88 -5.173 0.711 5.569 725 H ASN 89 H ASN 89 -7.473 4.286 2.895 726 HA ASN 89 HA ASN 89 -7.375 3.579 0.213 727 1HB ASN 89 1HB ASN 89 -9.373 3.970 1.977 728 2HB ASN 89 2HB ASN 89 -9.543 5.431 1.006 729 1HD2 ASN 89 1HD2 ASN 89 -8.603 2.122 0.156 730 2HD2 ASN 89 2HD2 ASN 89 -9.847 1.889 -1.020 731 H GLU 90 H GLU 90 -7.598 6.856 1.602 732 HA GLU 90 HA GLU 90 -7.696 8.285 -0.771 733 1HB GLU 90 1HB GLU 90 -7.540 8.916 1.912 734 2HB GLU 90 2HB GLU 90 -6.042 9.573 1.267 735 1HG GLU 90 1HG GLU 90 -7.909 11.190 1.297 736 2HG GLU 90 2HG GLU 90 -7.231 10.920 -0.307 737 H ARG 91 H ARG 91 -4.798 7.476 1.134 738 HA ARG 91 HA ARG 91 -2.912 8.550 -0.629 739 1HB ARG 91 1HB ARG 91 -2.770 6.332 1.390 740 2HB ARG 91 2HB ARG 91 -1.356 6.853 0.486 741 1HG ARG 91 1HG ARG 91 -2.735 9.088 1.694 742 2HG ARG 91 2HG ARG 91 -2.282 7.875 2.893 743 1HD ARG 91 1HD ARG 91 -0.379 9.156 2.833 744 2HD ARG 91 2HD ARG 91 0.011 7.926 1.634 745 HE ARG 91 HE ARG 91 -0.421 9.514 -0.084 746 1HH1 ARG 91 1HH1 ARG 91 -0.482 10.875 3.137 747 2HH1 ARG 91 2HH1 ARG 91 -0.258 12.499 2.584 748 1HH2 ARG 91 1HH2 ARG 91 -0.135 11.652 -0.802 749 2HH2 ARG 91 2HH2 ARG 91 -0.064 12.941 0.353 750 H ILE 92 H ILE 92 -4.128 5.218 -0.340 751 HA ILE 92 HA ILE 92 -2.623 3.991 -2.313 752 HB ILE 92 HB ILE 92 -5.452 3.485 -1.396 753 1HG1 ILE 92 1HG1 ILE 92 -2.995 1.785 -1.010 754 2HG1 ILE 92 2HG1 ILE 92 -3.447 3.065 0.113 755 1HG2 ILE 92 1HG2 ILE 92 -4.746 1.144 -2.565 756 2HG2 ILE 92 2HG2 ILE 92 -4.026 2.307 -3.677 757 3HG2 ILE 92 3HG2 ILE 92 -5.753 2.375 -3.326 758 1HD1 ILE 92 1HD1 ILE 92 -5.596 1.944 0.487 759 2HD1 ILE 92 2HD1 ILE 92 -4.219 0.931 0.923 760 3HD1 ILE 92 3HD1 ILE 92 -5.084 0.643 -0.587 761 H GLU 93 H GLU 93 -5.900 5.351 -2.662 762 HA GLU 93 HA GLU 93 -6.066 5.039 -5.447 763 1HB GLU 93 1HB GLU 93 -7.509 6.958 -3.612 764 2HB GLU 93 2HB GLU 93 -7.948 6.664 -5.289 765 1HG GLU 93 1HG GLU 93 -7.762 4.167 -3.918 766 2HG GLU 93 2HG GLU 93 -8.783 5.266 -2.992 767 H ASP 94 H ASP 94 -4.560 7.467 -3.490 768 HA ASP 94 HA ASP 94 -4.519 9.616 -5.267 769 1HB ASP 94 1HB ASP 94 -3.613 9.260 -2.761 770 2HB ASP 94 2HB ASP 94 -2.086 9.136 -3.631 771 H TYR 95 H TYR 95 -1.982 7.166 -4.739 772 HA TYR 95 HA TYR 95 -0.666 7.943 -7.205 773 1HB TYR 95 1HB TYR 95 0.101 5.732 -5.294 774 2HB TYR 95 2HB TYR 95 1.113 6.463 -6.536 775 HD1 TYR 95 HD1 TYR 95 1.090 9.216 -6.250 776 HD2 TYR 95 HD2 TYR 95 0.682 6.329 -3.151 777 HE1 TYR 95 HE1 TYR 95 1.914 10.860 -4.618 778 HE2 TYR 95 HE2 TYR 95 1.504 7.966 -1.511 779 HH TYR 95 HH TYR 95 1.573 11.133 -1.948 780 H VAL 96 H VAL 96 -1.835 4.865 -5.829 781 HA VAL 96 HA VAL 96 -1.595 3.245 -8.022 782 HB VAL 96 HB VAL 96 -3.848 3.227 -6.005 783 1HG1 VAL 96 1HG1 VAL 96 -4.752 1.730 -7.413 784 2HG1 VAL 96 2HG1 VAL 96 -3.531 0.642 -6.755 785 3HG1 VAL 96 3HG1 VAL 96 -3.237 1.477 -8.281 786 1HG2 VAL 96 1HG2 VAL 96 -2.054 2.850 -4.665 787 2HG2 VAL 96 2HG2 VAL 96 -1.055 2.241 -5.985 788 3HG2 VAL 96 3HG2 VAL 96 -2.281 1.205 -5.258 789 H ASN 97 H ASN 97 -4.360 5.369 -7.246 790 HA ASN 97 HA ASN 97 -5.329 4.946 -9.990 791 1HB ASN 97 1HB ASN 97 -6.676 4.903 -7.461 792 2HB ASN 97 2HB ASN 97 -7.312 6.239 -8.413 793 1HD2 ASN 97 1HD2 ASN 97 -7.359 5.387 -10.915 794 2HD2 ASN 97 2HD2 ASN 97 -8.337 3.973 -11.087 795 H LYS 98 H LYS 98 -3.278 6.643 -9.887 796 HA LYS 98 HA LYS 98 -4.209 9.356 -9.479 797 1HB LYS 98 1HB LYS 98 -1.972 10.058 -10.023 798 2HB LYS 98 2HB LYS 98 -1.899 8.724 -8.885 799 1HG LYS 98 1HG LYS 98 -1.278 7.194 -10.627 800 2HG LYS 98 2HG LYS 98 -1.514 8.441 -11.855 801 1HD LYS 98 1HD LYS 98 0.635 8.988 -11.611 802 2HD LYS 98 2HD LYS 98 0.243 9.563 -9.990 803 1HE LYS 98 1HE LYS 98 2.135 7.893 -10.157 804 2HE LYS 98 2HE LYS 98 0.859 7.512 -9.002 805 1HZ LYS 98 1HZ LYS 98 1.764 5.739 -10.698 806 2HZ LYS 98 2HZ LYS 98 0.607 6.441 -11.712 807 3HZ LYS 98 3HZ LYS 98 0.137 5.764 -10.236 808 H PHE 99 H PHE 99 -4.817 7.229 -11.832 809 HA PHE 99 HA PHE 99 -4.240 8.796 -14.164 810 1HB PHE 99 1HB PHE 99 -6.203 6.514 -14.041 811 2HB PHE 99 2HB PHE 99 -5.233 7.051 -15.408 812 HD1 PHE 99 HD1 PHE 99 -2.707 6.771 -15.252 813 HD2 PHE 99 HD2 PHE 99 -5.439 4.817 -12.638 814 HE1 PHE 99 HE1 PHE 99 -0.973 5.124 -14.676 815 HE2 PHE 99 HE2 PHE 99 -3.709 3.167 -12.057 816 HZ PHE 99 HZ PHE 99 -1.472 3.319 -13.076 817 H VAL 100 H VAL 100 -7.286 7.911 -12.496 818 HA VAL 100 HA VAL 100 -8.748 9.840 -14.089 819 HB VAL 100 HB VAL 100 -10.649 9.143 -12.422 820 1HG1 VAL 100 1HG1 VAL 100 -9.512 7.344 -14.554 821 2HG1 VAL 100 2HG1 VAL 100 -10.685 8.643 -14.769 822 3HG1 VAL 100 3HG1 VAL 100 -11.131 7.191 -13.872 823 1HG2 VAL 100 1HG2 VAL 100 -9.021 7.942 -10.922 824 2HG2 VAL 100 2HG2 VAL 100 -8.857 6.733 -12.195 825 3HG2 VAL 100 3HG2 VAL 100 -10.422 6.998 -11.426 826 H ILE 101 H ILE 101 -6.788 10.209 -11.499 827 HA ILE 101 HA ILE 101 -8.424 12.411 -10.431 828 HB ILE 101 HB ILE 101 -8.079 10.787 -8.702 829 1HG1 ILE 101 1HG1 ILE 101 -6.201 13.115 -8.257 830 2HG1 ILE 101 2HG1 ILE 101 -7.952 13.180 -8.079 831 1HG2 ILE 101 1HG2 ILE 101 -6.070 9.837 -8.089 832 2HG2 ILE 101 2HG2 ILE 101 -5.116 11.105 -8.861 833 3HG2 ILE 101 3HG2 ILE 101 -5.955 9.906 -9.846 834 1HD1 ILE 101 1HD1 ILE 101 -7.879 11.643 -6.246 835 2HD1 ILE 101 2HD1 ILE 101 -6.734 12.950 -5.942 836 3HD1 ILE 101 3HD1 ILE 101 -6.153 11.375 -6.484 837 H CYS 102 H CYS 102 -5.055 11.431 -11.128 838 HA CYS 102 HA CYS 102 -4.147 14.171 -10.981 839 1HB CYS 102 1HB CYS 102 -2.727 12.189 -10.318 840 2HB CYS 102 2HB CYS 102 -2.594 11.805 -12.030 841 H HIS 103 H HIS 103 -6.044 12.864 -13.155 842 HA HIS 103 HA HIS 103 -6.612 13.369 -15.287 843 1HB HIS 103 1HB HIS 103 -4.569 15.487 -14.739 844 2HB HIS 103 2HB HIS 103 -5.192 15.287 -16.373 845 HD2 HIS 103 HD2 HIS 103 -6.280 16.720 -12.953 846 HE1 HIS 103 HE1 HIS 103 -9.524 17.184 -15.649 847 HE2 HIS 103 HE2 HIS 103 -8.642 17.699 -13.345 848 H GLU 104 H GLU 104 -5.041 11.165 -14.927 849 HA GLU 104 HA GLU 104 -3.639 9.697 -15.958 850 1HB GLU 104 1HB GLU 104 -5.463 10.420 -17.728 851 2HB GLU 104 2HB GLU 104 -4.070 11.106 -18.552 852 1HG GLU 104 1HG GLU 104 -3.221 8.577 -17.875 853 2HG GLU 104 2HG GLU 104 -4.915 8.342 -18.301 854 H CYS 105 H CYS 105 -1.870 10.894 -14.795 855 HA CYS 105 HA CYS 105 -0.177 12.623 -16.342 856 1HB CYS 105 1HB CYS 105 -0.519 12.207 -13.668 857 2HB CYS 105 2HB CYS 105 0.973 11.321 -13.961 858 H ASN 106 H ASN 106 -0.618 10.185 -17.702 859 HA ASN 106 HA ASN 106 1.590 8.411 -17.334 860 1HB ASN 106 1HB ASN 106 -0.684 7.838 -18.340 861 2HB ASN 106 2HB ASN 106 -0.120 8.632 -19.807 862 1HD2 ASN 106 1HD2 ASN 106 -0.363 6.615 -20.872 863 2HD2 ASN 106 2HD2 ASN 106 0.838 5.385 -20.710 864 H ARG 107 H ARG 107 0.707 10.347 -20.182 865 HA ARG 107 HA ARG 107 3.381 10.333 -21.188 866 1HB ARG 107 1HB ARG 107 0.832 11.693 -22.028 867 2HB ARG 107 2HB ARG 107 2.357 12.027 -22.836 868 1HG ARG 107 1HG ARG 107 1.667 9.181 -22.542 869 2HG ARG 107 2HG ARG 107 0.627 10.122 -23.612 870 1HD ARG 107 1HD ARG 107 3.632 9.965 -23.776 871 2HD ARG 107 2HD ARG 107 2.507 9.089 -24.812 872 HE ARG 107 HE ARG 107 1.706 11.430 -25.443 873 1HH1 ARG 107 1HH1 ARG 107 5.016 10.679 -24.597 874 2HH1 ARG 107 2HH1 ARG 107 5.675 11.972 -25.538 875 1HH2 ARG 107 1HH2 ARG 107 2.582 13.124 -26.680 876 2HH2 ARG 107 2HH2 ARG 107 4.299 13.357 -26.718 877 HA PRO 108 HA PRO 108 5.056 13.811 -19.006 878 1HB PRO 108 1HB PRO 108 6.533 14.333 -21.530 879 2HB PRO 108 2HB PRO 108 7.151 14.100 -19.892 880 1HG PRO 108 1HG PRO 108 7.406 12.186 -21.724 881 2HG PRO 108 2HG PRO 108 7.034 11.788 -20.035 882 1HD PRO 108 1HD PRO 108 5.217 11.856 -22.411 883 2HD PRO 108 2HD PRO 108 5.264 10.707 -21.057 884 H ASP 109 H ASP 109 2.771 14.701 -19.395 885 HA ASP 109 HA ASP 109 2.707 16.844 -21.390 886 1HB ASP 109 1HB ASP 109 0.461 16.165 -19.505 887 2HB ASP 109 2HB ASP 109 0.374 16.923 -21.091 888 H THR 110 H THR 110 3.395 16.321 -18.125 889 HA THR 110 HA THR 110 3.273 19.204 -17.579 890 HB THR 110 HB THR 110 2.468 18.777 -15.339 891 HG1 THR 110 HG1 THR 110 2.397 16.036 -16.045 892 1HG2 THR 110 1HG2 THR 110 0.270 17.943 -15.737 893 2HG2 THR 110 2HG2 THR 110 0.779 17.172 -17.234 894 3HG2 THR 110 3HG2 THR 110 0.756 18.931 -17.110 895 H ARG 111 H ARG 111 4.521 19.614 -15.405 896 HA ARG 111 HA ARG 111 7.162 18.456 -15.798 897 1HB ARG 111 1HB ARG 111 6.233 20.679 -13.967 898 2HB ARG 111 2HB ARG 111 7.906 20.196 -14.207 899 1HG ARG 111 1HG ARG 111 6.329 20.946 -16.603 900 2HG ARG 111 2HG ARG 111 6.827 22.231 -15.500 901 1HD ARG 111 1HD ARG 111 8.477 21.943 -17.250 902 2HD ARG 111 2HD ARG 111 9.154 21.472 -15.693 903 HE ARG 111 HE ARG 111 8.430 19.680 -17.896 904 1HH1 ARG 111 1HH1 ARG 111 9.816 20.117 -14.714 905 2HH1 ARG 111 2HH1 ARG 111 10.559 18.555 -14.692 906 1HH2 ARG 111 1HH2 ARG 111 9.407 17.626 -17.855 907 2HH2 ARG 111 2HH2 ARG 111 10.327 17.142 -16.469 908 H ILE 112 H ILE 112 7.188 16.452 -14.923 909 HA ILE 112 HA ILE 112 6.077 15.960 -12.294 910 HB ILE 112 HB ILE 112 7.616 14.115 -14.129 911 1HG1 ILE 112 1HG1 ILE 112 4.806 13.514 -13.730 912 2HG1 ILE 112 2HG1 ILE 112 5.019 15.133 -14.388 913 1HG2 ILE 112 1HG2 ILE 112 6.212 13.672 -11.515 914 2HG2 ILE 112 2HG2 ILE 112 7.846 13.206 -11.988 915 3HG2 ILE 112 3HG2 ILE 112 6.456 12.360 -12.668 916 1HD1 ILE 112 1HD1 ILE 112 5.824 14.370 -16.365 917 2HD1 ILE 112 2HD1 ILE 112 4.802 13.002 -15.927 918 3HD1 ILE 112 3HD1 ILE 112 6.542 12.928 -15.648 919 H ILE 113 H ILE 113 7.173 16.139 -10.461 920 HA ILE 113 HA ILE 113 10.092 15.837 -10.476 921 HB ILE 113 HB ILE 113 10.405 17.791 -9.068 922 1HG1 ILE 113 1HG1 ILE 113 7.424 18.211 -9.406 923 2HG1 ILE 113 2HG1 ILE 113 8.256 17.802 -7.910 924 1HG2 ILE 113 1HG2 ILE 113 10.772 18.503 -11.195 925 2HG2 ILE 113 2HG2 ILE 113 9.405 19.542 -10.796 926 3HG2 ILE 113 3HG2 ILE 113 9.151 18.076 -11.739 927 1HD1 ILE 113 1HD1 ILE 113 9.524 20.099 -8.745 928 2HD1 ILE 113 2HD1 ILE 113 8.284 19.976 -7.497 929 3HD1 ILE 113 3HD1 ILE 113 7.831 20.377 -9.154 930 H ARG 114 H ARG 114 10.801 14.614 -8.817 931 HA ARG 114 HA ARG 114 9.129 14.405 -6.428 932 1HB ARG 114 1HB ARG 114 9.419 11.967 -6.361 933 2HB ARG 114 2HB ARG 114 8.534 12.486 -7.786 934 1HG ARG 114 1HG ARG 114 11.468 12.150 -8.034 935 2HG ARG 114 2HG ARG 114 10.472 10.699 -7.910 936 1HD ARG 114 1HD ARG 114 9.832 10.895 -10.027 937 2HD ARG 114 2HD ARG 114 9.279 12.547 -9.751 938 HE ARG 114 HE ARG 114 11.969 12.805 -9.976 939 1HH1 ARG 114 1HH1 ARG 114 9.513 11.345 -11.981 940 2HH1 ARG 114 2HH1 ARG 114 10.366 11.643 -13.458 941 1HH2 ARG 114 1HH2 ARG 114 13.091 13.197 -11.918 942 2HH2 ARG 114 2HH2 ARG 114 12.396 12.694 -13.423 943 H GLU 115 H GLU 115 10.202 14.356 -4.560 944 HA GLU 115 HA GLU 115 13.110 13.915 -4.623 945 1HB GLU 115 1HB GLU 115 13.369 15.780 -3.012 946 2HB GLU 115 2HB GLU 115 12.740 16.314 -4.567 947 1HG GLU 115 1HG GLU 115 10.751 16.934 -3.709 948 2HG GLU 115 2HG GLU 115 10.727 15.620 -2.534 949 H GLY 116 H GLY 116 14.011 13.005 -2.760 950 1HA GLY 116 1HA GLY 116 14.067 11.939 -0.712 951 2HA GLY 116 2HA GLY 116 12.438 12.518 -0.406 952 H ARG 117 H ARG 117 14.139 10.188 -2.505 953 HA ARG 117 HA ARG 117 13.368 8.213 -3.426 954 1HB ARG 117 1HB ARG 117 13.092 6.506 -1.674 955 2HB ARG 117 2HB ARG 117 14.456 7.566 -1.356 956 1HG ARG 117 1HG ARG 117 11.879 8.306 -0.106 957 2HG ARG 117 2HG ARG 117 12.687 6.868 0.510 958 1HD ARG 117 1HD ARG 117 13.740 9.686 0.411 959 2HD ARG 117 2HD ARG 117 13.425 8.697 1.831 960 HE ARG 117 HE ARG 117 15.762 8.637 0.146 961 1HH1 ARG 117 1HH1 ARG 117 13.856 6.888 2.494 962 2HH1 ARG 117 2HH1 ARG 117 15.178 5.892 3.005 963 1HH2 ARG 117 1HH2 ARG 117 17.495 7.334 0.821 964 2HH2 ARG 117 2HH2 ARG 117 17.243 6.146 2.056 965 H ILE 118 H ILE 118 11.488 9.343 -4.420 966 HA ILE 118 HA ILE 118 9.270 9.691 -4.832 967 HB ILE 118 HB ILE 118 9.580 7.361 -5.591 968 1HG1 ILE 118 1HG1 ILE 118 6.873 7.931 -4.358 969 2HG1 ILE 118 2HG1 ILE 118 7.443 8.554 -5.901 970 1HG2 ILE 118 1HG2 ILE 118 10.066 6.429 -3.303 971 2HG2 ILE 118 2HG2 ILE 118 8.958 5.479 -4.284 972 3HG2 ILE 118 3HG2 ILE 118 8.334 6.493 -2.990 973 1HD1 ILE 118 1HD1 ILE 118 6.951 6.663 -6.974 974 2HD1 ILE 118 2HD1 ILE 118 5.934 6.328 -5.574 975 3HD1 ILE 118 3HD1 ILE 118 7.553 5.648 -5.669 976 H SER 119 H SER 119 9.338 11.076 -2.812 977 HA SER 119 HA SER 119 7.297 10.076 -0.940 978 1HB SER 119 1HB SER 119 9.775 11.692 -0.348 979 2HB SER 119 2HB SER 119 8.417 11.608 0.773 980 HG SER 119 HG SER 119 8.952 9.131 0.080 981 H LEU 120 H LEU 120 8.641 12.850 -2.651 982 HA LEU 120 HA LEU 120 6.060 14.231 -2.282 983 1HB LEU 120 1HB LEU 120 8.762 15.563 -2.504 984 2HB LEU 120 2HB LEU 120 7.221 16.369 -2.319 985 HG LEU 120 HG LEU 120 8.291 16.471 -0.216 986 1HD1 LEU 120 1HD1 LEU 120 5.993 16.039 0.086 987 2HD1 LEU 120 2HD1 LEU 120 6.850 15.010 1.232 988 3HD1 LEU 120 3HD1 LEU 120 6.194 14.321 -0.251 989 1HD2 LEU 120 1HD2 LEU 120 8.598 13.514 0.005 990 2HD2 LEU 120 2HD2 LEU 120 9.465 14.803 0.838 991 3HD2 LEU 120 3HD2 LEU 120 9.813 14.457 -0.855 992 H LEU 121 H LEU 121 5.228 15.305 -4.115 993 HA LEU 121 HA LEU 121 6.768 15.373 -6.573 994 1HB LEU 121 1HB LEU 121 4.122 14.080 -6.902 995 2HB LEU 121 2HB LEU 121 5.586 13.872 -7.837 996 HG LEU 121 HG LEU 121 6.149 12.750 -5.326 997 1HD1 LEU 121 1HD1 LEU 121 3.466 11.816 -6.321 998 2HD1 LEU 121 2HD1 LEU 121 3.722 12.798 -4.879 999 3HD1 LEU 121 3HD1 LEU 121 4.379 11.164 -4.961 1000 1HD2 LEU 121 1HD2 LEU 121 6.776 12.090 -7.725 1001 2HD2 LEU 121 2HD2 LEU 121 5.270 11.176 -7.716 1002 3HD2 LEU 121 3HD2 LEU 121 6.534 10.804 -6.543 1003 H LYS 122 H LYS 122 5.996 16.937 -8.053 1004 HA LYS 122 HA LYS 122 3.560 18.355 -7.178 1005 1HB LYS 122 1HB LYS 122 6.163 19.375 -7.289 1006 2HB LYS 122 2HB LYS 122 5.328 20.065 -8.675 1007 1HG LYS 122 1HG LYS 122 3.443 20.486 -6.869 1008 2HG LYS 122 2HG LYS 122 4.828 20.451 -5.785 1009 1HD LYS 122 1HD LYS 122 4.694 22.157 -8.257 1010 2HD LYS 122 2HD LYS 122 4.214 22.724 -6.656 1011 1HE LYS 122 1HE LYS 122 6.343 22.943 -5.967 1012 2HE LYS 122 2HE LYS 122 6.856 21.458 -6.767 1013 1HZ LYS 122 1HZ LYS 122 7.808 23.621 -7.631 1014 2HZ LYS 122 2HZ LYS 122 6.280 23.921 -8.292 1015 3HZ LYS 122 3HZ LYS 122 7.160 22.562 -8.781 1016 H CYS 123 H CYS 123 2.145 19.140 -8.698 1017 HA CYS 123 HA CYS 123 2.683 18.578 -11.529 1018 1HB CYS 123 1HB CYS 123 0.595 17.374 -9.786 1019 2HB CYS 123 2HB CYS 123 0.147 17.749 -11.442 1020 H GLU 124 H GLU 124 2.700 21.101 -10.349 1021 HA GLU 124 HA GLU 124 0.402 22.556 -10.151 1022 1HB GLU 124 1HB GLU 124 3.063 23.341 -11.327 1023 2HB GLU 124 2HB GLU 124 1.762 24.497 -11.081 1024 1HG GLU 124 1HG GLU 124 3.181 22.886 -8.979 1025 2HG GLU 124 2HG GLU 124 3.284 24.625 -9.239 1026 H ALA 125 H ALA 125 1.799 21.259 -13.071 1027 HA ALA 125 HA ALA 125 0.354 22.889 -14.901 1028 1HB ALA 125 1HB ALA 125 0.888 20.731 -16.386 1029 2HB ALA 125 2HB ALA 125 2.039 20.477 -15.076 1030 3HB ALA 125 3HB ALA 125 2.085 21.969 -16.013 1031 H CYS 126 H CYS 126 -0.082 19.355 -14.409 1032 HA CYS 126 HA CYS 126 -2.819 19.587 -15.312 1033 1HB CYS 126 1HB CYS 126 -2.945 17.169 -15.062 1034 2HB CYS 126 2HB CYS 126 -1.489 17.614 -15.942 1035 H GLY 127 H GLY 127 -2.558 21.144 -13.115 1036 1HA GLY 127 1HA GLY 127 -4.374 21.298 -11.477 1037 2HA GLY 127 2HA GLY 127 -4.036 19.623 -11.066 1038 H ALA 128 H ALA 128 -3.018 19.404 -9.202 1039 HA ALA 128 HA ALA 128 -0.726 21.047 -8.598 1040 1HB ALA 128 1HB ALA 128 -2.563 22.428 -7.758 1041 2HB ALA 128 2HB ALA 128 -1.518 21.853 -6.457 1042 3HB ALA 128 3HB ALA 128 -3.088 21.095 -6.729 1043 H LYS 129 H LYS 129 0.537 20.262 -6.845 1044 HA LYS 129 HA LYS 129 -0.212 17.770 -5.584 1045 1HB LYS 129 1HB LYS 129 1.715 17.903 -7.818 1046 2HB LYS 129 2HB LYS 129 2.223 16.971 -6.430 1047 1HG LYS 129 1HG LYS 129 -0.163 15.913 -6.682 1048 2HG LYS 129 2HG LYS 129 0.021 16.468 -8.345 1049 1HD LYS 129 1HD LYS 129 1.162 14.590 -8.727 1050 2HD LYS 129 2HD LYS 129 2.459 15.284 -7.751 1051 1HE LYS 129 1HE LYS 129 2.201 13.566 -6.360 1052 2HE LYS 129 2HE LYS 129 0.656 14.275 -5.895 1053 1HZ LYS 129 1HZ LYS 129 1.206 11.982 -7.591 1054 2HZ LYS 129 2HZ LYS 129 -0.052 12.989 -8.104 1055 3HZ LYS 129 3HZ LYS 129 -0.107 12.284 -6.567 1056 H ALA 130 H ALA 130 1.215 17.189 -3.846 1057 HA ALA 130 HA ALA 130 2.355 19.509 -2.582 1058 1HB ALA 130 1HB ALA 130 2.466 18.227 -0.624 1059 2HB ALA 130 2HB ALA 130 2.480 16.707 -1.519 1060 3HB ALA 130 3HB ALA 130 1.007 17.675 -1.446 1061 HA PRO 131 HA PRO 131 6.411 18.377 -4.281 1062 1HB PRO 131 1HB PRO 131 7.579 20.773 -3.858 1063 2HB PRO 131 2HB PRO 131 6.511 20.471 -5.231 1064 1HG PRO 131 1HG PRO 131 5.936 21.855 -2.648 1065 2HG PRO 131 2HG PRO 131 5.402 22.272 -4.285 1066 1HD PRO 131 1HD PRO 131 3.831 20.978 -2.454 1067 2HD PRO 131 2HD PRO 131 3.640 20.823 -4.209 1068 H LEU 132 H LEU 132 5.658 19.943 -1.228 1069 HA LEU 132 HA LEU 132 7.301 18.236 0.287 1070 1HB LEU 132 1HB LEU 132 9.090 19.532 -0.793 1071 2HB LEU 132 2HB LEU 132 8.386 21.013 -0.178 1072 HG LEU 132 HG LEU 132 8.910 20.365 2.104 1073 1HD1 LEU 132 1HD1 LEU 132 9.572 18.322 2.772 1074 2HD1 LEU 132 2HD1 LEU 132 10.565 18.058 1.342 1075 3HD1 LEU 132 3HD1 LEU 132 8.824 17.793 1.267 1076 1HD2 LEU 132 1HD2 LEU 132 10.610 21.604 1.063 1077 2HD2 LEU 132 2HD2 LEU 132 11.135 20.227 0.095 1078 3HD2 LEU 132 3HD2 LEU 132 11.433 20.248 1.833 1079 H LYS 133 H LYS 133 6.427 21.694 0.345 1080 HA LYS 133 HA LYS 133 4.407 21.304 2.314 1081 1HB LYS 133 1HB LYS 133 7.063 21.617 3.270 1082 2HB LYS 133 2HB LYS 133 6.192 23.099 3.638 1083 1HG LYS 133 1HG LYS 133 4.962 22.123 5.219 1084 2HG LYS 133 2HG LYS 133 4.674 20.684 4.240 1085 1HD LYS 133 1HD LYS 133 6.234 19.544 5.345 1086 2HD LYS 133 2HD LYS 133 7.431 20.811 5.067 1087 1HE LYS 133 1HE LYS 133 6.633 22.033 6.997 1088 2HE LYS 133 2HE LYS 133 5.347 20.853 7.245 1089 1HZ LYS 133 1HZ LYS 133 8.211 20.106 7.289 1090 2HZ LYS 133 2HZ LYS 133 6.891 19.215 7.859 1091 3HZ LYS 133 3HZ LYS 133 7.386 20.610 8.679 1092 H ASN 134 H ASN 134 6.735 23.925 1.626 1093 HA ASN 134 HA ASN 134 4.943 25.426 0.040 1094 1HB ASN 134 1HB ASN 134 4.635 25.695 2.903 1095 2HB ASN 134 2HB ASN 134 5.113 27.230 2.184 1096 1HD2 ASN 134 1HD2 ASN 134 3.773 28.178 0.616 1097 2HD2 ASN 134 2HD2 ASN 134 2.104 27.752 0.484 1098 H VAL 135 H VAL 135 6.724 25.737 -1.254 1099 HA VAL 135 HA VAL 135 8.700 27.654 -0.224 1100 HB VAL 135 HB VAL 135 9.812 25.502 -0.210 1101 1HG1 VAL 135 1HG1 VAL 135 8.178 24.795 -2.233 1102 2HG1 VAL 135 2HG1 VAL 135 9.651 23.924 -1.807 1103 3HG1 VAL 135 3HG1 VAL 135 9.670 25.098 -3.123 1104 1HG2 VAL 135 1HG2 VAL 135 11.301 27.224 -0.765 1105 2HG2 VAL 135 2HG2 VAL 135 10.637 27.399 -2.389 1106 3HG2 VAL 135 3HG2 VAL 135 11.599 25.979 -1.978 Start of MODEL 8 1 H MET 1 H MET 1 2.120 -7.190 -22.766 2 HA MET 1 HA MET 1 -0.241 -8.366 -21.532 3 1HB MET 1 1HB MET 1 0.012 -8.148 -23.984 4 2HB MET 1 2HB MET 1 1.498 -9.083 -23.902 5 1HG MET 1 1HG MET 1 0.384 -10.990 -23.975 6 2HG MET 1 2HG MET 1 -0.640 -10.507 -22.623 7 1HE MET 1 1HE MET 1 -0.889 -12.072 -25.699 8 2HE MET 1 2HE MET 1 -0.279 -10.656 -26.554 9 3HE MET 1 3HE MET 1 -1.945 -11.181 -26.795 10 H ASP 2 H ASP 2 0.137 -9.560 -19.777 11 HA ASP 2 HA ASP 2 1.822 -11.826 -19.864 12 1HB ASP 2 1HB ASP 2 3.034 -9.372 -18.925 13 2HB ASP 2 2HB ASP 2 3.008 -10.581 -17.646 14 H ASP 3 H ASP 3 0.728 -13.267 -18.724 15 HA ASP 3 HA ASP 3 -0.992 -12.343 -16.539 16 1HB ASP 3 1HB ASP 3 -1.440 -14.123 -18.632 17 2HB ASP 3 2HB ASP 3 -1.234 -15.162 -17.226 18 H TYR 4 H TYR 4 -1.134 -13.666 -14.583 19 HA TYR 4 HA TYR 4 1.520 -14.414 -13.678 20 1HB TYR 4 1HB TYR 4 -0.980 -14.534 -12.007 21 2HB TYR 4 2HB TYR 4 0.680 -14.271 -11.485 22 HD1 TYR 4 HD1 TYR 4 -2.325 -12.697 -11.709 23 HD2 TYR 4 HD2 TYR 4 1.723 -12.093 -12.870 24 HE1 TYR 4 HE1 TYR 4 -2.707 -10.269 -11.754 25 HE2 TYR 4 HE2 TYR 4 1.354 -9.663 -12.916 26 HH TYR 4 HH TYR 4 -1.612 -8.255 -12.985 27 H GLU 5 H GLU 5 1.507 -16.304 -15.174 28 HA GLU 5 HA GLU 5 -0.184 -18.533 -14.459 29 1HB GLU 5 1HB GLU 5 1.530 -17.816 -16.664 30 2HB GLU 5 2HB GLU 5 1.919 -19.437 -16.102 31 1HG GLU 5 1HG GLU 5 -0.945 -18.814 -16.444 32 2HG GLU 5 2HG GLU 5 0.025 -18.919 -17.912 33 H LYS 6 H LYS 6 3.352 -18.046 -14.534 34 HA LYS 6 HA LYS 6 3.663 -19.301 -11.966 35 1HB LYS 6 1HB LYS 6 3.606 -21.017 -14.128 36 2HB LYS 6 2HB LYS 6 5.326 -20.738 -13.896 37 1HG LYS 6 1HG LYS 6 5.382 -21.848 -11.931 38 2HG LYS 6 2HG LYS 6 3.757 -21.338 -11.469 39 1HD LYS 6 1HD LYS 6 3.337 -22.955 -13.676 40 2HD LYS 6 2HD LYS 6 4.641 -23.765 -12.804 41 1HE LYS 6 1HE LYS 6 2.390 -22.788 -11.164 42 2HE LYS 6 2HE LYS 6 2.028 -24.121 -12.260 43 1HZ LYS 6 1HZ LYS 6 2.708 -25.165 -10.325 44 2HZ LYS 6 2HZ LYS 6 3.939 -24.049 -10.015 45 3HZ LYS 6 3HZ LYS 6 4.118 -25.177 -11.260 46 H LEU 7 H LEU 7 5.788 -19.109 -11.126 47 HA LEU 7 HA LEU 7 7.279 -16.931 -12.352 48 1HB LEU 7 1HB LEU 7 7.230 -18.204 -9.647 49 2HB LEU 7 2HB LEU 7 8.649 -17.297 -10.136 50 HG LEU 7 HG LEU 7 6.123 -15.866 -10.568 51 1HD1 LEU 7 1HD1 LEU 7 5.353 -15.674 -8.450 52 2HD1 LEU 7 2HD1 LEU 7 6.946 -15.912 -7.730 53 3HD1 LEU 7 3HD1 LEU 7 6.026 -17.298 -8.317 54 1HD2 LEU 7 1HD2 LEU 7 7.493 -14.120 -10.412 55 2HD2 LEU 7 2HD2 LEU 7 8.826 -15.272 -10.313 56 3HD2 LEU 7 3HD2 LEU 7 8.092 -14.643 -8.837 57 H LEU 8 H LEU 8 7.567 -18.983 -13.982 58 HA LEU 8 HA LEU 8 9.857 -20.607 -13.290 59 1HB LEU 8 1HB LEU 8 7.756 -21.003 -14.953 60 2HB LEU 8 2HB LEU 8 8.967 -20.469 -16.103 61 HG LEU 8 HG LEU 8 10.349 -22.341 -14.644 62 1HD1 LEU 8 1HD1 LEU 8 8.903 -24.315 -14.533 63 2HD1 LEU 8 2HD1 LEU 8 7.517 -23.318 -14.976 64 3HD1 LEU 8 3HD1 LEU 8 8.354 -23.037 -13.450 65 1HD2 LEU 8 1HD2 LEU 8 10.525 -23.432 -16.635 66 2HD2 LEU 8 2HD2 LEU 8 9.878 -21.896 -17.214 67 3HD2 LEU 8 3HD2 LEU 8 8.805 -23.279 -16.999 68 H GLU 9 H GLU 9 10.332 -17.802 -13.223 69 HA GLU 9 HA GLU 9 12.167 -17.450 -15.491 70 1HB GLU 9 1HB GLU 9 10.377 -15.744 -15.314 71 2HB GLU 9 2HB GLU 9 10.946 -15.340 -13.701 72 1HG GLU 9 1HG GLU 9 12.252 -13.819 -14.630 73 2HG GLU 9 2HG GLU 9 13.199 -15.136 -15.315 74 H ARG 10 H ARG 10 14.253 -16.635 -15.062 75 HA ARG 10 HA ARG 10 15.163 -17.117 -12.308 76 1HB ARG 10 1HB ARG 10 17.220 -16.942 -14.402 77 2HB ARG 10 2HB ARG 10 17.024 -18.119 -13.112 78 1HG ARG 10 1HG ARG 10 15.676 -19.490 -14.388 79 2HG ARG 10 2HG ARG 10 15.210 -18.194 -15.486 80 1HD ARG 10 1HD ARG 10 17.669 -18.145 -16.181 81 2HD ARG 10 2HD ARG 10 17.800 -19.706 -15.369 82 HE ARG 10 HE ARG 10 16.786 -19.279 -17.936 83 1HH1 ARG 10 1HH1 ARG 10 16.001 -21.057 -15.032 84 2HH1 ARG 10 2HH1 ARG 10 15.047 -22.234 -15.863 85 1HH2 ARG 10 1HH2 ARG 10 15.555 -20.856 -19.029 86 2HH2 ARG 10 2HH2 ARG 10 14.805 -22.130 -18.127 87 H ALA 11 H ALA 11 17.596 -15.871 -12.363 88 HA ALA 11 HA ALA 11 18.519 -13.847 -11.893 89 1HB ALA 11 1HB ALA 11 17.433 -12.287 -14.017 90 2HB ALA 11 2HB ALA 11 17.800 -13.911 -14.596 91 3HB ALA 11 3HB ALA 11 19.058 -12.943 -13.830 92 H ILE 12 H ILE 12 16.402 -14.178 -10.283 93 HA ILE 12 HA ILE 12 14.981 -11.603 -10.368 94 HB ILE 12 HB ILE 12 14.168 -13.993 -8.725 95 1HG1 ILE 12 1HG1 ILE 12 12.737 -13.256 -11.239 96 2HG1 ILE 12 2HG1 ILE 12 14.223 -14.190 -11.371 97 1HG2 ILE 12 1HG2 ILE 12 13.263 -11.287 -8.919 98 2HG2 ILE 12 2HG2 ILE 12 12.692 -12.578 -7.862 99 3HG2 ILE 12 3HG2 ILE 12 11.985 -12.372 -9.464 100 1HD1 ILE 12 1HD1 ILE 12 12.707 -15.865 -11.260 101 2HD1 ILE 12 2HD1 ILE 12 11.591 -14.955 -10.250 102 3HD1 ILE 12 3HD1 ILE 12 13.041 -15.671 -9.544 103 H ASP 13 H ASP 13 17.375 -13.359 -8.683 104 HA ASP 13 HA ASP 13 17.451 -11.277 -6.642 105 1HB ASP 13 1HB ASP 13 16.124 -13.240 -5.773 106 2HB ASP 13 2HB ASP 13 17.603 -14.187 -5.855 107 H GLN 14 H GLN 14 19.261 -14.293 -6.345 108 HA GLN 14 HA GLN 14 21.716 -12.757 -6.714 109 1HB GLN 14 1HB GLN 14 21.338 -15.565 -5.658 110 2HB GLN 14 2HB GLN 14 22.850 -14.667 -5.678 111 1HG GLN 14 1HG GLN 14 20.594 -13.350 -4.324 112 2HG GLN 14 2HG GLN 14 21.218 -14.808 -3.555 113 1HE2 GLN 14 1HE2 GLN 14 22.462 -14.195 -1.936 114 2HE2 GLN 14 2HE2 GLN 14 23.700 -12.992 -2.008 115 H LEU 15 H LEU 15 20.763 -12.913 -9.092 116 HA LEU 15 HA LEU 15 22.304 -15.041 -10.411 117 1HB LEU 15 1HB LEU 15 19.502 -14.145 -10.984 118 2HB LEU 15 2HB LEU 15 20.450 -15.031 -12.158 119 HG LEU 15 HG LEU 15 19.049 -16.618 -11.137 120 1HD1 LEU 15 1HD1 LEU 15 21.772 -16.855 -10.971 121 2HD1 LEU 15 2HD1 LEU 15 20.604 -18.152 -10.729 122 3HD1 LEU 15 3HD1 LEU 15 21.242 -17.273 -9.341 123 1HD2 LEU 15 1HD2 LEU 15 19.899 -16.047 -8.353 124 2HD2 LEU 15 2HD2 LEU 15 18.374 -16.679 -8.967 125 3HD2 LEU 15 3HD2 LEU 15 18.730 -14.956 -9.098 126 HA PRO 16 HA PRO 16 24.182 -11.908 -12.902 127 1HB PRO 16 1HB PRO 16 23.877 -13.087 -15.421 128 2HB PRO 16 2HB PRO 16 25.226 -13.346 -14.311 129 1HG PRO 16 1HG PRO 16 22.806 -15.021 -14.783 130 2HG PRO 16 2HG PRO 16 24.468 -15.521 -14.416 131 1HD PRO 16 1HD PRO 16 22.538 -15.599 -12.557 132 2HD PRO 16 2HD PRO 16 24.207 -15.150 -12.141 133 HA PRO 17 HA PRO 17 21.191 -9.221 -14.699 134 1HB PRO 17 1HB PRO 17 22.397 -8.387 -17.032 135 2HB PRO 17 2HB PRO 17 22.783 -7.761 -15.427 136 1HG PRO 17 1HG PRO 17 24.199 -9.852 -17.032 137 2HG PRO 17 2HG PRO 17 24.879 -8.535 -16.059 138 1HD PRO 17 1HD PRO 17 24.810 -11.054 -15.145 139 2HD PRO 17 2HD PRO 17 24.547 -9.670 -14.064 140 H GLU 18 H GLU 18 22.368 -10.089 -17.892 141 HA GLU 18 HA GLU 18 21.307 -10.934 -19.710 142 1HB GLU 18 1HB GLU 18 21.153 -12.868 -17.611 143 2HB GLU 18 2HB GLU 18 19.689 -12.973 -18.579 144 1HG GLU 18 1HG GLU 18 20.926 -13.375 -20.561 145 2HG GLU 18 2HG GLU 18 22.450 -13.007 -19.754 146 H VAL 19 H VAL 19 18.598 -11.893 -17.650 147 HA VAL 19 HA VAL 19 16.885 -10.115 -19.226 148 HB VAL 19 HB VAL 19 16.043 -12.391 -17.426 149 1HG1 VAL 19 1HG1 VAL 19 14.505 -10.352 -18.273 150 2HG1 VAL 19 2HG1 VAL 19 13.901 -11.989 -18.021 151 3HG1 VAL 19 3HG1 VAL 19 14.337 -11.451 -19.641 152 1HG2 VAL 19 1HG2 VAL 19 16.605 -12.309 -20.380 153 2HG2 VAL 19 2HG2 VAL 19 15.606 -13.554 -19.631 154 3HG2 VAL 19 3HG2 VAL 19 17.297 -13.384 -19.164 155 H PHE 20 H PHE 20 16.833 -8.176 -18.281 156 HA PHE 20 HA PHE 20 16.502 -8.002 -15.385 157 1HB PHE 20 1HB PHE 20 16.690 -5.428 -16.061 158 2HB PHE 20 2HB PHE 20 18.108 -6.445 -15.859 159 HD1 PHE 20 HD1 PHE 20 19.400 -7.176 -17.785 160 HD2 PHE 20 HD2 PHE 20 16.015 -4.640 -18.254 161 HE1 PHE 20 HE1 PHE 20 20.122 -6.626 -20.073 162 HE2 PHE 20 HE2 PHE 20 16.723 -4.098 -20.534 163 HZ PHE 20 HZ PHE 20 18.780 -5.086 -21.450 164 H GLU 21 H GLU 21 15.257 -5.461 -17.374 165 HA GLU 21 HA GLU 21 13.217 -4.556 -17.640 166 1HB GLU 21 1HB GLU 21 12.952 -7.284 -18.282 167 2HB GLU 21 2HB GLU 21 11.550 -6.879 -17.300 168 1HG GLU 21 1HG GLU 21 11.084 -4.983 -18.805 169 2HG GLU 21 2HG GLU 21 12.438 -5.486 -19.814 170 H THR 22 H THR 22 10.814 -4.809 -16.609 171 HA THR 22 HA THR 22 11.159 -4.011 -13.904 172 HB THR 22 HB THR 22 9.431 -3.071 -15.408 173 HG1 THR 22 HG1 THR 22 7.839 -4.133 -13.442 174 1HG2 THR 22 1HG2 THR 22 7.242 -4.538 -15.365 175 2HG2 THR 22 2HG2 THR 22 8.414 -5.856 -15.376 176 3HG2 THR 22 3HG2 THR 22 8.418 -4.661 -16.673 177 H LYS 23 H LYS 23 10.519 -5.023 -12.013 178 HA LYS 23 HA LYS 23 10.688 -7.875 -12.016 179 1HB LYS 23 1HB LYS 23 11.218 -5.928 -10.171 180 2HB LYS 23 2HB LYS 23 9.705 -6.575 -9.561 181 1HG LYS 23 1HG LYS 23 11.452 -7.753 -8.488 182 2HG LYS 23 2HG LYS 23 10.742 -8.855 -9.670 183 1HD LYS 23 1HD LYS 23 12.960 -9.188 -10.114 184 2HD LYS 23 2HD LYS 23 12.638 -7.846 -11.214 185 1HE LYS 23 1HE LYS 23 13.710 -7.527 -8.415 186 2HE LYS 23 2HE LYS 23 14.718 -7.587 -9.861 187 1HZ LYS 23 1HZ LYS 23 13.003 -5.695 -10.560 188 2HZ LYS 23 2HZ LYS 23 14.449 -5.367 -9.751 189 3HZ LYS 23 3HZ LYS 23 12.998 -5.456 -8.885 190 H ARG 24 H ARG 24 9.044 -9.160 -10.674 191 HA ARG 24 HA ARG 24 6.434 -8.721 -11.868 192 1HB ARG 24 1HB ARG 24 7.925 -10.987 -11.116 193 2HB ARG 24 2HB ARG 24 6.536 -10.957 -10.040 194 1HG ARG 24 1HG ARG 24 5.741 -12.204 -11.793 195 2HG ARG 24 2HG ARG 24 5.184 -10.588 -12.234 196 1HD ARG 24 1HD ARG 24 7.833 -11.596 -13.202 197 2HD ARG 24 2HD ARG 24 6.345 -12.080 -14.014 198 HE ARG 24 HE ARG 24 6.854 -9.228 -13.623 199 1HH1 ARG 24 1HH1 ARG 24 6.690 -11.960 -15.798 200 2HH1 ARG 24 2HH1 ARG 24 6.601 -10.975 -17.217 201 1HH2 ARG 24 1HH2 ARG 24 6.736 -7.942 -15.488 202 2HH2 ARG 24 2HH2 ARG 24 6.630 -8.696 -17.043 203 H PHE 25 H PHE 25 7.300 -6.829 -9.908 204 HA PHE 25 HA PHE 25 5.770 -7.406 -7.510 205 1HB PHE 25 1HB PHE 25 7.711 -5.296 -8.344 206 2HB PHE 25 2HB PHE 25 6.559 -4.913 -7.069 207 HD1 PHE 25 HD1 PHE 25 9.755 -5.461 -7.268 208 HD2 PHE 25 HD2 PHE 25 6.376 -7.477 -5.646 209 HE1 PHE 25 HE1 PHE 25 11.210 -6.570 -5.624 210 HE2 PHE 25 HE2 PHE 25 7.825 -8.590 -3.999 211 HZ PHE 25 HZ PHE 25 10.246 -8.136 -3.986 212 H GLU 26 H GLU 26 3.701 -7.503 -8.502 213 HA GLU 26 HA GLU 26 2.539 -4.845 -8.892 214 1HB GLU 26 1HB GLU 26 2.104 -7.210 -10.716 215 2HB GLU 26 2HB GLU 26 1.158 -5.728 -10.759 216 1HG GLU 26 1HG GLU 26 4.009 -5.223 -10.897 217 2HG GLU 26 2HG GLU 26 3.439 -6.260 -12.205 218 H VAL 27 H VAL 27 1.185 -4.696 -7.234 219 HA VAL 27 HA VAL 27 -0.909 -6.671 -6.982 220 HB VAL 27 HB VAL 27 1.139 -7.279 -5.538 221 1HG1 VAL 27 1HG1 VAL 27 0.141 -5.833 -3.255 222 2HG1 VAL 27 2HG1 VAL 27 0.732 -4.738 -4.503 223 3HG1 VAL 27 3HG1 VAL 27 1.786 -5.996 -3.861 224 1HG2 VAL 27 1HG2 VAL 27 -1.099 -7.353 -3.701 225 2HG2 VAL 27 2HG2 VAL 27 -0.261 -8.666 -4.517 226 3HG2 VAL 27 3HG2 VAL 27 -1.558 -7.801 -5.341 227 HA PRO 28 HA PRO 28 -1.788 -1.962 -6.228 228 1HB PRO 28 1HB PRO 28 -3.673 -2.656 -8.433 229 2HB PRO 28 2HB PRO 28 -2.769 -1.167 -8.158 230 1HG PRO 28 1HG PRO 28 -2.005 -2.882 -10.033 231 2HG PRO 28 2HG PRO 28 -0.811 -2.030 -9.036 232 1HD PRO 28 1HD PRO 28 -1.728 -4.864 -8.891 233 2HD PRO 28 2HD PRO 28 -0.124 -4.175 -8.588 234 H LYS 29 H LYS 29 -4.153 -1.160 -5.966 235 HA LYS 29 HA LYS 29 -6.271 -1.380 -5.129 236 1HB LYS 29 1HB LYS 29 -5.988 -3.762 -6.403 237 2HB LYS 29 2HB LYS 29 -6.165 -4.318 -4.750 238 1HG LYS 29 1HG LYS 29 -8.334 -3.594 -4.593 239 2HG LYS 29 2HG LYS 29 -8.109 -2.323 -5.797 240 1HD LYS 29 1HD LYS 29 -8.324 -3.797 -7.580 241 2HD LYS 29 2HD LYS 29 -7.923 -5.204 -6.593 242 1HE LYS 29 1HE LYS 29 -10.337 -3.742 -5.768 243 2HE LYS 29 2HE LYS 29 -10.436 -4.520 -7.347 244 1HZ LYS 29 1HZ LYS 29 -10.197 -6.600 -6.438 245 2HZ LYS 29 2HZ LYS 29 -11.085 -5.824 -5.225 246 3HZ LYS 29 3HZ LYS 29 -9.417 -6.039 -5.045 247 H ALA 30 H ALA 30 -6.587 -3.854 -3.152 248 HA ALA 30 HA ALA 30 -6.162 -4.298 -0.954 249 1HB ALA 30 1HB ALA 30 -4.110 -3.812 0.001 250 2HB ALA 30 2HB ALA 30 -3.945 -2.293 -0.880 251 3HB ALA 30 3HB ALA 30 -3.726 -3.825 -1.720 252 H TYR 31 H TYR 31 -6.964 -3.472 0.942 253 HA TYR 31 HA TYR 31 -7.138 -0.681 1.454 254 1HB TYR 31 1HB TYR 31 -9.435 -0.278 1.104 255 2HB TYR 31 2HB TYR 31 -8.888 -1.086 -0.355 256 HD1 TYR 31 HD1 TYR 31 -10.891 -1.409 2.690 257 HD2 TYR 31 HD2 TYR 31 -9.684 -3.293 -0.919 258 HE1 TYR 31 HE1 TYR 31 -12.669 -3.082 2.984 259 HE2 TYR 31 HE2 TYR 31 -11.461 -4.971 -0.646 260 HH TYR 31 HH TYR 31 -13.940 -4.798 0.841 261 H SER 32 H SER 32 -7.938 -0.208 3.531 262 HA SER 32 HA SER 32 -7.831 -2.463 5.355 263 1HB SER 32 1HB SER 32 -8.049 -0.521 7.070 264 2HB SER 32 2HB SER 32 -6.558 -0.661 6.138 265 HG SER 32 HG SER 32 -7.149 1.030 4.906 266 H VAL 33 H VAL 33 -9.403 -2.094 7.385 267 HA VAL 33 HA VAL 33 -12.102 -1.528 6.377 268 HB VAL 33 HB VAL 33 -12.839 -3.539 7.846 269 1HG1 VAL 33 1HG1 VAL 33 -13.351 -3.571 5.567 270 2HG1 VAL 33 2HG1 VAL 33 -12.455 -5.066 5.833 271 3HG1 VAL 33 3HG1 VAL 33 -11.655 -3.678 5.096 272 1HG2 VAL 33 1HG2 VAL 33 -9.953 -3.872 7.802 273 2HG2 VAL 33 2HG2 VAL 33 -10.811 -5.292 7.210 274 3HG2 VAL 33 3HG2 VAL 33 -11.174 -4.645 8.808 275 H ILE 34 H ILE 34 -13.471 -0.587 7.785 276 HA ILE 34 HA ILE 34 -12.375 0.088 10.412 277 HB ILE 34 HB ILE 34 -12.820 2.071 9.265 278 1HG1 ILE 34 1HG1 ILE 34 -14.008 1.595 11.610 279 2HG1 ILE 34 2HG1 ILE 34 -14.122 3.150 10.798 280 1HG2 ILE 34 1HG2 ILE 34 -14.664 0.597 7.798 281 2HG2 ILE 34 2HG2 ILE 34 -14.227 2.287 7.570 282 3HG2 ILE 34 3HG2 ILE 34 -15.609 1.863 8.572 283 1HD1 ILE 34 1HD1 ILE 34 -16.206 1.269 10.012 284 2HD1 ILE 34 2HD1 ILE 34 -16.323 2.955 10.518 285 3HD1 ILE 34 3HD1 ILE 34 -16.219 1.675 11.727 286 H GLN 35 H GLN 35 -13.230 -0.729 12.178 287 HA GLN 35 HA GLN 35 -16.008 -1.210 12.525 288 1HB GLN 35 1HB GLN 35 -14.612 -3.289 11.265 289 2HB GLN 35 2HB GLN 35 -14.786 -3.804 12.937 290 1HG GLN 35 1HG GLN 35 -17.264 -2.719 12.045 291 2HG GLN 35 2HG GLN 35 -16.693 -3.898 10.865 292 1HE2 GLN 35 1HE2 GLN 35 -17.412 -5.859 11.212 293 2HE2 GLN 35 2HE2 GLN 35 -17.770 -6.565 12.747 294 H GLY 36 H GLY 36 -16.535 -1.584 14.684 295 1HA GLY 36 1HA GLY 36 -16.221 -1.302 16.945 296 2HA GLY 36 2HA GLY 36 -14.976 -2.522 16.731 297 H ASN 37 H ASN 37 -15.218 0.905 15.759 298 HA ASN 37 HA ASN 37 -13.675 2.595 15.905 299 1HB ASN 37 1HB ASN 37 -13.468 1.466 18.705 300 2HB ASN 37 2HB ASN 37 -12.923 3.066 18.212 301 1HD2 ASN 37 1HD2 ASN 37 -14.937 2.225 20.179 302 2HD2 ASN 37 2HD2 ASN 37 -16.397 3.028 19.719 303 H ARG 38 H ARG 38 -12.640 0.022 14.969 304 HA ARG 38 HA ARG 38 -9.817 0.577 15.397 305 1HB ARG 38 1HB ARG 38 -9.269 -1.702 15.995 306 2HB ARG 38 2HB ARG 38 -10.443 -1.068 17.125 307 1HG ARG 38 1HG ARG 38 -12.088 -2.252 15.389 308 2HG ARG 38 2HG ARG 38 -10.671 -3.284 15.220 309 1HD ARG 38 1HD ARG 38 -10.955 -2.846 17.964 310 2HD ARG 38 2HD ARG 38 -12.591 -3.122 17.370 311 HE ARG 38 HE ARG 38 -11.316 -5.153 16.242 312 1HH1 ARG 38 1HH1 ARG 38 -11.112 -3.924 19.506 313 2HH1 ARG 38 2HH1 ARG 38 -10.728 -5.465 20.194 314 1HH2 ARG 38 1HH2 ARG 38 -10.818 -7.184 17.154 315 2HH2 ARG 38 2HH2 ARG 38 -10.563 -7.313 18.862 316 H THR 39 H THR 39 -8.421 -0.500 13.828 317 HA THR 39 HA THR 39 -9.888 -1.042 11.344 318 HB THR 39 HB THR 39 -7.793 0.741 11.896 319 HG1 THR 39 HG1 THR 39 -8.431 -0.033 9.279 320 1HG2 THR 39 1HG2 THR 39 -6.740 -1.055 9.768 321 2HG2 THR 39 2HG2 THR 39 -6.310 -1.361 11.446 322 3HG2 THR 39 3HG2 THR 39 -5.917 0.185 10.710 323 H PHE 40 H PHE 40 -10.035 -3.079 10.781 324 HA PHE 40 HA PHE 40 -8.211 -5.072 11.845 325 1HB PHE 40 1HB PHE 40 -10.782 -5.275 11.603 326 2HB PHE 40 2HB PHE 40 -10.449 -5.600 9.911 327 HD1 PHE 40 HD1 PHE 40 -11.450 -7.202 12.617 328 HD2 PHE 40 HD2 PHE 40 -8.172 -7.320 9.909 329 HE1 PHE 40 HE1 PHE 40 -11.108 -9.583 13.138 330 HE2 PHE 40 HE2 PHE 40 -7.838 -9.690 10.419 331 HZ PHE 40 HZ PHE 40 -9.290 -10.830 12.038 332 H ILE 41 H ILE 41 -6.366 -4.108 10.591 333 HA ILE 41 HA ILE 41 -6.354 -4.281 7.762 334 HB ILE 41 HB ILE 41 -4.846 -2.795 9.093 335 1HG1 ILE 41 1HG1 ILE 41 -2.861 -3.200 7.608 336 2HG1 ILE 41 2HG1 ILE 41 -3.665 -4.667 7.053 337 1HG2 ILE 41 1HG2 ILE 41 -4.196 -4.717 10.663 338 2HG2 ILE 41 2HG2 ILE 41 -2.962 -3.556 10.198 339 3HG2 ILE 41 3HG2 ILE 41 -3.023 -5.138 9.421 340 1HD1 ILE 41 1HD1 ILE 41 -4.423 -1.818 6.608 341 2HD1 ILE 41 2HD1 ILE 41 -5.632 -3.099 6.501 342 3HD1 ILE 41 3HD1 ILE 41 -4.232 -3.124 5.443 343 H GLN 42 H GLN 42 -6.319 -6.000 6.570 344 HA GLN 42 HA GLN 42 -5.185 -8.480 7.649 345 1HB GLN 42 1HB GLN 42 -7.258 -8.110 5.484 346 2HB GLN 42 2HB GLN 42 -6.650 -9.657 6.051 347 1HG GLN 42 1HG GLN 42 -7.519 -8.920 8.354 348 2HG GLN 42 2HG GLN 42 -8.419 -7.700 7.461 349 1HE2 GLN 42 1HE2 GLN 42 -10.368 -8.647 8.121 350 2HE2 GLN 42 2HE2 GLN 42 -10.956 -10.100 7.397 351 H ASN 43 H ASN 43 -5.352 -6.421 4.804 352 HA ASN 43 HA ASN 43 -3.245 -8.016 3.545 353 1HB ASN 43 1HB ASN 43 -5.207 -5.992 2.507 354 2HB ASN 43 2HB ASN 43 -3.744 -6.357 1.597 355 1HD2 ASN 43 1HD2 ASN 43 -6.163 -8.231 3.405 356 2HD2 ASN 43 2HD2 ASN 43 -6.446 -9.388 2.155 357 H PHE 44 H PHE 44 -2.363 -6.673 5.744 358 HA PHE 44 HA PHE 44 -1.475 -4.096 5.569 359 1HB PHE 44 1HB PHE 44 -1.079 -5.915 7.411 360 2HB PHE 44 2HB PHE 44 0.430 -6.196 6.550 361 HD1 PHE 44 HD1 PHE 44 1.270 -3.514 5.786 362 HD2 PHE 44 HD2 PHE 44 -0.538 -4.864 9.392 363 HE1 PHE 44 HE1 PHE 44 2.297 -1.641 6.988 364 HE2 PHE 44 HE2 PHE 44 0.492 -2.987 10.606 365 HZ PHE 44 HZ PHE 44 1.907 -1.373 9.401 366 H ARG 45 H ARG 45 -0.007 -6.948 4.053 367 HA ARG 45 HA ARG 45 2.281 -5.645 3.060 368 1HB ARG 45 1HB ARG 45 2.254 -7.559 1.360 369 2HB ARG 45 2HB ARG 45 2.409 -7.969 3.063 370 1HG ARG 45 1HG ARG 45 -0.352 -7.893 2.405 371 2HG ARG 45 2HG ARG 45 0.491 -8.861 1.203 372 1HD ARG 45 1HD ARG 45 0.772 -9.212 4.175 373 2HD ARG 45 2HD ARG 45 -0.331 -10.151 3.172 374 HE ARG 45 HE ARG 45 1.669 -10.974 1.987 375 1HH1 ARG 45 1HH1 ARG 45 2.058 -9.642 5.199 376 2HH1 ARG 45 2HH1 ARG 45 3.521 -10.508 5.509 377 1HH2 ARG 45 1HH2 ARG 45 3.593 -12.104 2.402 378 2HH2 ARG 45 2HH2 ARG 45 4.393 -11.905 3.926 379 H GLU 46 H GLU 46 -0.758 -6.470 1.410 380 HA GLU 46 HA GLU 46 -0.113 -5.150 -1.005 381 1HB GLU 46 1HB GLU 46 -2.051 -6.871 -0.337 382 2HB GLU 46 2HB GLU 46 -2.958 -5.372 -0.196 383 1HG GLU 46 1HG GLU 46 -2.404 -4.798 -2.491 384 2HG GLU 46 2HG GLU 46 -1.452 -6.266 -2.629 385 H VAL 47 H VAL 47 -2.339 -4.221 1.600 386 HA VAL 47 HA VAL 47 -2.930 -1.676 0.677 387 HB VAL 47 HB VAL 47 -4.096 -2.857 2.534 388 1HG1 VAL 47 1HG1 VAL 47 -2.719 -1.894 4.772 389 2HG1 VAL 47 2HG1 VAL 47 -1.507 -2.675 3.763 390 3HG1 VAL 47 3HG1 VAL 47 -2.929 -3.570 4.277 391 1HG2 VAL 47 1HG2 VAL 47 -3.198 -0.083 3.280 392 2HG2 VAL 47 2HG2 VAL 47 -4.723 -0.868 3.693 393 3HG2 VAL 47 3HG2 VAL 47 -4.376 -0.440 2.019 394 H ALA 48 H ALA 48 -0.143 -2.821 2.509 395 HA ALA 48 HA ALA 48 0.881 -0.408 3.391 396 1HB ALA 48 1HB ALA 48 3.079 -2.004 2.599 397 2HB ALA 48 2HB ALA 48 1.825 -3.072 3.211 398 3HB ALA 48 3HB ALA 48 2.427 -1.758 4.218 399 H ASP 49 H ASP 49 2.104 -2.189 0.603 400 HA ASP 49 HA ASP 49 3.638 -0.230 -0.541 401 1HB ASP 49 1HB ASP 49 3.199 -2.699 -1.275 402 2HB ASP 49 2HB ASP 49 1.979 -1.984 -2.322 403 H ALA 50 H ALA 50 0.324 -0.957 -1.683 404 HA ALA 50 HA ALA 50 -0.050 1.147 -3.355 405 1HB ALA 50 1HB ALA 50 -1.914 -0.055 -3.499 406 2HB ALA 50 2HB ALA 50 -2.521 0.946 -2.180 407 3HB ALA 50 3HB ALA 50 -1.787 -0.616 -1.831 408 H LEU 51 H LEU 51 -1.057 1.260 0.087 409 HA LEU 51 HA LEU 51 -1.666 4.008 0.036 410 1HB LEU 51 1HB LEU 51 -2.735 2.906 1.764 411 2HB LEU 51 2HB LEU 51 -1.326 1.955 2.172 412 HG LEU 51 HG LEU 51 -0.289 3.919 3.195 413 1HD1 LEU 51 1HD1 LEU 51 -1.011 5.989 2.871 414 2HD1 LEU 51 2HD1 LEU 51 -2.662 5.563 3.318 415 3HD1 LEU 51 3HD1 LEU 51 -2.101 5.308 1.667 416 1HD2 LEU 51 1HD2 LEU 51 -2.618 4.203 4.773 417 2HD2 LEU 51 2HD2 LEU 51 -1.227 3.164 5.071 418 3HD2 LEU 51 3HD2 LEU 51 -2.606 2.546 4.169 419 H ASN 52 H ASN 52 1.308 2.432 0.002 420 HA ASN 52 HA ASN 52 2.866 4.698 -0.109 421 1HB ASN 52 1HB ASN 52 2.151 3.978 2.603 422 2HB ASN 52 2HB ASN 52 3.892 3.897 2.377 423 1HD2 ASN 52 1HD2 ASN 52 4.169 5.941 0.477 424 2HD2 ASN 52 2HD2 ASN 52 3.812 7.447 1.242 425 H ARG 53 H ARG 53 4.456 3.910 -1.342 426 HA ARG 53 HA ARG 53 5.102 1.246 -1.675 427 1HB ARG 53 1HB ARG 53 6.961 1.946 -2.943 428 2HB ARG 53 2HB ARG 53 5.771 3.226 -3.129 429 1HG ARG 53 1HG ARG 53 6.971 4.711 -1.825 430 2HG ARG 53 2HG ARG 53 7.881 3.433 -1.020 431 1HD ARG 53 1HD ARG 53 8.532 3.127 -3.689 432 2HD ARG 53 2HD ARG 53 8.459 4.873 -3.466 433 HE ARG 53 HE ARG 53 10.545 3.231 -2.650 434 1HH1 ARG 53 1HH1 ARG 53 8.540 5.760 -1.308 435 2HH1 ARG 53 2HH1 ARG 53 9.744 6.284 -0.184 436 1HH2 ARG 53 1HH2 ARG 53 12.133 3.946 -1.186 437 2HH2 ARG 53 2HH2 ARG 53 11.782 5.265 -0.119 438 H ASP 54 H ASP 54 6.199 3.479 0.746 439 HA ASP 54 HA ASP 54 8.353 1.779 1.644 440 1HB ASP 54 1HB ASP 54 7.675 4.503 1.916 441 2HB ASP 54 2HB ASP 54 7.644 3.824 3.537 442 HA PRO 55 HA PRO 55 5.658 -0.572 4.322 443 1HB PRO 55 1HB PRO 55 7.582 -2.047 5.541 444 2HB PRO 55 2HB PRO 55 7.022 -2.369 3.896 445 1HG PRO 55 1HG PRO 55 9.487 -0.959 4.817 446 2HG PRO 55 2HG PRO 55 9.276 -2.083 3.467 447 1HD PRO 55 1HD PRO 55 9.398 0.631 3.173 448 2HD PRO 55 2HD PRO 55 8.537 -0.442 2.055 449 H GLN 56 H GLN 56 8.736 0.488 5.792 450 HA GLN 56 HA GLN 56 7.857 0.595 8.427 451 1HB GLN 56 1HB GLN 56 9.996 2.193 7.020 452 2HB GLN 56 2HB GLN 56 9.764 2.189 8.759 453 1HG GLN 56 1HG GLN 56 10.801 0.236 9.010 454 2HG GLN 56 2HG GLN 56 9.968 -0.483 7.632 455 1HE2 GLN 56 1HE2 GLN 56 11.331 -1.180 6.174 456 2HE2 GLN 56 2HE2 GLN 56 12.810 -0.422 5.704 457 H HIS 57 H HIS 57 7.203 2.710 5.811 458 HA HIS 57 HA HIS 57 6.620 5.048 7.349 459 1HB HIS 57 1HB HIS 57 7.139 4.944 4.847 460 2HB HIS 57 2HB HIS 57 5.472 4.422 4.631 461 HD2 HIS 57 HD2 HIS 57 3.531 6.427 5.144 462 HE1 HIS 57 HE1 HIS 57 6.349 9.596 5.305 463 HE2 HIS 57 HE2 HIS 57 3.923 8.983 5.032 464 H LEU 58 H LEU 58 4.477 2.828 5.572 465 HA LEU 58 HA LEU 58 2.046 3.669 6.447 466 1HB LEU 58 1HB LEU 58 2.863 1.536 5.028 467 2HB LEU 58 2HB LEU 58 2.406 0.735 6.521 468 HG LEU 58 HG LEU 58 0.299 2.483 5.958 469 1HD1 LEU 58 1HD1 LEU 58 1.109 0.981 3.486 470 2HD1 LEU 58 2HD1 LEU 58 1.206 2.718 3.690 471 3HD1 LEU 58 3HD1 LEU 58 -0.358 1.913 3.707 472 1HD2 LEU 58 1HD2 LEU 58 -0.379 0.540 6.905 473 2HD2 LEU 58 2HD2 LEU 58 0.775 -0.437 5.997 474 3HD2 LEU 58 3HD2 LEU 58 -0.707 0.126 5.224 475 H LEU 59 H LEU 59 4.250 1.515 8.176 476 HA LEU 59 HA LEU 59 2.572 0.963 10.344 477 1HB LEU 59 1HB LEU 59 5.380 0.631 9.685 478 2HB LEU 59 2HB LEU 59 5.140 0.974 11.389 479 HG LEU 59 HG LEU 59 3.224 -0.985 10.612 480 1HD1 LEU 59 1HD1 LEU 59 5.300 -2.692 10.224 481 2HD1 LEU 59 2HD1 LEU 59 5.830 -1.280 9.310 482 3HD1 LEU 59 3HD1 LEU 59 4.280 -2.035 8.942 483 1HD2 LEU 59 1HD2 LEU 59 5.089 -0.463 12.685 484 2HD2 LEU 59 2HD2 LEU 59 5.315 -2.127 12.146 485 3HD2 LEU 59 3HD2 LEU 59 3.726 -1.581 12.680 486 H LYS 60 H LYS 60 5.117 3.419 10.003 487 HA LYS 60 HA LYS 60 4.757 4.643 12.482 488 1HB LYS 60 1HB LYS 60 6.415 5.022 10.313 489 2HB LYS 60 2HB LYS 60 5.464 6.501 10.335 490 1HG LYS 60 1HG LYS 60 6.133 6.959 12.598 491 2HG LYS 60 2HG LYS 60 6.966 5.407 12.704 492 1HD LYS 60 1HD LYS 60 7.900 6.887 10.420 493 2HD LYS 60 2HD LYS 60 8.029 7.870 11.880 494 1HE LYS 60 1HE LYS 60 9.491 6.402 12.899 495 2HE LYS 60 2HE LYS 60 8.962 5.034 11.921 496 1HZ LYS 60 1HZ LYS 60 10.695 5.411 10.619 497 2HZ LYS 60 2HZ LYS 60 11.105 6.818 11.463 498 3HZ LYS 60 3HZ LYS 60 10.022 6.896 10.165 499 H PHE 61 H PHE 61 2.992 5.064 9.460 500 HA PHE 61 HA PHE 61 1.653 7.441 10.247 501 1HB PHE 61 1HB PHE 61 1.604 5.642 7.967 502 2HB PHE 61 2HB PHE 61 -0.016 6.165 8.405 503 HD1 PHE 61 HD1 PHE 61 1.343 6.784 5.819 504 HD2 PHE 61 HD2 PHE 61 1.220 8.936 9.493 505 HE1 PHE 61 HE1 PHE 61 1.699 8.889 4.600 506 HE2 PHE 61 HE2 PHE 61 1.582 11.039 8.276 507 HZ PHE 61 HZ PHE 61 1.820 11.020 5.827 508 H LEU 62 H LEU 62 0.737 4.008 10.362 509 HA LEU 62 HA LEU 62 -1.878 4.356 11.264 510 1HB LEU 62 1HB LEU 62 -0.043 2.104 12.079 511 2HB LEU 62 2HB LEU 62 -1.795 2.076 12.033 512 HG LEU 62 HG LEU 62 -0.463 2.663 9.462 513 1HD1 LEU 62 1HD1 LEU 62 -0.007 0.272 9.049 514 2HD1 LEU 62 2HD1 LEU 62 -0.315 -0.054 10.756 515 3HD1 LEU 62 3HD1 LEU 62 1.036 0.969 10.284 516 1HD2 LEU 62 1HD2 LEU 62 -2.224 1.232 8.610 517 2HD2 LEU 62 2HD2 LEU 62 -2.897 2.448 9.696 518 3HD2 LEU 62 3HD2 LEU 62 -2.686 0.788 10.253 519 H LEU 63 H LEU 63 1.148 4.103 13.111 520 HA LEU 63 HA LEU 63 -0.152 4.317 15.651 521 1HB LEU 63 1HB LEU 63 2.742 4.865 15.021 522 2HB LEU 63 2HB LEU 63 2.055 4.475 16.586 523 HG LEU 63 HG LEU 63 1.531 2.413 14.589 524 1HD1 LEU 63 1HD1 LEU 63 3.696 3.164 13.738 525 2HD1 LEU 63 2HD1 LEU 63 3.812 1.567 14.477 526 3HD1 LEU 63 3HD1 LEU 63 4.391 2.987 15.348 527 1HD2 LEU 63 1HD2 LEU 63 3.134 1.781 16.950 528 2HD2 LEU 63 2HD2 LEU 63 1.602 1.102 16.402 529 3HD2 LEU 63 3HD2 LEU 63 1.620 2.610 17.316 530 H ARG 64 H ARG 64 1.283 6.568 13.387 531 HA ARG 64 HA ARG 64 1.458 8.796 15.111 532 1HB ARG 64 1HB ARG 64 1.463 8.407 12.153 533 2HB ARG 64 2HB ARG 64 1.243 10.033 12.780 534 1HG ARG 64 1HG ARG 64 3.596 8.209 13.184 535 2HG ARG 64 2HG ARG 64 3.552 9.745 12.325 536 1HD ARG 64 1HD ARG 64 3.487 9.212 15.269 537 2HD ARG 64 2HD ARG 64 4.547 10.280 14.355 538 HE ARG 64 HE ARG 64 1.778 11.066 14.312 539 1HH1 ARG 64 1HH1 ARG 64 4.809 11.296 16.026 540 2HH1 ARG 64 2HH1 ARG 64 4.394 12.781 16.812 541 1HH2 ARG 64 1HH2 ARG 64 1.228 13.019 15.348 542 2HH2 ARG 64 2HH2 ARG 64 2.362 13.760 16.429 543 H GLU 65 H GLU 65 -1.195 7.393 13.363 544 HA GLU 65 HA GLU 65 -2.895 9.701 14.029 545 1HB GLU 65 1HB GLU 65 -2.756 8.874 11.635 546 2HB GLU 65 2HB GLU 65 -3.571 7.423 12.184 547 1HG GLU 65 1HG GLU 65 -5.490 8.433 11.776 548 2HG GLU 65 2HG GLU 65 -5.143 9.505 13.132 549 H LEU 66 H LEU 66 -2.216 6.455 14.850 550 HA LEU 66 HA LEU 66 -4.769 5.704 15.880 551 1HB LEU 66 1HB LEU 66 -2.055 4.595 15.801 552 2HB LEU 66 2HB LEU 66 -2.929 4.189 17.258 553 HG LEU 66 HG LEU 66 -4.590 3.009 16.069 554 1HD1 LEU 66 1HD1 LEU 66 -3.917 3.072 13.369 555 2HD1 LEU 66 2HD1 LEU 66 -3.884 4.755 13.897 556 3HD1 LEU 66 3HD1 LEU 66 -5.335 3.787 14.136 557 1HD2 LEU 66 1HD2 LEU 66 -2.640 1.691 16.317 558 2HD2 LEU 66 2HD2 LEU 66 -1.857 2.473 14.942 559 3HD2 LEU 66 3HD2 LEU 66 -3.239 1.411 14.682 560 H GLY 67 H GLY 67 -5.676 6.810 17.541 561 1HA GLY 67 1HA GLY 67 -4.042 8.136 19.518 562 2HA GLY 67 2HA GLY 67 -5.799 8.094 19.478 563 H THR 68 H THR 68 -5.723 5.119 19.249 564 HA THR 68 HA THR 68 -5.540 4.585 22.102 565 HB THR 68 HB THR 68 -6.930 2.742 21.740 566 HG1 THR 68 HG1 THR 68 -5.572 1.896 19.980 567 1HG2 THR 68 1HG2 THR 68 -8.764 3.428 20.448 568 2HG2 THR 68 2HG2 THR 68 -7.751 4.417 19.395 569 3HG2 THR 68 3HG2 THR 68 -8.031 4.908 21.066 570 H ALA 69 H ALA 69 -4.700 2.356 22.723 571 HA ALA 69 HA ALA 69 -2.074 2.076 22.676 572 1HB ALA 69 1HB ALA 69 -3.491 0.514 23.859 573 2HB ALA 69 2HB ALA 69 -2.311 -0.366 22.888 574 3HB ALA 69 3HB ALA 69 -3.981 -0.234 22.338 575 H GLY 70 H GLY 70 -3.942 0.225 20.248 576 1HA GLY 70 1HA GLY 70 -3.490 -0.039 17.978 577 2HA GLY 70 2HA GLY 70 -2.059 0.959 18.174 578 H ASN 71 H ASN 71 -3.248 -2.185 17.813 579 HA ASN 71 HA ASN 71 -0.628 -3.264 17.596 580 1HB ASN 71 1HB ASN 71 -1.634 -3.331 20.186 581 2HB ASN 71 2HB ASN 71 -1.953 -4.947 19.561 582 1HD2 ASN 71 1HD2 ASN 71 -0.191 -6.205 18.807 583 2HD2 ASN 71 2HD2 ASN 71 1.418 -5.895 19.351 584 H LEU 72 H LEU 72 -0.710 -5.663 17.191 585 HA LEU 72 HA LEU 72 -2.784 -6.184 15.273 586 1HB LEU 72 1HB LEU 72 -0.577 -8.002 16.248 587 2HB LEU 72 2HB LEU 72 -1.552 -8.237 14.812 588 HG LEU 72 HG LEU 72 0.493 -7.440 14.002 589 1HD1 LEU 72 1HD1 LEU 72 -0.010 -5.394 12.948 590 2HD1 LEU 72 2HD1 LEU 72 -1.066 -4.885 14.267 591 3HD1 LEU 72 3HD1 LEU 72 -1.555 -6.198 13.204 592 1HD2 LEU 72 1HD2 LEU 72 0.929 -6.492 16.501 593 2HD2 LEU 72 2HD2 LEU 72 0.692 -4.991 15.605 594 3HD2 LEU 72 3HD2 LEU 72 1.943 -6.128 15.104 595 H GLU 73 H GLU 73 -4.748 -6.835 15.968 596 HA GLU 73 HA GLU 73 -4.901 -8.638 18.284 597 1HB GLU 73 1HB GLU 73 -6.999 -6.890 16.995 598 2HB GLU 73 2HB GLU 73 -7.362 -8.067 18.236 599 1HG GLU 73 1HG GLU 73 -5.236 -6.339 19.085 600 2HG GLU 73 2HG GLU 73 -6.625 -5.394 18.548 601 H GLY 74 H GLY 74 -6.393 -10.454 18.148 602 1HA GLY 74 1HA GLY 74 -7.153 -12.367 17.136 603 2HA GLY 74 2HA GLY 74 -7.674 -11.318 15.829 604 H GLY 75 H GLY 75 -7.089 -13.568 14.853 605 1HA GLY 75 1HA GLY 75 -4.516 -14.465 14.457 606 2HA GLY 75 2HA GLY 75 -5.802 -14.619 13.272 607 H ARG 76 H ARG 76 -6.183 -11.879 12.695 608 HA ARG 76 HA ARG 76 -3.849 -11.420 11.019 609 1HB ARG 76 1HB ARG 76 -6.425 -11.325 10.411 610 2HB ARG 76 2HB ARG 76 -6.257 -9.670 10.985 611 1HG ARG 76 1HG ARG 76 -6.017 -9.826 8.579 612 2HG ARG 76 2HG ARG 76 -4.549 -9.235 9.339 613 1HD ARG 76 1HD ARG 76 -3.444 -10.788 8.204 614 2HD ARG 76 2HD ARG 76 -4.234 -12.000 9.210 615 HE ARG 76 HE ARG 76 -6.072 -11.827 7.424 616 1HH1 ARG 76 1HH1 ARG 76 -2.647 -11.521 6.753 617 2HH1 ARG 76 2HH1 ARG 76 -2.801 -12.091 5.127 618 1HH2 ARG 76 1HH2 ARG 76 -6.247 -12.588 5.296 619 2HH2 ARG 76 2HH2 ARG 76 -4.832 -12.694 4.302 620 H ALA 77 H ALA 77 -4.354 -8.560 10.715 621 HA ALA 77 HA ALA 77 -3.055 -7.622 13.164 622 1HB ALA 77 1HB ALA 77 -1.605 -7.137 11.441 623 2HB ALA 77 2HB ALA 77 -2.529 -5.639 11.534 624 3HB ALA 77 3HB ALA 77 -2.906 -6.833 10.290 625 H ILE 78 H ILE 78 -5.086 -7.365 14.300 626 HA ILE 78 HA ILE 78 -6.877 -5.300 13.243 627 HB ILE 78 HB ILE 78 -7.261 -6.884 15.763 628 1HG1 ILE 78 1HG1 ILE 78 -8.553 -7.581 13.158 629 2HG1 ILE 78 2HG1 ILE 78 -7.004 -8.273 13.611 630 1HG2 ILE 78 1HG2 ILE 78 -8.610 -4.700 14.794 631 2HG2 ILE 78 2HG2 ILE 78 -9.204 -5.842 15.999 632 3HG2 ILE 78 3HG2 ILE 78 -9.617 -6.060 14.298 633 1HD1 ILE 78 1HD1 ILE 78 -9.680 -8.648 14.893 634 2HD1 ILE 78 2HD1 ILE 78 -8.189 -8.981 15.774 635 3HD1 ILE 78 3HD1 ILE 78 -8.553 -9.863 14.290 636 H LEU 79 H LEU 79 -5.787 -3.394 13.590 637 HA LEU 79 HA LEU 79 -4.746 -2.797 16.252 638 1HB LEU 79 1HB LEU 79 -3.800 -0.809 15.226 639 2HB LEU 79 2HB LEU 79 -3.386 -2.238 14.294 640 HG LEU 79 HG LEU 79 -5.567 -1.534 12.956 641 1HD1 LEU 79 1HD1 LEU 79 -4.766 1.195 13.071 642 2HD1 LEU 79 2HD1 LEU 79 -5.191 0.654 14.699 643 3HD1 LEU 79 3HD1 LEU 79 -6.352 0.489 13.380 644 1HD2 LEU 79 1HD2 LEU 79 -2.968 -0.096 12.486 645 2HD2 LEU 79 2HD2 LEU 79 -4.158 -0.615 11.292 646 3HD2 LEU 79 3HD2 LEU 79 -3.192 -1.813 12.154 647 H GLN 80 H GLN 80 -5.144 -0.327 16.865 648 HA GLN 80 HA GLN 80 -7.961 0.354 16.418 649 1HB GLN 80 1HB GLN 80 -6.968 -0.832 18.782 650 2HB GLN 80 2HB GLN 80 -7.296 0.848 19.168 651 1HG GLN 80 1HG GLN 80 -9.531 0.251 17.833 652 2HG GLN 80 2HG GLN 80 -9.139 -1.335 18.496 653 1HE2 GLN 80 1HE2 GLN 80 -8.043 -0.660 20.906 654 2HE2 GLN 80 2HE2 GLN 80 -9.240 0.084 21.905 655 H GLY 81 H GLY 81 -8.209 2.450 15.933 656 1HA GLY 81 1HA GLY 81 -7.087 4.602 17.296 657 2HA GLY 81 2HA GLY 81 -6.023 4.260 15.946 658 H LYS 82 H LYS 82 -6.350 5.819 14.498 659 HA LYS 82 HA LYS 82 -9.127 6.453 13.750 660 1HB LYS 82 1HB LYS 82 -7.934 8.307 14.906 661 2HB LYS 82 2HB LYS 82 -6.738 8.301 13.619 662 1HG LYS 82 1HG LYS 82 -8.440 10.089 13.417 663 2HG LYS 82 2HG LYS 82 -8.358 9.024 12.016 664 1HD LYS 82 1HD LYS 82 -10.593 8.930 12.239 665 2HD LYS 82 2HD LYS 82 -10.250 7.778 13.526 666 1HE LYS 82 1HE LYS 82 -10.293 10.692 14.154 667 2HE LYS 82 2HE LYS 82 -11.821 9.835 13.947 668 1HZ LYS 82 1HZ LYS 82 -9.674 9.075 15.854 669 2HZ LYS 82 2HZ LYS 82 -11.162 8.291 15.673 670 3HZ LYS 82 3HZ LYS 82 -11.107 9.876 16.262 671 H PHE 83 H PHE 83 -6.951 4.537 12.652 672 HA PHE 83 HA PHE 83 -6.779 5.569 9.911 673 1HB PHE 83 1HB PHE 83 -5.095 3.896 11.542 674 2HB PHE 83 2HB PHE 83 -5.529 3.042 10.064 675 HD1 PHE 83 HD1 PHE 83 -3.893 6.027 11.423 676 HD2 PHE 83 HD2 PHE 83 -4.704 3.736 7.972 677 HE1 PHE 83 HE1 PHE 83 -2.214 7.330 10.179 678 HE2 PHE 83 HE2 PHE 83 -3.033 5.014 6.695 679 HZ PHE 83 HZ PHE 83 -1.782 6.823 7.807 680 H THR 84 H THR 84 -9.295 5.012 10.653 681 HA THR 84 HA THR 84 -10.060 2.331 9.955 682 HB THR 84 HB THR 84 -12.397 3.506 10.087 683 HG1 THR 84 HG1 THR 84 -12.393 5.448 11.069 684 1HG2 THR 84 1HG2 THR 84 -10.811 2.270 11.970 685 2HG2 THR 84 2HG2 THR 84 -12.512 2.695 12.156 686 3HG2 THR 84 3HG2 THR 84 -11.262 3.793 12.734 687 H HIS 85 H HIS 85 -8.860 2.655 7.833 688 HA HIS 85 HA HIS 85 -8.883 2.782 5.564 689 1HB HIS 85 1HB HIS 85 -11.075 1.495 6.097 690 2HB HIS 85 2HB HIS 85 -11.884 3.002 5.686 691 HD2 HIS 85 HD2 HIS 85 -8.876 1.561 3.603 692 HE1 HIS 85 HE1 HIS 85 -12.363 1.616 1.189 693 HE2 HIS 85 HE2 HIS 85 -9.851 1.475 1.211 694 H PHE 86 H PHE 86 -8.630 5.184 7.044 695 HA PHE 86 HA PHE 86 -10.093 7.182 5.502 696 1HB PHE 86 1HB PHE 86 -8.631 7.181 8.076 697 2HB PHE 86 2HB PHE 86 -8.547 8.668 7.134 698 HD1 PHE 86 HD1 PHE 86 -11.184 6.156 7.912 699 HD2 PHE 86 HD2 PHE 86 -10.053 10.251 7.817 700 HE1 PHE 86 HE1 PHE 86 -13.420 6.781 8.722 701 HE2 PHE 86 HE2 PHE 86 -12.287 10.890 8.631 702 HZ PHE 86 HZ PHE 86 -13.974 9.153 9.083 703 H LEU 87 H LEU 87 -6.811 7.551 6.683 704 HA LEU 87 HA LEU 87 -5.875 8.811 4.361 705 1HB LEU 87 1HB LEU 87 -4.666 7.721 6.843 706 2HB LEU 87 2HB LEU 87 -3.583 7.989 5.493 707 HG LEU 87 HG LEU 87 -3.551 9.905 6.966 708 1HD1 LEU 87 1HD1 LEU 87 -3.795 11.591 5.377 709 2HD1 LEU 87 2HD1 LEU 87 -5.139 10.774 4.577 710 3HD1 LEU 87 3HD1 LEU 87 -3.500 10.140 4.419 711 1HD2 LEU 87 1HD2 LEU 87 -6.374 10.613 6.385 712 2HD2 LEU 87 2HD2 LEU 87 -5.372 10.998 7.784 713 3HD2 LEU 87 3HD2 LEU 87 -6.067 9.387 7.614 714 H ILE 88 H ILE 88 -5.877 5.440 5.368 715 HA ILE 88 HA ILE 88 -4.008 4.414 3.577 716 HB ILE 88 HB ILE 88 -6.542 3.002 4.401 717 1HG1 ILE 88 1HG1 ILE 88 -3.916 3.073 5.904 718 2HG1 ILE 88 2HG1 ILE 88 -5.339 4.006 6.348 719 1HG2 ILE 88 1HG2 ILE 88 -4.161 2.220 2.969 720 2HG2 ILE 88 2HG2 ILE 88 -5.678 1.347 3.197 721 3HG2 ILE 88 3HG2 ILE 88 -4.403 1.230 4.408 722 1HD1 ILE 88 1HD1 ILE 88 -6.577 2.021 6.822 723 2HD1 ILE 88 2HD1 ILE 88 -5.031 1.924 7.661 724 3HD1 ILE 88 3HD1 ILE 88 -5.287 1.004 6.180 725 H ASN 89 H ASN 89 -7.538 4.320 3.174 726 HA ASN 89 HA ASN 89 -7.547 3.535 0.512 727 1HB ASN 89 1HB ASN 89 -9.521 3.579 2.041 728 2HB ASN 89 2HB ASN 89 -9.602 5.318 1.820 729 1HD2 ASN 89 1HD2 ASN 89 -9.817 6.073 -0.430 730 2HD2 ASN 89 2HD2 ASN 89 -10.789 5.139 -1.508 731 H GLU 90 H GLU 90 -7.751 6.834 1.823 732 HA GLU 90 HA GLU 90 -8.046 8.222 -0.542 733 1HB GLU 90 1HB GLU 90 -7.415 8.838 2.168 734 2HB GLU 90 2HB GLU 90 -6.321 9.744 1.134 735 1HG GLU 90 1HG GLU 90 -8.867 9.989 -0.019 736 2HG GLU 90 2HG GLU 90 -9.082 10.215 1.717 737 H ARG 91 H ARG 91 -4.966 7.473 1.095 738 HA ARG 91 HA ARG 91 -3.314 8.587 -0.893 739 1HB ARG 91 1HB ARG 91 -3.005 7.007 1.516 740 2HB ARG 91 2HB ARG 91 -1.852 6.526 0.280 741 1HG ARG 91 1HG ARG 91 -0.874 8.179 1.707 742 2HG ARG 91 2HG ARG 91 -1.115 8.866 0.100 743 1HD ARG 91 1HD ARG 91 -3.425 9.600 1.216 744 2HD ARG 91 2HD ARG 91 -2.436 9.520 2.674 745 HE ARG 91 HE ARG 91 -2.419 11.593 0.818 746 1HH1 ARG 91 1HH1 ARG 91 -0.122 9.589 2.534 747 2HH1 ARG 91 2HH1 ARG 91 1.150 10.752 2.433 748 1HH2 ARG 91 1HH2 ARG 91 -0.742 13.130 0.718 749 2HH2 ARG 91 2HH2 ARG 91 0.800 12.760 1.417 750 H ILE 92 H ILE 92 -4.348 5.222 -0.331 751 HA ILE 92 HA ILE 92 -2.955 3.954 -2.358 752 HB ILE 92 HB ILE 92 -5.759 3.370 -1.397 753 1HG1 ILE 92 1HG1 ILE 92 -3.328 1.813 -0.616 754 2HG1 ILE 92 2HG1 ILE 92 -3.684 3.332 0.197 755 1HG2 ILE 92 1HG2 ILE 92 -5.401 1.098 -2.253 756 2HG2 ILE 92 2HG2 ILE 92 -3.870 1.619 -2.958 757 3HG2 ILE 92 3HG2 ILE 92 -5.384 2.307 -3.530 758 1HD1 ILE 92 1HD1 ILE 92 -6.072 1.814 0.094 759 2HD1 ILE 92 2HD1 ILE 92 -5.128 2.290 1.494 760 3HD1 ILE 92 3HD1 ILE 92 -4.778 0.773 0.678 761 H GLU 93 H GLU 93 -6.304 5.167 -2.524 762 HA GLU 93 HA GLU 93 -6.688 4.718 -5.255 763 1HB GLU 93 1HB GLU 93 -7.986 6.480 -3.217 764 2HB GLU 93 2HB GLU 93 -8.406 6.685 -4.912 765 1HG GLU 93 1HG GLU 93 -8.930 4.225 -4.963 766 2HG GLU 93 2HG GLU 93 -8.757 4.236 -3.208 767 H ASP 94 H ASP 94 -5.042 7.264 -3.572 768 HA ASP 94 HA ASP 94 -5.085 9.222 -5.601 769 1HB ASP 94 1HB ASP 94 -4.412 9.552 -3.176 770 2HB ASP 94 2HB ASP 94 -2.867 8.817 -3.591 771 H TYR 95 H TYR 95 -2.660 6.749 -4.777 772 HA TYR 95 HA TYR 95 -1.133 7.349 -7.165 773 1HB TYR 95 1HB TYR 95 -0.182 6.665 -4.853 774 2HB TYR 95 2HB TYR 95 -0.610 5.025 -5.330 775 HD1 TYR 95 HD1 TYR 95 0.929 7.907 -7.157 776 HD2 TYR 95 HD2 TYR 95 1.277 3.849 -5.929 777 HE1 TYR 95 HE1 TYR 95 3.048 7.720 -8.393 778 HE2 TYR 95 HE2 TYR 95 3.396 3.651 -7.161 779 HH TYR 95 HH TYR 95 5.230 5.280 -7.939 780 H VAL 96 H VAL 96 -2.614 4.389 -5.820 781 HA VAL 96 HA VAL 96 -2.352 2.847 -8.116 782 HB VAL 96 HB VAL 96 -3.043 2.062 -5.792 783 1HG1 VAL 96 1HG1 VAL 96 -5.863 2.025 -6.480 784 2HG1 VAL 96 2HG1 VAL 96 -5.255 3.658 -6.225 785 3HG1 VAL 96 3HG1 VAL 96 -5.072 2.451 -4.972 786 1HG2 VAL 96 1HG2 VAL 96 -4.317 0.161 -6.712 787 2HG2 VAL 96 2HG2 VAL 96 -2.876 0.551 -7.647 788 3HG2 VAL 96 3HG2 VAL 96 -4.466 1.032 -8.236 789 H ASN 97 H ASN 97 -4.986 5.029 -7.154 790 HA ASN 97 HA ASN 97 -6.173 4.619 -9.807 791 1HB ASN 97 1HB ASN 97 -7.388 5.243 -7.135 792 2HB ASN 97 2HB ASN 97 -8.211 5.739 -8.611 793 1HD2 ASN 97 1HD2 ASN 97 -9.929 4.348 -8.157 794 2HD2 ASN 97 2HD2 ASN 97 -9.799 2.640 -8.383 795 H LYS 98 H LYS 98 -4.051 6.236 -9.852 796 HA LYS 98 HA LYS 98 -4.828 8.979 -9.375 797 1HB LYS 98 1HB LYS 98 -2.641 9.588 -10.032 798 2HB LYS 98 2HB LYS 98 -2.465 8.087 -9.139 799 1HG LYS 98 1HG LYS 98 -2.739 7.245 -11.754 800 2HG LYS 98 2HG LYS 98 -1.769 8.715 -11.883 801 1HD LYS 98 1HD LYS 98 -0.130 7.849 -10.366 802 2HD LYS 98 2HD LYS 98 -1.146 6.468 -9.978 803 1HE LYS 98 1HE LYS 98 -0.465 6.834 -12.826 804 2HE LYS 98 2HE LYS 98 0.856 6.370 -11.754 805 1HZ LYS 98 1HZ LYS 98 0.020 4.344 -12.385 806 2HZ LYS 98 2HZ LYS 98 -1.582 4.880 -12.442 807 3HZ LYS 98 3HZ LYS 98 -0.838 4.599 -10.950 808 H PHE 99 H PHE 99 -5.590 6.795 -11.702 809 HA PHE 99 HA PHE 99 -5.312 8.255 -14.089 810 1HB PHE 99 1HB PHE 99 -6.733 6.598 -15.090 811 2HB PHE 99 2HB PHE 99 -5.652 5.801 -13.956 812 HD1 PHE 99 HD1 PHE 99 -6.827 5.827 -11.419 813 HD2 PHE 99 HD2 PHE 99 -8.798 5.662 -15.187 814 HE1 PHE 99 HE1 PHE 99 -8.752 4.735 -10.360 815 HE2 PHE 99 HE2 PHE 99 -10.729 4.569 -14.128 816 HZ PHE 99 HZ PHE 99 -10.707 4.102 -11.711 817 H VAL 100 H VAL 100 -8.202 7.809 -12.017 818 HA VAL 100 HA VAL 100 -9.576 9.891 -13.526 819 HB VAL 100 HB VAL 100 -10.854 7.889 -13.014 820 1HG1 VAL 100 1HG1 VAL 100 -11.471 7.407 -10.636 821 2HG1 VAL 100 2HG1 VAL 100 -10.227 8.559 -10.146 822 3HG1 VAL 100 3HG1 VAL 100 -9.781 7.106 -11.036 823 1HG2 VAL 100 1HG2 VAL 100 -12.817 8.909 -11.990 824 2HG2 VAL 100 2HG2 VAL 100 -12.052 10.025 -13.123 825 3HG2 VAL 100 3HG2 VAL 100 -11.826 10.238 -11.387 826 H ILE 101 H ILE 101 -7.735 9.565 -10.690 827 HA ILE 101 HA ILE 101 -8.969 11.783 -9.290 828 HB ILE 101 HB ILE 101 -6.434 10.300 -8.599 829 1HG1 ILE 101 1HG1 ILE 101 -8.377 8.782 -8.782 830 2HG1 ILE 101 2HG1 ILE 101 -7.802 8.924 -7.123 831 1HG2 ILE 101 1HG2 ILE 101 -7.856 11.265 -6.337 832 2HG2 ILE 101 2HG2 ILE 101 -7.674 12.593 -7.483 833 3HG2 ILE 101 3HG2 ILE 101 -6.252 11.722 -6.909 834 1HD1 ILE 101 1HD1 ILE 101 -10.339 9.827 -8.349 835 2HD1 ILE 101 2HD1 ILE 101 -9.664 10.803 -7.045 836 3HD1 ILE 101 3HD1 ILE 101 -10.032 9.100 -6.772 837 H CYS 102 H CYS 102 -5.682 11.081 -10.514 838 HA CYS 102 HA CYS 102 -4.980 13.879 -10.383 839 1HB CYS 102 1HB CYS 102 -3.378 12.000 -9.881 840 2HB CYS 102 2HB CYS 102 -3.372 11.634 -11.603 841 H HIS 103 H HIS 103 -7.144 13.191 -12.200 842 HA HIS 103 HA HIS 103 -7.850 13.478 -14.342 843 1HB HIS 103 1HB HIS 103 -6.389 15.740 -13.475 844 2HB HIS 103 2HB HIS 103 -5.988 15.497 -15.171 845 HD2 HIS 103 HD2 HIS 103 -9.583 14.939 -13.657 846 HE1 HIS 103 HE1 HIS 103 -9.745 18.026 -16.562 847 HE2 HIS 103 HE2 HIS 103 -11.082 16.526 -15.042 848 H GLU 104 H GLU 104 -6.294 11.307 -14.287 849 HA GLU 104 HA GLU 104 -4.822 9.975 -15.404 850 1HB GLU 104 1HB GLU 104 -5.317 9.761 -17.752 851 2HB GLU 104 2HB GLU 104 -6.804 10.069 -16.876 852 1HG GLU 104 1HG GLU 104 -6.381 12.540 -17.546 853 2HG GLU 104 2HG GLU 104 -5.316 11.840 -18.759 854 H CYS 105 H CYS 105 -3.036 11.312 -14.481 855 HA CYS 105 HA CYS 105 -1.667 13.168 -16.177 856 1HB CYS 105 1HB CYS 105 -1.581 12.546 -13.494 857 2HB CYS 105 2HB CYS 105 -0.067 11.874 -14.084 858 H ASN 106 H ASN 106 -2.090 10.929 -17.728 859 HA ASN 106 HA ASN 106 0.146 9.156 -17.711 860 1HB ASN 106 1HB ASN 106 -2.146 9.670 -19.587 861 2HB ASN 106 2HB ASN 106 -0.815 8.620 -20.066 862 1HD2 ASN 106 1HD2 ASN 106 -3.648 8.945 -18.186 863 2HD2 ASN 106 2HD2 ASN 106 -3.670 7.349 -17.525 864 H ARG 107 H ARG 107 -0.919 11.187 -20.403 865 HA ARG 107 HA ARG 107 1.734 11.442 -21.433 866 1HB ARG 107 1HB ARG 107 -0.749 11.572 -22.527 867 2HB ARG 107 2HB ARG 107 -0.364 13.283 -22.410 868 1HG ARG 107 1HG ARG 107 0.387 12.758 -24.516 869 2HG ARG 107 2HG ARG 107 1.856 12.603 -23.559 870 1HD ARG 107 1HD ARG 107 1.546 10.193 -23.439 871 2HD ARG 107 2HD ARG 107 0.041 10.329 -24.348 872 HE ARG 107 HE ARG 107 2.660 10.240 -25.419 873 1HH1 ARG 107 1HH1 ARG 107 -0.456 11.743 -25.906 874 2HH1 ARG 107 2HH1 ARG 107 -0.209 11.986 -27.603 875 1HH2 ARG 107 1HH2 ARG 107 2.978 10.554 -27.650 876 2HH2 ARG 107 2HH2 ARG 107 1.736 11.308 -28.593 877 HA PRO 108 HA PRO 108 3.182 14.998 -19.222 878 1HB PRO 108 1HB PRO 108 4.325 15.856 -21.832 879 2HB PRO 108 2HB PRO 108 5.123 15.632 -20.271 880 1HG PRO 108 1HG PRO 108 5.454 13.856 -22.219 881 2HG PRO 108 2HG PRO 108 5.282 13.330 -20.534 882 1HD PRO 108 1HD PRO 108 3.278 13.281 -22.751 883 2HD PRO 108 2HD PRO 108 3.578 12.080 -21.478 884 H ASP 109 H ASP 109 0.763 15.588 -19.362 885 HA ASP 109 HA ASP 109 0.207 17.802 -21.182 886 1HB ASP 109 1HB ASP 109 -1.375 15.782 -20.166 887 2HB ASP 109 2HB ASP 109 -1.821 17.155 -19.159 888 H THR 110 H THR 110 1.384 17.269 -18.061 889 HA THR 110 HA THR 110 1.094 20.105 -17.401 890 HB THR 110 HB THR 110 0.485 19.511 -15.086 891 HG1 THR 110 HG1 THR 110 1.422 17.354 -15.235 892 1HG2 THR 110 1HG2 THR 110 -1.680 19.551 -15.563 893 2HG2 THR 110 2HG2 THR 110 -1.605 17.965 -16.331 894 3HG2 THR 110 3HG2 THR 110 -1.221 19.413 -17.260 895 H ARG 111 H ARG 111 2.481 20.522 -15.277 896 HA ARG 111 HA ARG 111 5.108 19.412 -15.841 897 1HB ARG 111 1HB ARG 111 4.159 21.670 -14.072 898 2HB ARG 111 2HB ARG 111 5.833 21.136 -14.130 899 1HG ARG 111 1HG ARG 111 6.211 22.376 -15.921 900 2HG ARG 111 2HG ARG 111 4.893 21.591 -16.791 901 1HD ARG 111 1HD ARG 111 3.298 23.146 -15.853 902 2HD ARG 111 2HD ARG 111 4.554 23.882 -14.859 903 HE ARG 111 HE ARG 111 4.007 24.416 -17.611 904 1HH1 ARG 111 1HH1 ARG 111 6.541 24.334 -15.212 905 2HH1 ARG 111 2HH1 ARG 111 7.535 25.483 -16.042 906 1HH2 ARG 111 1HH2 ARG 111 5.315 25.927 -18.704 907 2HH2 ARG 111 2HH2 ARG 111 6.840 26.388 -18.024 908 H ILE 112 H ILE 112 5.274 17.409 -14.958 909 HA ILE 112 HA ILE 112 4.499 17.054 -12.144 910 HB ILE 112 HB ILE 112 5.226 14.859 -14.075 911 1HG1 ILE 112 1HG1 ILE 112 2.493 14.747 -13.807 912 2HG1 ILE 112 2HG1 ILE 112 2.781 16.482 -13.900 913 1HG2 ILE 112 1HG2 ILE 112 3.852 14.985 -11.415 914 2HG2 ILE 112 2HG2 ILE 112 5.309 14.093 -11.854 915 3HG2 ILE 112 3HG2 ILE 112 3.737 13.575 -12.466 916 1HD1 ILE 112 1HD1 ILE 112 2.310 15.437 -16.081 917 2HD1 ILE 112 2HD1 ILE 112 3.780 14.476 -15.906 918 3HD1 ILE 112 3HD1 ILE 112 3.882 16.232 -16.015 919 H ILE 113 H ILE 113 5.941 16.220 -10.637 920 HA ILE 113 HA ILE 113 8.687 15.659 -11.435 921 HB ILE 113 HB ILE 113 8.125 17.768 -9.351 922 1HG1 ILE 113 1HG1 ILE 113 9.326 18.263 -12.072 923 2HG1 ILE 113 2HG1 ILE 113 7.598 18.416 -11.776 924 1HG2 ILE 113 1HG2 ILE 113 10.173 17.059 -8.728 925 2HG2 ILE 113 2HG2 ILE 113 10.697 18.097 -10.056 926 3HG2 ILE 113 3HG2 ILE 113 10.529 16.360 -10.307 927 1HD1 ILE 113 1HD1 ILE 113 9.820 20.160 -10.954 928 2HD1 ILE 113 2HD1 ILE 113 8.509 19.951 -9.796 929 3HD1 ILE 113 3HD1 ILE 113 8.166 20.558 -11.416 930 H ARG 114 H ARG 114 9.591 14.121 -10.183 931 HA ARG 114 HA ARG 114 8.337 13.516 -7.594 932 1HB ARG 114 1HB ARG 114 7.769 11.923 -9.547 933 2HB ARG 114 2HB ARG 114 9.431 11.371 -9.398 934 1HG ARG 114 1HG ARG 114 8.822 9.983 -7.789 935 2HG ARG 114 2HG ARG 114 8.300 11.348 -6.807 936 1HD ARG 114 1HD ARG 114 6.517 9.672 -7.157 937 2HD ARG 114 2HD ARG 114 6.096 11.266 -7.776 938 HE ARG 114 HE ARG 114 6.063 10.408 -9.904 939 1HH1 ARG 114 1HH1 ARG 114 7.554 8.089 -7.774 940 2HH1 ARG 114 2HH1 ARG 114 7.540 6.820 -8.944 941 1HH2 ARG 114 1HH2 ARG 114 6.064 8.729 -11.447 942 2HH2 ARG 114 2HH2 ARG 114 6.708 7.179 -11.020 943 H GLU 115 H GLU 115 9.728 13.266 -5.914 944 HA GLU 115 HA GLU 115 12.591 12.954 -6.549 945 1HB GLU 115 1HB GLU 115 12.137 15.272 -5.923 946 2HB GLU 115 2HB GLU 115 11.371 14.737 -4.436 947 1HG GLU 115 1HG GLU 115 13.914 13.582 -4.417 948 2HG GLU 115 2HG GLU 115 14.146 15.228 -5.000 949 H GLY 116 H GLY 116 13.834 11.717 -5.143 950 1HA GLY 116 1HA GLY 116 14.265 10.358 -3.286 951 2HA GLY 116 2HA GLY 116 12.603 10.584 -2.763 952 H ARG 117 H ARG 117 12.582 9.794 -5.994 953 HA ARG 117 HA ARG 117 12.097 7.922 -7.172 954 1HB ARG 117 1HB ARG 117 14.245 7.132 -5.953 955 2HB ARG 117 2HB ARG 117 13.145 6.204 -4.944 956 1HG ARG 117 1HG ARG 117 14.095 4.899 -6.805 957 2HG ARG 117 2HG ARG 117 12.333 4.988 -6.852 958 1HD ARG 117 1HD ARG 117 12.474 5.739 -8.936 959 2HD ARG 117 2HD ARG 117 13.267 7.188 -8.327 960 HE ARG 117 HE ARG 117 15.396 6.036 -8.667 961 1HH1 ARG 117 1HH1 ARG 117 12.593 4.750 -10.325 962 2HH1 ARG 117 2HH1 ARG 117 13.529 4.007 -11.575 963 1HH2 ARG 117 1HH2 ARG 117 16.611 5.056 -10.311 964 2HH2 ARG 117 2HH2 ARG 117 15.805 4.180 -11.569 965 H ILE 118 H ILE 118 9.894 8.646 -6.614 966 HA ILE 118 HA ILE 118 7.733 8.020 -6.233 967 HB ILE 118 HB ILE 118 8.586 5.500 -4.870 968 1HG1 ILE 118 1HG1 ILE 118 8.527 5.939 -7.860 969 2HG1 ILE 118 2HG1 ILE 118 9.947 5.570 -6.897 970 1HG2 ILE 118 1HG2 ILE 118 6.167 6.575 -6.144 971 2HG2 ILE 118 2HG2 ILE 118 6.339 5.444 -4.802 972 3HG2 ILE 118 3HG2 ILE 118 6.502 4.873 -6.461 973 1HD1 ILE 118 1HD1 ILE 118 7.605 3.774 -7.441 974 2HD1 ILE 118 2HD1 ILE 118 8.891 3.404 -6.294 975 3HD1 ILE 118 3HD1 ILE 118 9.264 3.587 -8.008 976 H SER 119 H SER 119 8.972 9.714 -4.527 977 HA SER 119 HA SER 119 7.867 8.943 -1.907 978 1HB SER 119 1HB SER 119 10.486 9.451 -2.350 979 2HB SER 119 2HB SER 119 9.914 11.082 -1.997 980 HG SER 119 HG SER 119 10.026 8.832 -0.350 981 H LEU 120 H LEU 120 8.600 11.702 -4.026 982 HA LEU 120 HA LEU 120 6.175 13.020 -3.008 983 1HB LEU 120 1HB LEU 120 8.831 14.340 -3.560 984 2HB LEU 120 2HB LEU 120 7.356 15.176 -3.105 985 HG LEU 120 HG LEU 120 8.422 13.043 -1.310 986 1HD1 LEU 120 1HD1 LEU 120 9.432 15.875 -1.376 987 2HD1 LEU 120 2HD1 LEU 120 10.357 14.444 -1.812 988 3HD1 LEU 120 3HD1 LEU 120 9.808 14.669 -0.150 989 1HD2 LEU 120 1HD2 LEU 120 7.103 15.663 -0.661 990 2HD2 LEU 120 2HD2 LEU 120 7.273 14.240 0.368 991 3HD2 LEU 120 3HD2 LEU 120 6.194 14.197 -1.027 992 H LEU 121 H LEU 121 5.112 14.417 -4.467 993 HA LEU 121 HA LEU 121 6.065 14.590 -7.194 994 1HB LEU 121 1HB LEU 121 4.809 12.370 -6.837 995 2HB LEU 121 2HB LEU 121 3.367 13.359 -6.726 996 HG LEU 121 HG LEU 121 3.658 12.416 -8.967 997 1HD1 LEU 121 1HD1 LEU 121 2.892 14.920 -8.330 998 2HD1 LEU 121 2HD1 LEU 121 2.823 14.252 -9.959 999 3HD1 LEU 121 3HD1 LEU 121 4.186 15.263 -9.477 1000 1HD2 LEU 121 1HD2 LEU 121 5.762 14.069 -9.942 1001 2HD2 LEU 121 2HD2 LEU 121 5.653 12.310 -9.935 1002 3HD2 LEU 121 3HD2 LEU 121 6.362 13.153 -8.560 1003 H LYS 122 H LYS 122 5.364 16.450 -8.177 1004 HA LYS 122 HA LYS 122 3.259 17.967 -6.790 1005 1HB LYS 122 1HB LYS 122 4.334 20.004 -7.495 1006 2HB LYS 122 2HB LYS 122 5.492 18.984 -6.662 1007 1HG LYS 122 1HG LYS 122 6.838 18.886 -8.425 1008 2HG LYS 122 2HG LYS 122 5.508 18.547 -9.533 1009 1HD LYS 122 1HD LYS 122 5.442 21.284 -8.569 1010 2HD LYS 122 2HD LYS 122 6.974 20.908 -9.352 1011 1HE LYS 122 1HE LYS 122 5.437 21.778 -10.987 1012 2HE LYS 122 2HE LYS 122 5.720 20.069 -11.315 1013 1HZ LYS 122 1HZ LYS 122 3.405 20.495 -11.523 1014 2HZ LYS 122 2HZ LYS 122 3.345 21.278 -10.026 1015 3HZ LYS 122 3HZ LYS 122 3.625 19.619 -10.097 1016 H CYS 123 H CYS 123 1.586 18.897 -7.983 1017 HA CYS 123 HA CYS 123 1.652 18.630 -10.894 1018 1HB CYS 123 1HB CYS 123 -0.187 17.148 -9.084 1019 2HB CYS 123 2HB CYS 123 -0.842 17.762 -10.592 1020 H GLU 124 H GLU 124 1.849 20.949 -9.421 1021 HA GLU 124 HA GLU 124 -0.314 22.423 -8.730 1022 1HB GLU 124 1HB GLU 124 2.161 23.204 -10.248 1023 2HB GLU 124 2HB GLU 124 0.960 24.397 -9.772 1024 1HG GLU 124 1HG GLU 124 1.588 22.798 -7.508 1025 2HG GLU 124 2HG GLU 124 3.092 23.332 -8.255 1026 H ALA 125 H ALA 125 0.591 21.500 -11.993 1027 HA ALA 125 HA ALA 125 -1.123 23.327 -13.330 1028 1HB ALA 125 1HB ALA 125 -0.817 21.663 -15.256 1029 2HB ALA 125 2HB ALA 125 0.285 20.827 -14.162 1030 3HB ALA 125 3HB ALA 125 0.610 22.492 -14.635 1031 H CYS 126 H CYS 126 -1.489 19.773 -13.423 1032 HA CYS 126 HA CYS 126 -4.326 20.038 -13.803 1033 1HB CYS 126 1HB CYS 126 -4.373 17.638 -13.972 1034 2HB CYS 126 2HB CYS 126 -2.958 18.213 -14.843 1035 H GLY 127 H GLY 127 -3.643 21.266 -11.416 1036 1HA GLY 127 1HA GLY 127 -5.242 21.091 -9.525 1037 2HA GLY 127 2HA GLY 127 -4.747 19.408 -9.410 1038 H ALA 128 H ALA 128 -3.515 19.091 -7.694 1039 HA ALA 128 HA ALA 128 -1.181 20.751 -7.274 1040 1HB ALA 128 1HB ALA 128 -1.653 21.391 -5.039 1041 2HB ALA 128 2HB ALA 128 -3.124 20.420 -5.001 1042 3HB ALA 128 3HB ALA 128 -3.045 21.862 -6.013 1043 H LYS 129 H LYS 129 0.405 19.771 -6.016 1044 HA LYS 129 HA LYS 129 -0.090 17.191 -4.819 1045 1HB LYS 129 1HB LYS 129 0.661 17.270 -7.486 1046 2HB LYS 129 2HB LYS 129 2.152 16.945 -6.637 1047 1HG LYS 129 1HG LYS 129 1.421 14.827 -6.976 1048 2HG LYS 129 2HG LYS 129 0.689 15.158 -5.403 1049 1HD LYS 129 1HD LYS 129 -1.421 15.317 -6.267 1050 2HD LYS 129 2HD LYS 129 -0.851 15.879 -7.838 1051 1HE LYS 129 1HE LYS 129 -1.374 13.792 -8.494 1052 2HE LYS 129 2HE LYS 129 0.199 13.397 -7.804 1053 1HZ LYS 129 1HZ LYS 129 -1.433 11.874 -6.981 1054 2HZ LYS 129 2HZ LYS 129 -2.436 13.133 -6.465 1055 3HZ LYS 129 3HZ LYS 129 -0.949 12.873 -5.704 1056 H ALA 130 H ALA 130 1.709 16.442 -3.534 1057 HA ALA 130 HA ALA 130 3.165 18.638 -2.379 1058 1HB ALA 130 1HB ALA 130 3.737 17.162 -0.641 1059 2HB ALA 130 2HB ALA 130 3.478 15.742 -1.653 1060 3HB ALA 130 3HB ALA 130 2.101 16.708 -1.119 1061 HA PRO 131 HA PRO 131 6.660 17.752 -5.154 1062 1HB PRO 131 1HB PRO 131 7.981 20.064 -4.655 1063 2HB PRO 131 2HB PRO 131 6.628 19.968 -5.783 1064 1HG PRO 131 1HG PRO 131 6.665 20.913 -2.946 1065 2HG PRO 131 2HG PRO 131 5.833 21.609 -4.348 1066 1HD PRO 131 1HD PRO 131 4.565 20.075 -2.504 1067 2HD PRO 131 2HD PRO 131 4.090 20.123 -4.211 1068 H LEU 132 H LEU 132 7.096 19.299 -1.960 1069 HA LEU 132 HA LEU 132 9.209 17.343 -1.402 1070 1HB LEU 132 1HB LEU 132 9.406 20.231 -0.594 1071 2HB LEU 132 2HB LEU 132 10.647 18.997 -0.482 1072 HG LEU 132 HG LEU 132 9.680 19.449 -3.212 1073 1HD1 LEU 132 1HD1 LEU 132 9.500 21.733 -2.437 1074 2HD1 LEU 132 2HD1 LEU 132 10.889 21.559 -3.510 1075 3HD1 LEU 132 3HD1 LEU 132 11.129 21.657 -1.766 1076 1HD2 LEU 132 1HD2 LEU 132 11.705 18.667 -3.696 1077 2HD2 LEU 132 2HD2 LEU 132 11.901 18.362 -1.970 1078 3HD2 LEU 132 3HD2 LEU 132 12.494 19.867 -2.672 1079 H LYS 133 H LYS 133 7.765 20.067 0.375 1080 HA LYS 133 HA LYS 133 6.359 18.352 2.194 1081 1HB LYS 133 1HB LYS 133 9.080 19.088 2.789 1082 2HB LYS 133 2HB LYS 133 7.998 19.818 3.968 1083 1HG LYS 133 1HG LYS 133 7.940 17.891 5.047 1084 2HG LYS 133 2HG LYS 133 7.130 17.168 3.657 1085 1HD LYS 133 1HD LYS 133 8.927 15.944 3.182 1086 2HD LYS 133 2HD LYS 133 9.950 17.381 3.149 1087 1HE LYS 133 1HE LYS 133 9.613 17.079 5.811 1088 2HE LYS 133 2HE LYS 133 9.528 15.397 5.287 1089 1HZ LYS 133 1HZ LYS 133 11.672 16.625 3.968 1090 2HZ LYS 133 2HZ LYS 133 11.721 15.382 5.114 1091 3HZ LYS 133 3HZ LYS 133 11.800 16.996 5.614 1092 H ASN 134 H ASN 134 7.752 21.538 1.616 1093 HA ASN 134 HA ASN 134 5.167 22.752 2.242 1094 1HB ASN 134 1HB ASN 134 7.820 23.705 3.351 1095 2HB ASN 134 2HB ASN 134 6.301 24.590 3.471 1096 1HD2 ASN 134 1HD2 ASN 134 8.320 22.807 5.203 1097 2HD2 ASN 134 2HD2 ASN 134 7.226 22.043 6.301 1098 H VAL 135 H VAL 135 5.229 25.144 1.530 1099 HA VAL 135 HA VAL 135 5.104 26.375 -0.414 1100 HB VAL 135 HB VAL 135 7.025 27.307 0.827 1101 1HG1 VAL 135 1HG1 VAL 135 9.074 26.280 -0.968 1102 2HG1 VAL 135 2HG1 VAL 135 8.370 25.035 0.056 1103 3HG1 VAL 135 3HG1 VAL 135 9.090 26.465 0.785 1104 1HG2 VAL 135 1HG2 VAL 135 7.240 28.843 -0.775 1105 2HG2 VAL 135 2HG2 VAL 135 6.265 27.782 -1.791 1106 3HG2 VAL 135 3HG2 VAL 135 8.025 27.703 -1.869 Start of MODEL 9 1 H MET 1 H MET 1 -24.184 -6.856 -43.810 2 HA MET 1 HA MET 1 -23.005 -9.295 -43.717 3 1HB MET 1 1HB MET 1 -22.783 -6.764 -45.048 4 2HB MET 1 2HB MET 1 -21.169 -7.372 -44.717 5 1HG MET 1 1HG MET 1 -21.535 -8.333 -46.736 6 2HG MET 1 2HG MET 1 -22.168 -9.600 -45.688 7 1HE MET 1 1HE MET 1 -22.498 -8.407 -48.784 8 2HE MET 1 2HE MET 1 -23.218 -6.834 -48.440 9 3HE MET 1 3HE MET 1 -24.184 -8.098 -49.199 10 H ASP 2 H ASP 2 -22.903 -8.127 -40.983 11 HA ASP 2 HA ASP 2 -20.227 -8.931 -40.335 12 1HB ASP 2 1HB ASP 2 -21.030 -6.038 -39.943 13 2HB ASP 2 2HB ASP 2 -19.642 -6.790 -39.161 14 H ASP 3 H ASP 3 -21.952 -10.391 -39.360 15 HA ASP 3 HA ASP 3 -23.492 -9.449 -37.165 16 1HB ASP 3 1HB ASP 3 -23.752 -11.604 -38.637 17 2HB ASP 3 2HB ASP 3 -22.689 -12.323 -37.432 18 H TYR 4 H TYR 4 -20.862 -11.856 -37.051 19 HA TYR 4 HA TYR 4 -19.535 -10.445 -34.921 20 1HB TYR 4 1HB TYR 4 -21.529 -12.348 -34.254 21 2HB TYR 4 2HB TYR 4 -19.974 -13.079 -33.874 22 HD1 TYR 4 HD1 TYR 4 -22.485 -11.660 -32.267 23 HD2 TYR 4 HD2 TYR 4 -18.363 -10.855 -32.949 24 HE1 TYR 4 HE1 TYR 4 -22.398 -10.368 -30.178 25 HE2 TYR 4 HE2 TYR 4 -18.265 -9.560 -30.859 26 HH TYR 4 HH TYR 4 -19.797 -9.656 -28.557 27 H GLU 5 H GLU 5 -18.497 -10.980 -37.323 28 HA GLU 5 HA GLU 5 -17.156 -13.473 -37.544 29 1HB GLU 5 1HB GLU 5 -16.548 -10.803 -38.823 30 2HB GLU 5 2HB GLU 5 -15.827 -12.335 -39.298 31 1HG GLU 5 1HG GLU 5 -18.567 -12.793 -39.361 32 2HG GLU 5 2HG GLU 5 -18.362 -11.178 -40.037 33 H LYS 6 H LYS 6 -16.110 -10.261 -36.446 34 HA LYS 6 HA LYS 6 -13.729 -11.533 -35.264 35 1HB LYS 6 1HB LYS 6 -13.945 -9.292 -36.995 36 2HB LYS 6 2HB LYS 6 -13.438 -8.689 -35.423 37 1HG LYS 6 1HG LYS 6 -11.404 -9.625 -35.571 38 2HG LYS 6 2HG LYS 6 -12.014 -11.082 -36.356 39 1HD LYS 6 1HD LYS 6 -12.366 -8.942 -38.172 40 2HD LYS 6 2HD LYS 6 -10.729 -8.814 -37.526 41 1HE LYS 6 1HE LYS 6 -10.252 -10.288 -39.162 42 2HE LYS 6 2HE LYS 6 -10.850 -11.464 -37.992 43 1HZ LYS 6 1HZ LYS 6 -12.111 -12.030 -39.771 44 2HZ LYS 6 2HZ LYS 6 -12.099 -10.476 -40.440 45 3HZ LYS 6 3HZ LYS 6 -13.123 -10.828 -39.141 46 H LEU 7 H LEU 7 -12.851 -10.016 -33.410 47 HA LEU 7 HA LEU 7 -14.954 -8.824 -31.815 48 1HB LEU 7 1HB LEU 7 -14.423 -11.512 -31.465 49 2HB LEU 7 2HB LEU 7 -13.465 -10.752 -30.209 50 HG LEU 7 HG LEU 7 -16.235 -9.774 -30.402 51 1HD1 LEU 7 1HD1 LEU 7 -16.779 -11.937 -28.939 52 2HD1 LEU 7 2HD1 LEU 7 -15.610 -12.643 -30.055 53 3HD1 LEU 7 3HD1 LEU 7 -17.064 -11.863 -30.679 54 1HD2 LEU 7 1HD2 LEU 7 -16.009 -10.225 -27.898 55 2HD2 LEU 7 2HD2 LEU 7 -14.975 -8.980 -28.596 56 3HD2 LEU 7 3HD2 LEU 7 -14.315 -10.575 -28.239 57 H LEU 8 H LEU 8 -12.546 -7.871 -33.065 58 HA LEU 8 HA LEU 8 -10.632 -7.473 -30.922 59 1HB LEU 8 1HB LEU 8 -10.468 -7.514 -33.695 60 2HB LEU 8 2HB LEU 8 -10.262 -5.821 -33.291 61 HG LEU 8 HG LEU 8 -8.554 -6.968 -31.514 62 1HD1 LEU 8 1HD1 LEU 8 -8.947 -8.864 -33.743 63 2HD1 LEU 8 2HD1 LEU 8 -8.423 -9.151 -32.084 64 3HD1 LEU 8 3HD1 LEU 8 -7.280 -8.528 -33.274 65 1HD2 LEU 8 1HD2 LEU 8 -7.266 -6.584 -34.088 66 2HD2 LEU 8 2HD2 LEU 8 -7.094 -5.672 -32.590 67 3HD2 LEU 8 3HD2 LEU 8 -8.403 -5.291 -33.708 68 H GLU 9 H GLU 9 -10.008 -5.378 -30.156 69 HA GLU 9 HA GLU 9 -12.294 -3.577 -29.930 70 1HB GLU 9 1HB GLU 9 -9.944 -4.228 -28.271 71 2HB GLU 9 2HB GLU 9 -10.413 -2.535 -28.260 72 1HG GLU 9 1HG GLU 9 -12.082 -2.948 -26.871 73 2HG GLU 9 2HG GLU 9 -12.738 -4.175 -27.953 74 H ARG 10 H ARG 10 -11.912 -1.232 -29.961 75 HA ARG 10 HA ARG 10 -10.198 -0.529 -32.219 76 1HB ARG 10 1HB ARG 10 -12.627 0.648 -30.957 77 2HB ARG 10 2HB ARG 10 -11.527 1.739 -31.790 78 1HG ARG 10 1HG ARG 10 -11.828 -0.363 -33.556 79 2HG ARG 10 2HG ARG 10 -13.439 -0.157 -32.868 80 1HD ARG 10 1HD ARG 10 -11.819 2.141 -33.938 81 2HD ARG 10 2HD ARG 10 -12.891 1.187 -34.957 82 HE ARG 10 HE ARG 10 -13.734 2.868 -32.692 83 1HH1 ARG 10 1HH1 ARG 10 -14.484 1.167 -35.661 84 2HH1 ARG 10 2HH1 ARG 10 -16.078 1.830 -35.774 85 1HH2 ARG 10 1HH2 ARG 10 -15.829 3.723 -32.850 86 2HH2 ARG 10 2HH2 ARG 10 -16.841 3.278 -34.183 87 H ALA 11 H ALA 11 -8.165 -0.247 -31.473 88 HA ALA 11 HA ALA 11 -6.391 0.768 -30.486 89 1HB ALA 11 1HB ALA 11 -8.480 2.879 -30.190 90 2HB ALA 11 2HB ALA 11 -7.024 2.877 -31.184 91 3HB ALA 11 3HB ALA 11 -6.900 3.084 -29.438 92 H ILE 12 H ILE 12 -7.085 -1.210 -29.033 93 HA ILE 12 HA ILE 12 -7.772 -0.411 -26.328 94 HB ILE 12 HB ILE 12 -8.666 -2.507 -27.307 95 1HG1 ILE 12 1HG1 ILE 12 -7.628 -4.003 -25.318 96 2HG1 ILE 12 2HG1 ILE 12 -7.122 -2.410 -24.773 97 1HG2 ILE 12 1HG2 ILE 12 -5.902 -2.924 -27.930 98 2HG2 ILE 12 2HG2 ILE 12 -7.320 -3.816 -28.482 99 3HG2 ILE 12 3HG2 ILE 12 -6.514 -4.278 -26.982 100 1HD1 ILE 12 1HD1 ILE 12 -9.141 -2.020 -23.967 101 2HD1 ILE 12 2HD1 ILE 12 -9.620 -3.647 -24.445 102 3HD1 ILE 12 3HD1 ILE 12 -9.862 -2.297 -25.553 103 H ASP 13 H ASP 13 -4.962 -0.847 -28.224 104 HA ASP 13 HA ASP 13 -3.226 -0.005 -26.186 105 1HB ASP 13 1HB ASP 13 -3.745 -2.821 -26.200 106 2HB ASP 13 2HB ASP 13 -2.068 -2.549 -26.658 107 H GLN 14 H GLN 14 -2.560 -2.499 -28.647 108 HA GLN 14 HA GLN 14 -0.281 -1.307 -29.669 109 1HB GLN 14 1HB GLN 14 -2.010 -3.500 -30.387 110 2HB GLN 14 2HB GLN 14 -1.481 -2.654 -31.834 111 1HG GLN 14 1HG GLN 14 0.425 -3.762 -31.733 112 2HG GLN 14 2HG GLN 14 0.798 -2.921 -30.229 113 1HE2 GLN 14 1HE2 GLN 14 0.524 -5.878 -31.621 114 2HE2 GLN 14 2HE2 GLN 14 0.259 -6.842 -30.212 115 H LEU 15 H LEU 15 -3.487 -1.253 -31.243 116 HA LEU 15 HA LEU 15 -2.965 0.461 -33.308 117 1HB LEU 15 1HB LEU 15 -5.502 0.751 -31.734 118 2HB LEU 15 2HB LEU 15 -5.267 0.910 -33.459 119 HG LEU 15 HG LEU 15 -4.621 -1.669 -33.223 120 1HD1 LEU 15 1HD1 LEU 15 -4.909 -1.855 -30.844 121 2HD1 LEU 15 2HD1 LEU 15 -6.213 -2.731 -31.638 122 3HD1 LEU 15 3HD1 LEU 15 -6.517 -1.142 -30.941 123 1HD2 LEU 15 1HD2 LEU 15 -6.411 -1.875 -34.523 124 2HD2 LEU 15 2HD2 LEU 15 -6.794 -0.192 -34.160 125 3HD2 LEU 15 3HD2 LEU 15 -7.498 -1.485 -33.190 126 HA PRO 16 HA PRO 16 -1.809 4.435 -31.820 127 1HB PRO 16 1HB PRO 16 -3.447 6.014 -33.444 128 2HB PRO 16 2HB PRO 16 -1.838 5.419 -33.863 129 1HG PRO 16 1HG PRO 16 -4.515 4.333 -34.600 130 2HG PRO 16 2HG PRO 16 -3.024 4.400 -35.558 131 1HD PRO 16 1HD PRO 16 -3.848 2.113 -34.438 132 2HD PRO 16 2HD PRO 16 -2.122 2.529 -34.516 133 HA PRO 17 HA PRO 17 -4.624 5.950 -28.786 134 1HB PRO 17 1HB PRO 17 -4.271 8.677 -29.018 135 2HB PRO 17 2HB PRO 17 -3.181 7.598 -28.141 136 1HG PRO 17 1HG PRO 17 -2.934 8.704 -30.909 137 2HG PRO 17 2HG PRO 17 -1.684 8.493 -29.668 138 1HD PRO 17 1HD PRO 17 -1.917 6.788 -31.725 139 2HD PRO 17 2HD PRO 17 -1.460 6.226 -30.103 140 H GLU 18 H GLU 18 -6.760 6.365 -28.701 141 HA GLU 18 HA GLU 18 -8.112 8.267 -30.272 142 1HB GLU 18 1HB GLU 18 -7.499 6.140 -31.821 143 2HB GLU 18 2HB GLU 18 -9.034 5.595 -31.160 144 1HG GLU 18 1HG GLU 18 -10.186 6.936 -32.495 145 2HG GLU 18 2HG GLU 18 -9.194 8.331 -32.072 146 H VAL 19 H VAL 19 -10.637 6.964 -30.455 147 HA VAL 19 HA VAL 19 -11.539 7.257 -27.778 148 HB VAL 19 HB VAL 19 -13.120 5.945 -29.982 149 1HG1 VAL 19 1HG1 VAL 19 -14.989 7.152 -28.791 150 2HG1 VAL 19 2HG1 VAL 19 -13.830 7.505 -27.510 151 3HG1 VAL 19 3HG1 VAL 19 -14.233 5.832 -27.897 152 1HG2 VAL 19 1HG2 VAL 19 -12.966 8.915 -29.501 153 2HG2 VAL 19 2HG2 VAL 19 -13.808 8.069 -30.798 154 3HG2 VAL 19 3HG2 VAL 19 -12.046 8.088 -30.759 155 H PHE 20 H PHE 20 -10.479 5.730 -26.494 156 HA PHE 20 HA PHE 20 -11.108 2.912 -27.056 157 1HB PHE 20 1HB PHE 20 -9.298 2.519 -25.262 158 2HB PHE 20 2HB PHE 20 -8.787 3.058 -26.856 159 HD1 PHE 20 HD1 PHE 20 -7.173 4.674 -26.918 160 HD2 PHE 20 HD2 PHE 20 -9.852 4.582 -23.611 161 HE1 PHE 20 HE1 PHE 20 -5.970 6.560 -25.897 162 HE2 PHE 20 HE2 PHE 20 -8.653 6.470 -22.584 163 HZ PHE 20 HZ PHE 20 -6.709 7.461 -23.728 164 H GLU 21 H GLU 21 -11.774 1.547 -25.343 165 HA GLU 21 HA GLU 21 -13.481 2.924 -23.427 166 1HB GLU 21 1HB GLU 21 -13.387 0.225 -24.649 167 2HB GLU 21 2HB GLU 21 -13.993 0.305 -23.001 168 1HG GLU 21 1HG GLU 21 -15.107 2.282 -24.877 169 2HG GLU 21 2HG GLU 21 -15.528 0.598 -25.185 170 H THR 22 H THR 22 -13.640 1.203 -21.326 171 HA THR 22 HA THR 22 -11.207 1.780 -19.937 172 HB THR 22 HB THR 22 -13.370 1.923 -18.798 173 HG1 THR 22 HG1 THR 22 -12.021 1.576 -17.227 174 1HG2 THR 22 1HG2 THR 22 -13.607 -0.926 -19.556 175 2HG2 THR 22 2HG2 THR 22 -14.842 0.320 -19.409 176 3HG2 THR 22 3HG2 THR 22 -14.190 -0.450 -17.964 177 H LYS 23 H LYS 23 -9.431 0.586 -19.918 178 HA LYS 23 HA LYS 23 -9.455 -2.080 -20.996 179 1HB LYS 23 1HB LYS 23 -7.049 -2.017 -20.754 180 2HB LYS 23 2HB LYS 23 -7.609 -0.506 -21.453 181 1HG LYS 23 1HG LYS 23 -7.515 0.441 -19.097 182 2HG LYS 23 2HG LYS 23 -6.615 -1.016 -18.671 183 1HD LYS 23 1HD LYS 23 -4.787 0.084 -19.331 184 2HD LYS 23 2HD LYS 23 -5.371 -0.151 -20.977 185 1HE LYS 23 1HE LYS 23 -5.672 2.257 -19.206 186 2HE LYS 23 2HE LYS 23 -4.906 2.149 -20.789 187 1HZ LYS 23 1HZ LYS 23 -7.804 1.664 -20.415 188 2HZ LYS 23 2HZ LYS 23 -6.974 1.991 -21.848 189 3HZ LYS 23 3HZ LYS 23 -7.179 3.209 -20.695 190 H ARG 24 H ARG 24 -7.717 -3.562 -19.613 191 HA ARG 24 HA ARG 24 -9.256 -4.284 -17.286 192 1HB ARG 24 1HB ARG 24 -6.772 -5.505 -18.500 193 2HB ARG 24 2HB ARG 24 -7.653 -6.189 -17.141 194 1HG ARG 24 1HG ARG 24 -9.528 -5.727 -19.205 195 2HG ARG 24 2HG ARG 24 -8.124 -6.510 -19.931 196 1HD ARG 24 1HD ARG 24 -9.145 -8.399 -19.247 197 2HD ARG 24 2HD ARG 24 -8.409 -7.999 -17.697 198 HE ARG 24 HE ARG 24 -10.790 -6.697 -17.633 199 1HH1 ARG 24 1HH1 ARG 24 -9.866 -10.008 -18.239 200 2HH1 ARG 24 2HH1 ARG 24 -11.340 -10.665 -17.611 201 1HH2 ARG 24 1HH2 ARG 24 -12.730 -7.560 -16.807 202 2HH2 ARG 24 2HH2 ARG 24 -12.966 -9.276 -16.799 203 H PHE 25 H PHE 25 -8.658 -2.098 -16.325 204 HA PHE 25 HA PHE 25 -6.049 -1.676 -15.294 205 1HB PHE 25 1HB PHE 25 -8.699 -0.413 -15.040 206 2HB PHE 25 2HB PHE 25 -7.659 -0.226 -13.632 207 HD1 PHE 25 HD1 PHE 25 -5.166 0.465 -14.235 208 HD2 PHE 25 HD2 PHE 25 -8.576 1.176 -16.679 209 HE1 PHE 25 HE1 PHE 25 -3.974 2.301 -15.357 210 HE2 PHE 25 HE2 PHE 25 -7.390 3.012 -17.807 211 HZ PHE 25 HZ PHE 25 -5.085 3.578 -17.146 212 H GLU 26 H GLU 26 -5.075 -2.616 -13.614 213 HA GLU 26 HA GLU 26 -6.701 -3.625 -11.401 214 1HB GLU 26 1HB GLU 26 -5.746 -5.335 -13.330 215 2HB GLU 26 2HB GLU 26 -4.497 -5.427 -12.096 216 1HG GLU 26 1HG GLU 26 -7.412 -5.775 -11.470 217 2HG GLU 26 2HG GLU 26 -6.375 -7.115 -11.959 218 H VAL 27 H VAL 27 -5.978 -2.265 -9.910 219 HA VAL 27 HA VAL 27 -3.253 -2.542 -8.976 220 HB VAL 27 HB VAL 27 -4.332 0.237 -9.467 221 1HG1 VAL 27 1HG1 VAL 27 -1.765 -0.847 -8.356 222 2HG1 VAL 27 2HG1 VAL 27 -2.866 0.335 -7.652 223 3HG1 VAL 27 3HG1 VAL 27 -1.864 0.777 -9.033 224 1HG2 VAL 27 1HG2 VAL 27 -2.034 -0.050 -10.990 225 2HG2 VAL 27 2HG2 VAL 27 -3.688 0.031 -11.591 226 3HG2 VAL 27 3HG2 VAL 27 -2.935 -1.531 -11.290 227 HA PRO 28 HA PRO 28 -6.107 -0.259 -5.694 228 1HB PRO 28 1HB PRO 28 -8.776 -0.996 -6.760 229 2HB PRO 28 2HB PRO 28 -8.232 0.527 -6.046 230 1HG PRO 28 1HG PRO 28 -8.664 0.347 -8.660 231 2HG PRO 28 2HG PRO 28 -7.284 1.258 -8.026 232 1HD PRO 28 1HD PRO 28 -7.342 -1.487 -9.196 233 2HD PRO 28 2HD PRO 28 -6.194 -0.165 -9.496 234 H LYS 29 H LYS 29 -8.667 -1.554 -4.919 235 HA LYS 29 HA LYS 29 -9.467 -3.438 -3.937 236 1HB LYS 29 1HB LYS 29 -8.187 -4.463 -6.117 237 2HB LYS 29 2HB LYS 29 -7.312 -5.251 -4.812 238 1HG LYS 29 1HG LYS 29 -9.037 -6.580 -4.286 239 2HG LYS 29 2HG LYS 29 -10.227 -5.297 -4.518 240 1HD LYS 29 1HD LYS 29 -10.237 -5.629 -6.882 241 2HD LYS 29 2HD LYS 29 -8.847 -6.712 -6.794 242 1HE LYS 29 1HE LYS 29 -10.648 -8.165 -7.034 243 2HE LYS 29 2HE LYS 29 -10.349 -8.173 -5.297 244 1HZ LYS 29 1HZ LYS 29 -12.662 -7.958 -5.582 245 2HZ LYS 29 2HZ LYS 29 -12.499 -6.757 -6.762 246 3HZ LYS 29 3HZ LYS 29 -12.119 -6.415 -5.150 247 H ALA 30 H ALA 30 -8.942 -4.919 -2.167 248 HA ALA 30 HA ALA 30 -7.962 -5.400 -0.173 249 1HB ALA 30 1HB ALA 30 -5.545 -5.445 -0.033 250 2HB ALA 30 2HB ALA 30 -5.418 -4.467 -1.495 251 3HB ALA 30 3HB ALA 30 -6.071 -6.103 -1.583 252 H TYR 31 H TYR 31 -8.750 -4.050 1.313 253 HA TYR 31 HA TYR 31 -7.221 -1.661 1.955 254 1HB TYR 31 1HB TYR 31 -9.437 -0.393 2.230 255 2HB TYR 31 2HB TYR 31 -8.827 -0.611 0.593 256 HD1 TYR 31 HD1 TYR 31 -11.633 -0.969 2.714 257 HD2 TYR 31 HD2 TYR 31 -9.753 -2.684 -0.696 258 HE1 TYR 31 HE1 TYR 31 -13.767 -2.005 2.067 259 HE2 TYR 31 HE2 TYR 31 -11.883 -3.725 -1.353 260 HH TYR 31 HH TYR 31 -14.824 -2.835 -0.117 261 H SER 32 H SER 32 -8.122 -0.662 4.046 262 HA SER 32 HA SER 32 -8.263 -2.761 5.995 263 1HB SER 32 1HB SER 32 -8.018 0.203 6.054 264 2HB SER 32 2HB SER 32 -8.676 -0.579 7.492 265 HG SER 32 HG SER 32 -6.811 -1.723 7.725 266 H VAL 33 H VAL 33 -9.877 -2.414 7.881 267 HA VAL 33 HA VAL 33 -12.544 -1.803 6.820 268 HB VAL 33 HB VAL 33 -12.557 -4.039 8.711 269 1HG1 VAL 33 1HG1 VAL 33 -13.721 -4.088 5.970 270 2HG1 VAL 33 2HG1 VAL 33 -14.382 -2.974 7.167 271 3HG1 VAL 33 3HG1 VAL 33 -14.376 -4.710 7.485 272 1HG2 VAL 33 1HG2 VAL 33 -10.472 -4.411 7.197 273 2HG2 VAL 33 2HG2 VAL 33 -11.665 -4.768 5.949 274 3HG2 VAL 33 3HG2 VAL 33 -11.623 -5.726 7.428 275 H ILE 34 H ILE 34 -13.834 -0.712 8.170 276 HA ILE 34 HA ILE 34 -12.741 0.088 10.729 277 HB ILE 34 HB ILE 34 -13.701 1.780 9.217 278 1HG1 ILE 34 1HG1 ILE 34 -13.732 1.822 11.819 279 2HG1 ILE 34 2HG1 ILE 34 -14.618 3.051 10.929 280 1HG2 ILE 34 1HG2 ILE 34 -15.498 0.286 8.306 281 2HG2 ILE 34 2HG2 ILE 34 -16.026 1.913 8.729 282 3HG2 ILE 34 3HG2 ILE 34 -16.394 0.563 9.798 283 1HD1 ILE 34 1HD1 ILE 34 -16.540 2.434 11.847 284 2HD1 ILE 34 2HD1 ILE 34 -15.588 1.443 12.952 285 3HD1 ILE 34 3HD1 ILE 34 -16.255 0.732 11.482 286 H GLN 35 H GLN 35 -13.145 -1.133 12.450 287 HA GLN 35 HA GLN 35 -15.828 -2.326 12.709 288 1HB GLN 35 1HB GLN 35 -13.469 -3.725 12.467 289 2HB GLN 35 2HB GLN 35 -13.694 -3.665 14.210 290 1HG GLN 35 1HG GLN 35 -14.890 -5.528 13.842 291 2HG GLN 35 2HG GLN 35 -16.168 -4.380 13.447 292 1HE2 GLN 35 1HE2 GLN 35 -13.450 -6.091 11.933 293 2HE2 GLN 35 2HE2 GLN 35 -14.252 -6.389 10.432 294 H GLY 36 H GLY 36 -16.632 -0.614 13.947 295 1HA GLY 36 1HA GLY 36 -17.172 0.342 15.980 296 2HA GLY 36 2HA GLY 36 -16.040 -0.768 16.743 297 H ASN 37 H ASN 37 -13.691 -0.237 16.385 298 HA ASN 37 HA ASN 37 -13.046 2.516 15.840 299 1HB ASN 37 1HB ASN 37 -13.869 2.024 18.402 300 2HB ASN 37 2HB ASN 37 -12.128 1.807 18.547 301 1HD2 ASN 37 1HD2 ASN 37 -10.792 3.564 17.618 302 2HD2 ASN 37 2HD2 ASN 37 -11.352 5.186 17.811 303 H ARG 38 H ARG 38 -12.281 -0.321 15.106 304 HA ARG 38 HA ARG 38 -9.379 0.074 15.330 305 1HB ARG 38 1HB ARG 38 -9.443 -2.604 15.389 306 2HB ARG 38 2HB ARG 38 -9.424 -1.629 16.849 307 1HG ARG 38 1HG ARG 38 -11.649 -2.032 17.307 308 2HG ARG 38 2HG ARG 38 -12.031 -2.415 15.626 309 1HD ARG 38 1HD ARG 38 -10.201 -4.337 16.237 310 2HD ARG 38 2HD ARG 38 -11.029 -4.138 17.777 311 HE ARG 38 HE ARG 38 -12.096 -5.284 15.360 312 1HH1 ARG 38 1HH1 ARG 38 -12.876 -3.743 18.388 313 2HH1 ARG 38 2HH1 ARG 38 -14.450 -4.457 18.493 314 1HH2 ARG 38 1HH2 ARG 38 -14.162 -6.230 15.490 315 2HH2 ARG 38 2HH2 ARG 38 -15.182 -5.876 16.845 316 H THR 39 H THR 39 -8.148 -0.844 13.606 317 HA THR 39 HA THR 39 -9.735 -1.196 11.176 318 HB THR 39 HB THR 39 -7.504 0.329 11.648 319 HG1 THR 39 HG1 THR 39 -7.530 -0.150 9.071 320 1HG2 THR 39 1HG2 THR 39 -5.588 -0.491 10.729 321 2HG2 THR 39 2HG2 THR 39 -6.429 -1.701 9.761 322 3HG2 THR 39 3HG2 THR 39 -6.205 -1.953 11.490 323 H PHE 40 H PHE 40 -9.999 -3.080 10.242 324 HA PHE 40 HA PHE 40 -8.553 -5.404 11.282 325 1HB PHE 40 1HB PHE 40 -11.229 -4.934 10.542 326 2HB PHE 40 2HB PHE 40 -10.595 -6.051 9.343 327 HD1 PHE 40 HD1 PHE 40 -10.051 -8.298 9.910 328 HD2 PHE 40 HD2 PHE 40 -11.305 -5.550 12.905 329 HE1 PHE 40 HE1 PHE 40 -10.397 -10.165 11.464 330 HE2 PHE 40 HE2 PHE 40 -11.657 -7.413 14.469 331 HZ PHE 40 HZ PHE 40 -11.205 -9.725 13.749 332 H ILE 41 H ILE 41 -6.631 -4.506 10.023 333 HA ILE 41 HA ILE 41 -6.580 -4.528 7.218 334 HB ILE 41 HB ILE 41 -4.613 -4.292 9.339 335 1HG1 ILE 41 1HG1 ILE 41 -3.871 -3.418 6.657 336 2HG1 ILE 41 2HG1 ILE 41 -5.483 -2.886 7.123 337 1HG2 ILE 41 1HG2 ILE 41 -3.805 -6.442 8.388 338 2HG2 ILE 41 2HG2 ILE 41 -2.670 -5.113 8.181 339 3HG2 ILE 41 3HG2 ILE 41 -3.660 -5.647 6.823 340 1HD1 ILE 41 1HD1 ILE 41 -4.384 -1.161 8.026 341 2HD1 ILE 41 2HD1 ILE 41 -2.859 -2.045 8.108 342 3HD1 ILE 41 3HD1 ILE 41 -4.085 -2.280 9.355 343 H GLN 42 H GLN 42 -6.812 -6.104 5.851 344 HA GLN 42 HA GLN 42 -6.338 -8.874 6.717 345 1HB GLN 42 1HB GLN 42 -8.359 -7.561 5.087 346 2HB GLN 42 2HB GLN 42 -7.642 -8.933 4.256 347 1HG GLN 42 1HG GLN 42 -9.504 -9.789 5.371 348 2HG GLN 42 2HG GLN 42 -8.119 -10.275 6.348 349 1HE2 GLN 42 1HE2 GLN 42 -7.564 -8.233 7.915 350 2HE2 GLN 42 2HE2 GLN 42 -8.904 -7.742 8.871 351 H ASN 43 H ASN 43 -5.666 -6.535 4.200 352 HA ASN 43 HA ASN 43 -3.709 -8.388 3.033 353 1HB ASN 43 1HB ASN 43 -5.404 -6.199 1.905 354 2HB ASN 43 2HB ASN 43 -3.873 -6.583 1.121 355 1HD2 ASN 43 1HD2 ASN 43 -6.448 -8.497 2.639 356 2HD2 ASN 43 2HD2 ASN 43 -6.692 -9.552 1.294 357 H PHE 44 H PHE 44 -2.822 -7.288 5.305 358 HA PHE 44 HA PHE 44 -1.715 -4.805 5.420 359 1HB PHE 44 1HB PHE 44 -1.527 -6.440 7.245 360 2HB PHE 44 2HB PHE 44 -0.385 -7.380 6.294 361 HD1 PHE 44 HD1 PHE 44 1.661 -7.269 7.360 362 HD2 PHE 44 HD2 PHE 44 -0.641 -3.720 6.902 363 HE1 PHE 44 HE1 PHE 44 3.522 -5.947 8.280 364 HE2 PHE 44 HE2 PHE 44 1.215 -2.392 7.821 365 HZ PHE 44 HZ PHE 44 3.300 -3.505 8.510 366 H ARG 45 H ARG 45 -0.765 -7.394 3.314 367 HA ARG 45 HA ARG 45 1.793 -6.228 2.670 368 1HB ARG 45 1HB ARG 45 0.728 -8.750 2.460 369 2HB ARG 45 2HB ARG 45 0.693 -8.192 0.793 370 1HG ARG 45 1HG ARG 45 2.846 -8.642 0.597 371 2HG ARG 45 2HG ARG 45 3.206 -7.485 1.881 372 1HD ARG 45 1HD ARG 45 2.202 -10.161 2.674 373 2HD ARG 45 2HD ARG 45 3.853 -10.055 2.065 374 HE ARG 45 HE ARG 45 2.958 -9.268 4.620 375 1HH1 ARG 45 1HH1 ARG 45 5.091 -8.236 2.060 376 2HH1 ARG 45 2HH1 ARG 45 6.155 -7.377 3.122 377 1HH2 ARG 45 1HH2 ARG 45 4.356 -8.137 6.020 378 2HH2 ARG 45 2HH2 ARG 45 5.739 -7.321 5.371 379 H GLU 46 H GLU 46 -1.245 -6.774 0.895 380 HA GLU 46 HA GLU 46 -0.481 -5.230 -1.364 381 1HB GLU 46 1HB GLU 46 -2.396 -7.014 -1.066 382 2HB GLU 46 2HB GLU 46 -3.350 -5.601 -0.645 383 1HG GLU 46 1HG GLU 46 -3.519 -4.948 -2.763 384 2HG GLU 46 2HG GLU 46 -1.801 -5.203 -3.064 385 H VAL 47 H VAL 47 -2.358 -4.548 1.533 386 HA VAL 47 HA VAL 47 -3.082 -1.902 0.812 387 HB VAL 47 HB VAL 47 -2.792 -2.960 3.623 388 1HG1 VAL 47 1HG1 VAL 47 -3.250 -0.460 3.035 389 2HG1 VAL 47 2HG1 VAL 47 -4.182 -1.253 4.304 390 3HG1 VAL 47 3HG1 VAL 47 -4.883 -1.037 2.700 391 1HG2 VAL 47 1HG2 VAL 47 -5.479 -3.073 2.593 392 2HG2 VAL 47 2HG2 VAL 47 -4.512 -4.337 3.352 393 3HG2 VAL 47 3HG2 VAL 47 -4.391 -4.057 1.615 394 H ALA 48 H ALA 48 -0.392 -3.298 2.644 395 HA ALA 48 HA ALA 48 0.668 -0.885 3.578 396 1HB ALA 48 1HB ALA 48 2.810 -2.173 3.823 397 2HB ALA 48 2HB ALA 48 1.970 -3.543 3.096 398 3HB ALA 48 3HB ALA 48 1.397 -2.862 4.620 399 H ASP 49 H ASP 49 1.042 -2.493 0.490 400 HA ASP 49 HA ASP 49 3.272 -0.860 -0.330 401 1HB ASP 49 1HB ASP 49 2.584 -3.188 -1.241 402 2HB ASP 49 2HB ASP 49 1.431 -2.298 -2.230 403 H ALA 50 H ALA 50 -0.034 -1.075 -1.628 404 HA ALA 50 HA ALA 50 -0.092 1.210 -3.105 405 1HB ALA 50 1HB ALA 50 -2.484 0.422 -1.493 406 2HB ALA 50 2HB ALA 50 -1.872 -0.611 -2.784 407 3HB ALA 50 3HB ALA 50 -2.405 1.030 -3.144 408 H LEU 51 H LEU 51 -0.953 1.005 0.366 409 HA LEU 51 HA LEU 51 -1.601 3.723 0.622 410 1HB LEU 51 1HB LEU 51 -2.484 2.411 2.307 411 2HB LEU 51 2HB LEU 51 -1.006 1.492 2.510 412 HG LEU 51 HG LEU 51 0.035 3.380 3.637 413 1HD1 LEU 51 1HD1 LEU 51 -2.068 4.816 2.429 414 2HD1 LEU 51 2HD1 LEU 51 -0.718 5.435 3.378 415 3HD1 LEU 51 3HD1 LEU 51 -2.228 5.000 4.177 416 1HD2 LEU 51 1HD2 LEU 51 -1.864 1.699 4.664 417 2HD2 LEU 51 2HD2 LEU 51 -2.453 3.284 5.158 418 3HD2 LEU 51 3HD2 LEU 51 -0.834 2.767 5.615 419 H ASN 52 H ASN 52 1.421 1.945 0.986 420 HA ASN 52 HA ASN 52 2.942 4.336 0.663 421 1HB ASN 52 1HB ASN 52 2.133 3.902 3.261 422 2HB ASN 52 2HB ASN 52 3.741 3.184 3.235 423 1HD2 ASN 52 1HD2 ASN 52 5.192 4.736 1.661 424 2HD2 ASN 52 2HD2 ASN 52 5.245 6.362 2.243 425 H ARG 53 H ARG 53 4.117 3.381 -0.884 426 HA ARG 53 HA ARG 53 4.996 0.883 -1.276 427 1HB ARG 53 1HB ARG 53 7.153 1.956 -2.202 428 2HB ARG 53 2HB ARG 53 5.614 2.424 -2.913 429 1HG ARG 53 1HG ARG 53 5.604 4.449 -1.533 430 2HG ARG 53 2HG ARG 53 7.165 3.984 -0.857 431 1HD ARG 53 1HD ARG 53 7.065 4.013 -3.787 432 2HD ARG 53 2HD ARG 53 6.812 5.586 -3.032 433 HE ARG 53 HE ARG 53 9.262 4.156 -3.205 434 1HH1 ARG 53 1HH1 ARG 53 7.446 6.308 -1.140 435 2HH1 ARG 53 2HH1 ARG 53 8.855 6.971 -0.384 436 1HH2 ARG 53 1HH2 ARG 53 11.115 5.029 -2.211 437 2HH2 ARG 53 2HH2 ARG 53 10.938 6.246 -0.990 438 H ASP 54 H ASP 54 6.264 3.091 1.140 439 HA ASP 54 HA ASP 54 8.378 1.236 1.889 440 1HB ASP 54 1HB ASP 54 7.949 4.051 2.160 441 2HB ASP 54 2HB ASP 54 8.141 3.363 3.769 442 HA PRO 55 HA PRO 55 5.795 -0.701 4.946 443 1HB PRO 55 1HB PRO 55 7.703 -2.007 6.349 444 2HB PRO 55 2HB PRO 55 7.192 -2.520 4.737 445 1HG PRO 55 1HG PRO 55 9.596 -0.932 5.546 446 2HG PRO 55 2HG PRO 55 9.472 -2.253 4.372 447 1HD PRO 55 1HD PRO 55 9.535 0.369 3.653 448 2HD PRO 55 2HD PRO 55 8.684 -0.871 2.712 449 H GLN 56 H GLN 56 8.719 1.013 5.984 450 HA GLN 56 HA GLN 56 7.906 1.294 8.695 451 1HB GLN 56 1HB GLN 56 10.256 1.631 7.354 452 2HB GLN 56 2HB GLN 56 9.780 3.300 7.635 453 1HG GLN 56 1HG GLN 56 9.383 1.863 10.045 454 2HG GLN 56 2HG GLN 56 10.986 1.467 9.429 455 1HE2 GLN 56 1HE2 GLN 56 11.810 2.581 11.281 456 2HE2 GLN 56 2HE2 GLN 56 11.921 4.305 11.280 457 H HIS 57 H HIS 57 7.707 3.389 5.848 458 HA HIS 57 HA HIS 57 6.765 5.686 7.159 459 1HB HIS 57 1HB HIS 57 7.245 4.873 4.482 460 2HB HIS 57 2HB HIS 57 5.606 5.502 4.542 461 HD2 HIS 57 HD2 HIS 57 6.390 7.793 3.123 462 HE1 HIS 57 HE1 HIS 57 8.864 9.346 6.202 463 HE2 HIS 57 HE2 HIS 57 7.696 9.836 4.022 464 H LEU 58 H LEU 58 5.210 2.737 6.301 465 HA LEU 58 HA LEU 58 2.530 3.746 6.391 466 1HB LEU 58 1HB LEU 58 3.676 1.500 5.404 467 2HB LEU 58 2HB LEU 58 3.006 0.881 6.902 468 HG LEU 58 HG LEU 58 1.000 2.454 5.658 469 1HD1 LEU 58 1HD1 LEU 58 1.488 0.337 3.744 470 2HD1 LEU 58 2HD1 LEU 58 2.718 1.583 3.708 471 3HD1 LEU 58 3HD1 LEU 58 1.025 2.007 3.469 472 1HD2 LEU 58 1HD2 LEU 58 1.411 -0.398 6.412 473 2HD2 LEU 58 2HD2 LEU 58 0.043 0.011 5.374 474 3HD2 LEU 58 3HD2 LEU 58 0.196 0.756 6.965 475 H LEU 59 H LEU 59 4.699 2.098 8.605 476 HA LEU 59 HA LEU 59 2.796 1.720 10.681 477 1HB LEU 59 1HB LEU 59 5.109 0.597 10.236 478 2HB LEU 59 2HB LEU 59 5.743 1.940 11.166 479 HG LEU 59 HG LEU 59 3.542 0.715 12.574 480 1HD1 LEU 59 1HD1 LEU 59 5.604 -1.263 12.760 481 2HD1 LEU 59 2HD1 LEU 59 5.047 -1.144 11.093 482 3HD1 LEU 59 3HD1 LEU 59 3.894 -1.467 12.386 483 1HD2 LEU 59 1HD2 LEU 59 5.245 2.144 13.580 484 2HD2 LEU 59 2HD2 LEU 59 6.485 0.953 13.187 485 3HD2 LEU 59 3HD2 LEU 59 5.218 0.555 14.346 486 H LYS 60 H LYS 60 4.935 4.317 9.782 487 HA LYS 60 HA LYS 60 4.755 5.748 12.243 488 1HB LYS 60 1HB LYS 60 6.010 6.087 9.642 489 2HB LYS 60 2HB LYS 60 5.370 7.598 10.272 490 1HG LYS 60 1HG LYS 60 6.659 6.473 12.444 491 2HG LYS 60 2HG LYS 60 7.709 6.094 11.075 492 1HD LYS 60 1HD LYS 60 6.602 8.853 11.426 493 2HD LYS 60 2HD LYS 60 8.033 8.339 12.324 494 1HE LYS 60 1HE LYS 60 8.919 9.322 10.408 495 2HE LYS 60 2HE LYS 60 8.947 7.600 10.040 496 1HZ LYS 60 1HZ LYS 60 7.158 9.688 8.974 497 2HZ LYS 60 2HZ LYS 60 6.671 8.071 8.964 498 3HZ LYS 60 3HZ LYS 60 8.066 8.535 8.135 499 H PHE 61 H PHE 61 3.238 6.229 9.035 500 HA PHE 61 HA PHE 61 1.618 8.393 9.803 501 1HB PHE 61 1HB PHE 61 2.114 7.155 7.444 502 2HB PHE 61 2HB PHE 61 0.502 6.534 7.788 503 HD1 PHE 61 HD1 PHE 61 2.317 9.789 7.966 504 HD2 PHE 61 HD2 PHE 61 -1.242 7.718 6.900 505 HE1 PHE 61 HE1 PHE 61 1.337 11.896 7.158 506 HE2 PHE 61 HE2 PHE 61 -2.228 9.817 6.088 507 HZ PHE 61 HZ PHE 61 -0.939 11.910 6.216 508 H LEU 62 H LEU 62 1.168 4.929 9.947 509 HA LEU 62 HA LEU 62 -1.519 4.773 10.629 510 1HB LEU 62 1HB LEU 62 -0.331 2.807 10.025 511 2HB LEU 62 2HB LEU 62 0.870 3.061 11.273 512 HG LEU 62 HG LEU 62 -0.977 2.650 12.959 513 1HD1 LEU 62 1HD1 LEU 62 -2.967 1.583 12.253 514 2HD1 LEU 62 2HD1 LEU 62 -2.391 1.449 10.595 515 3HD1 LEU 62 3HD1 LEU 62 -2.791 3.030 11.266 516 1HD2 LEU 62 1HD2 LEU 62 -0.829 0.127 11.521 517 2HD2 LEU 62 2HD2 LEU 62 -0.183 0.567 13.102 518 3HD2 LEU 62 3HD2 LEU 62 0.733 0.936 11.641 519 H LEU 63 H LEU 63 1.322 4.880 12.807 520 HA LEU 63 HA LEU 63 -0.242 4.996 15.174 521 1HB LEU 63 1HB LEU 63 1.807 5.434 16.344 522 2HB LEU 63 2HB LEU 63 2.090 4.200 15.133 523 HG LEU 63 HG LEU 63 2.865 6.286 13.698 524 1HD1 LEU 63 1HD1 LEU 63 4.170 7.806 15.247 525 2HD1 LEU 63 2HD1 LEU 63 3.151 7.188 16.546 526 3HD1 LEU 63 3HD1 LEU 63 2.425 8.051 15.191 527 1HD2 LEU 63 1HD2 LEU 63 4.363 4.703 15.740 528 2HD2 LEU 63 2HD2 LEU 63 5.185 5.911 14.752 529 3HD2 LEU 63 3HD2 LEU 63 4.369 4.550 13.983 530 H ARG 64 H ARG 64 0.996 7.414 12.992 531 HA ARG 64 HA ARG 64 0.901 9.667 14.613 532 1HB ARG 64 1HB ARG 64 0.550 9.251 11.663 533 2HB ARG 64 2HB ARG 64 0.334 10.850 12.363 534 1HG ARG 64 1HG ARG 64 2.733 9.920 13.431 535 2HG ARG 64 2HG ARG 64 2.762 9.432 11.735 536 1HD ARG 64 1HD ARG 64 3.740 11.598 11.867 537 2HD ARG 64 2HD ARG 64 2.143 11.784 11.141 538 HE ARG 64 HE ARG 64 2.263 12.177 14.007 539 1HH1 ARG 64 1HH1 ARG 64 2.390 13.680 10.857 540 2HH1 ARG 64 2HH1 ARG 64 1.939 15.243 11.449 541 1HH2 ARG 64 1HH2 ARG 64 1.671 14.232 14.783 542 2HH2 ARG 64 2HH2 ARG 64 1.531 15.558 13.676 543 H GLU 65 H GLU 65 -1.702 8.206 12.672 544 HA GLU 65 HA GLU 65 -3.608 10.145 13.722 545 1HB GLU 65 1HB GLU 65 -3.437 8.558 11.376 546 2HB GLU 65 2HB GLU 65 -4.882 8.052 12.240 547 1HG GLU 65 1HG GLU 65 -5.436 9.781 10.668 548 2HG GLU 65 2HG GLU 65 -5.633 10.390 12.311 549 H LEU 66 H LEU 66 -2.655 6.838 14.214 550 HA LEU 66 HA LEU 66 -4.887 5.755 15.425 551 1HB LEU 66 1HB LEU 66 -2.088 5.155 15.245 552 2HB LEU 66 2HB LEU 66 -2.652 4.816 16.871 553 HG LEU 66 HG LEU 66 -4.290 3.276 16.057 554 1HD1 LEU 66 1HD1 LEU 66 -4.106 4.773 13.672 555 2HD1 LEU 66 2HD1 LEU 66 -5.224 3.470 14.069 556 3HD1 LEU 66 3HD1 LEU 66 -3.688 3.105 13.288 557 1HD2 LEU 66 1HD2 LEU 66 -2.863 1.595 15.685 558 2HD2 LEU 66 2HD2 LEU 66 -1.630 2.826 15.963 559 3HD2 LEU 66 3HD2 LEU 66 -2.103 2.406 14.318 560 H GLY 67 H GLY 67 -6.073 6.698 16.955 561 1HA GLY 67 1HA GLY 67 -4.857 8.364 18.990 562 2HA GLY 67 2HA GLY 67 -6.572 8.062 18.775 563 H THR 68 H THR 68 -5.025 5.125 18.750 564 HA THR 68 HA THR 68 -5.258 4.795 21.664 565 HB THR 68 HB THR 68 -6.454 2.817 21.493 566 HG1 THR 68 HG1 THR 68 -5.484 1.559 20.100 567 1HG2 THR 68 1HG2 THR 68 -8.414 3.373 20.557 568 2HG2 THR 68 2HG2 THR 68 -7.691 3.761 18.998 569 3HG2 THR 68 3HG2 THR 68 -7.629 4.931 20.315 570 H ALA 69 H ALA 69 -4.197 2.704 22.366 571 HA ALA 69 HA ALA 69 -1.548 2.680 22.201 572 1HB ALA 69 1HB ALA 69 -3.159 0.138 22.138 573 2HB ALA 69 2HB ALA 69 -2.944 1.156 23.562 574 3HB ALA 69 3HB ALA 69 -1.551 0.363 22.827 575 H GLY 70 H GLY 70 -3.311 0.342 20.155 576 1HA GLY 70 1HA GLY 70 -2.981 0.062 17.820 577 2HA GLY 70 2HA GLY 70 -1.475 0.953 17.952 578 H ASN 71 H ASN 71 -2.849 -2.081 17.636 579 HA ASN 71 HA ASN 71 -0.300 -3.367 17.672 580 1HB ASN 71 1HB ASN 71 -2.101 -3.624 20.008 581 2HB ASN 71 2HB ASN 71 -1.423 -5.128 19.394 582 1HD2 ASN 71 1HD2 ASN 71 1.069 -4.383 18.601 583 2HD2 ASN 71 2HD2 ASN 71 1.987 -3.849 19.962 584 H LEU 72 H LEU 72 -0.515 -5.738 17.167 585 HA LEU 72 HA LEU 72 -2.629 -6.072 15.201 586 1HB LEU 72 1HB LEU 72 -0.410 -7.993 15.883 587 2HB LEU 72 2HB LEU 72 -1.390 -7.978 14.430 588 HG LEU 72 HG LEU 72 -0.078 -5.447 14.666 589 1HD1 LEU 72 1HD1 LEU 72 1.908 -5.923 15.531 590 2HD1 LEU 72 2HD1 LEU 72 2.190 -7.010 14.172 591 3HD1 LEU 72 3HD1 LEU 72 1.494 -7.632 15.667 592 1HD2 LEU 72 1HD2 LEU 72 0.928 -6.225 12.501 593 2HD2 LEU 72 2HD2 LEU 72 -0.832 -6.273 12.581 594 3HD2 LEU 72 3HD2 LEU 72 0.098 -7.760 12.754 595 H GLU 73 H GLU 73 -4.542 -6.884 15.848 596 HA GLU 73 HA GLU 73 -4.540 -8.900 17.994 597 1HB GLU 73 1HB GLU 73 -6.883 -7.268 16.991 598 2HB GLU 73 2HB GLU 73 -6.900 -8.394 18.335 599 1HG GLU 73 1HG GLU 73 -4.848 -6.549 18.863 600 2HG GLU 73 2HG GLU 73 -6.242 -5.622 18.307 601 H GLY 74 H GLY 74 -6.011 -10.735 17.740 602 1HA GLY 74 1HA GLY 74 -6.784 -12.542 16.550 603 2HA GLY 74 2HA GLY 74 -7.381 -11.361 15.395 604 H GLY 75 H GLY 75 -6.674 -13.682 14.343 605 1HA GLY 75 1HA GLY 75 -4.053 -14.237 13.702 606 2HA GLY 75 2HA GLY 75 -5.409 -14.559 12.635 607 H ARG 76 H ARG 76 -6.094 -11.718 12.372 608 HA ARG 76 HA ARG 76 -4.074 -11.047 10.374 609 1HB ARG 76 1HB ARG 76 -6.916 -10.748 10.562 610 2HB ARG 76 2HB ARG 76 -6.200 -9.157 10.365 611 1HG ARG 76 1HG ARG 76 -6.782 -10.103 8.220 612 2HG ARG 76 2HG ARG 76 -5.030 -9.937 8.359 613 1HD ARG 76 1HD ARG 76 -4.816 -12.092 7.876 614 2HD ARG 76 2HD ARG 76 -5.698 -12.493 9.349 615 HE ARG 76 HE ARG 76 -6.740 -12.443 6.641 616 1HH1 ARG 76 1HH1 ARG 76 -7.450 -12.659 10.059 617 2HH1 ARG 76 2HH1 ARG 76 -9.028 -13.324 9.808 618 1HH2 ARG 76 1HH2 ARG 76 -8.819 -13.288 6.321 619 2HH2 ARG 76 2HH2 ARG 76 -9.806 -13.680 7.689 620 H ALA 77 H ALA 77 -4.422 -8.305 10.206 621 HA ALA 77 HA ALA 77 -3.038 -7.444 12.644 622 1HB ALA 77 1HB ALA 77 -1.629 -6.628 11.117 623 2HB ALA 77 2HB ALA 77 -2.830 -5.369 10.838 624 3HB ALA 77 3HB ALA 77 -2.801 -6.805 9.819 625 H ILE 78 H ILE 78 -5.084 -7.347 13.815 626 HA ILE 78 HA ILE 78 -6.922 -5.212 13.053 627 HB ILE 78 HB ILE 78 -7.090 -6.954 15.497 628 1HG1 ILE 78 1HG1 ILE 78 -8.692 -7.550 13.049 629 2HG1 ILE 78 2HG1 ILE 78 -7.028 -8.121 13.136 630 1HG2 ILE 78 1HG2 ILE 78 -8.511 -5.092 15.703 631 2HG2 ILE 78 2HG2 ILE 78 -9.544 -6.440 15.227 632 3HG2 ILE 78 3HG2 ILE 78 -9.065 -5.231 14.035 633 1HD1 ILE 78 1HD1 ILE 78 -8.104 -9.922 14.011 634 2HD1 ILE 78 2HD1 ILE 78 -9.400 -8.950 14.708 635 3HD1 ILE 78 3HD1 ILE 78 -7.825 -9.004 15.489 636 H LEU 79 H LEU 79 -5.658 -3.333 13.471 637 HA LEU 79 HA LEU 79 -4.716 -2.963 16.215 638 1HB LEU 79 1HB LEU 79 -3.607 -0.964 15.413 639 2HB LEU 79 2HB LEU 79 -3.192 -2.339 14.404 640 HG LEU 79 HG LEU 79 -5.257 -1.373 12.989 641 1HD1 LEU 79 1HD1 LEU 79 -4.016 1.215 13.625 642 2HD1 LEU 79 2HD1 LEU 79 -5.103 0.574 14.849 643 3HD1 LEU 79 3HD1 LEU 79 -5.680 0.822 13.204 644 1HD2 LEU 79 1HD2 LEU 79 -2.491 -0.214 12.774 645 2HD2 LEU 79 2HD2 LEU 79 -3.658 -0.486 11.479 646 3HD2 LEU 79 3HD2 LEU 79 -2.898 -1.858 12.284 647 H GLN 80 H GLN 80 -4.987 -0.459 16.868 648 HA GLN 80 HA GLN 80 -7.760 0.349 16.378 649 1HB GLN 80 1HB GLN 80 -7.041 -1.011 18.656 650 2HB GLN 80 2HB GLN 80 -6.929 0.662 19.168 651 1HG GLN 80 1HG GLN 80 -9.137 0.940 19.180 652 2HG GLN 80 2HG GLN 80 -9.355 0.053 17.675 653 1HE2 GLN 80 1HE2 GLN 80 -10.429 0.059 20.622 654 2HE2 GLN 80 2HE2 GLN 80 -10.570 -1.630 20.961 655 H GLY 81 H GLY 81 -8.082 2.536 16.321 656 1HA GLY 81 1HA GLY 81 -6.738 4.558 17.580 657 2HA GLY 81 2HA GLY 81 -5.750 4.208 16.176 658 H LYS 82 H LYS 82 -6.282 5.096 14.263 659 HA LYS 82 HA LYS 82 -9.003 6.086 13.842 660 1HB LYS 82 1HB LYS 82 -6.567 7.757 14.097 661 2HB LYS 82 2HB LYS 82 -7.706 8.195 12.836 662 1HG LYS 82 1HG LYS 82 -9.446 8.003 14.795 663 2HG LYS 82 2HG LYS 82 -8.014 8.287 15.787 664 1HD LYS 82 1HD LYS 82 -7.605 10.374 14.805 665 2HD LYS 82 2HD LYS 82 -8.653 10.028 13.429 666 1HE LYS 82 1HE LYS 82 -10.541 10.592 14.552 667 2HE LYS 82 2HE LYS 82 -9.924 10.007 16.098 668 1HZ LYS 82 1HZ LYS 82 -9.792 12.201 16.522 669 2HZ LYS 82 2HZ LYS 82 -9.709 12.641 14.892 670 3HZ LYS 82 3HZ LYS 82 -8.323 12.088 15.689 671 H PHE 83 H PHE 83 -6.562 4.282 12.693 672 HA PHE 83 HA PHE 83 -6.611 5.151 9.934 673 1HB PHE 83 1HB PHE 83 -4.943 3.489 11.577 674 2HB PHE 83 2HB PHE 83 -5.431 2.587 10.147 675 HD1 PHE 83 HD1 PHE 83 -3.705 2.562 8.644 676 HD2 PHE 83 HD2 PHE 83 -4.597 6.177 10.701 677 HE1 PHE 83 HE1 PHE 83 -1.980 3.727 7.335 678 HE2 PHE 83 HE2 PHE 83 -2.875 7.351 9.395 679 HZ PHE 83 HZ PHE 83 -1.562 6.121 7.711 680 H THR 84 H THR 84 -9.172 4.598 10.760 681 HA THR 84 HA THR 84 -9.867 1.907 9.978 682 HB THR 84 HB THR 84 -12.222 2.744 10.365 683 HG1 THR 84 HG1 THR 84 -12.193 4.783 11.618 684 1HG2 THR 84 1HG2 THR 84 -10.145 2.879 12.511 685 2HG2 THR 84 2HG2 THR 84 -11.352 1.629 12.204 686 3HG2 THR 84 3HG2 THR 84 -11.846 3.191 12.858 687 H HIS 85 H HIS 85 -8.712 2.492 7.886 688 HA HIS 85 HA HIS 85 -8.816 2.696 5.624 689 1HB HIS 85 1HB HIS 85 -10.846 1.283 5.933 690 2HB HIS 85 2HB HIS 85 -11.814 2.743 6.077 691 HD2 HIS 85 HD2 HIS 85 -12.665 3.800 3.710 692 HE1 HIS 85 HE1 HIS 85 -10.504 1.177 1.168 693 HE2 HIS 85 HE2 HIS 85 -12.207 3.031 1.282 694 H PHE 86 H PHE 86 -8.507 4.966 7.260 695 HA PHE 86 HA PHE 86 -9.985 7.111 5.950 696 1HB PHE 86 1HB PHE 86 -8.353 6.885 8.427 697 2HB PHE 86 2HB PHE 86 -8.427 8.456 7.634 698 HD1 PHE 86 HD1 PHE 86 -10.635 5.718 8.840 699 HD2 PHE 86 HD2 PHE 86 -10.183 9.885 8.103 700 HE1 PHE 86 HE1 PHE 86 -12.824 6.136 9.887 701 HE2 PHE 86 HE2 PHE 86 -12.368 10.310 9.152 702 HZ PHE 86 HZ PHE 86 -13.690 8.434 10.046 703 H LEU 87 H LEU 87 -6.621 7.135 7.005 704 HA LEU 87 HA LEU 87 -5.781 8.661 4.752 705 1HB LEU 87 1HB LEU 87 -4.226 7.245 6.923 706 2HB LEU 87 2HB LEU 87 -3.468 8.196 5.666 707 HG LEU 87 HG LEU 87 -3.556 9.563 7.591 708 1HD1 LEU 87 1HD1 LEU 87 -5.733 10.323 5.662 709 2HD1 LEU 87 2HD1 LEU 87 -4.041 10.818 5.637 710 3HD1 LEU 87 3HD1 LEU 87 -5.109 11.393 6.916 711 1HD2 LEU 87 1HD2 LEU 87 -6.391 8.630 7.847 712 2HD2 LEU 87 2HD2 LEU 87 -5.838 10.108 8.622 713 3HD2 LEU 87 3HD2 LEU 87 -5.087 8.566 9.029 714 H ILE 88 H ILE 88 -5.706 5.290 5.647 715 HA ILE 88 HA ILE 88 -3.915 4.282 3.777 716 HB ILE 88 HB ILE 88 -6.470 2.892 4.554 717 1HG1 ILE 88 1HG1 ILE 88 -3.921 3.204 6.174 718 2HG1 ILE 88 2HG1 ILE 88 -5.544 3.718 6.624 719 1HG2 ILE 88 1HG2 ILE 88 -4.456 2.098 2.903 720 2HG2 ILE 88 2HG2 ILE 88 -5.548 1.016 3.766 721 3HG2 ILE 88 3HG2 ILE 88 -3.964 1.393 4.443 722 1HD1 ILE 88 1HD1 ILE 88 -4.285 1.296 7.221 723 2HD1 ILE 88 2HD1 ILE 88 -5.558 0.918 6.060 724 3HD1 ILE 88 3HD1 ILE 88 -5.952 1.764 7.556 725 H ASN 89 H ASN 89 -7.459 4.305 3.470 726 HA ASN 89 HA ASN 89 -7.624 3.602 0.804 727 1HB ASN 89 1HB ASN 89 -9.560 3.697 2.329 728 2HB ASN 89 2HB ASN 89 -9.489 5.453 2.302 729 1HD2 ASN 89 1HD2 ASN 89 -8.918 3.446 -0.521 730 2HD2 ASN 89 2HD2 ASN 89 -10.352 3.905 -1.365 731 H GLU 90 H GLU 90 -7.650 6.907 2.129 732 HA GLU 90 HA GLU 90 -7.822 8.278 -0.293 733 1HB GLU 90 1HB GLU 90 -6.736 9.012 2.404 734 2HB GLU 90 2HB GLU 90 -6.581 10.130 1.055 735 1HG GLU 90 1HG GLU 90 -9.151 9.677 0.797 736 2HG GLU 90 2HG GLU 90 -9.016 9.220 2.494 737 H ARG 91 H ARG 91 -4.852 7.641 1.599 738 HA ARG 91 HA ARG 91 -3.060 8.677 -0.271 739 1HB ARG 91 1HB ARG 91 -2.834 7.544 2.218 740 2HB ARG 91 2HB ARG 91 -2.063 6.340 1.198 741 1HG ARG 91 1HG ARG 91 -1.336 9.259 1.185 742 2HG ARG 91 2HG ARG 91 -0.519 8.038 2.162 743 1HD ARG 91 1HD ARG 91 0.258 6.890 0.244 744 2HD ARG 91 2HD ARG 91 -0.804 7.804 -0.821 745 HE ARG 91 HE ARG 91 1.610 8.845 0.499 746 1HH1 ARG 91 1HH1 ARG 91 -0.827 9.081 -2.003 747 2HH1 ARG 91 2HH1 ARG 91 -0.047 10.403 -2.799 748 1HH2 ARG 91 1HH2 ARG 91 2.621 10.583 -0.552 749 2HH2 ARG 91 2HH2 ARG 91 1.905 11.257 -1.978 750 H ILE 92 H ILE 92 -4.171 5.313 0.167 751 HA ILE 92 HA ILE 92 -2.665 4.108 -1.817 752 HB ILE 92 HB ILE 92 -5.480 3.500 -0.890 753 1HG1 ILE 92 1HG1 ILE 92 -2.862 2.066 -0.450 754 2HG1 ILE 92 2HG1 ILE 92 -3.604 3.155 0.710 755 1HG2 ILE 92 1HG2 ILE 92 -4.717 1.186 -2.029 756 2HG2 ILE 92 2HG2 ILE 92 -3.928 2.331 -3.114 757 3HG2 ILE 92 3HG2 ILE 92 -5.672 2.410 -2.866 758 1HD1 ILE 92 1HD1 ILE 92 -3.933 0.721 1.152 759 2HD1 ILE 92 2HD1 ILE 92 -4.921 0.653 -0.308 760 3HD1 ILE 92 3HD1 ILE 92 -5.421 1.663 1.049 761 H GLU 93 H GLU 93 -6.001 5.347 -2.120 762 HA GLU 93 HA GLU 93 -6.337 5.002 -4.845 763 1HB GLU 93 1HB GLU 93 -7.952 5.828 -2.910 764 2HB GLU 93 2HB GLU 93 -7.541 7.410 -3.558 765 1HG GLU 93 1HG GLU 93 -9.013 7.154 -5.184 766 2HG GLU 93 2HG GLU 93 -8.191 5.695 -5.730 767 H ASP 94 H ASP 94 -4.593 7.501 -3.159 768 HA ASP 94 HA ASP 94 -4.507 9.386 -5.256 769 1HB ASP 94 1HB ASP 94 -3.362 9.085 -2.644 770 2HB ASP 94 2HB ASP 94 -2.102 9.578 -3.771 771 H TYR 95 H TYR 95 -2.333 6.731 -4.361 772 HA TYR 95 HA TYR 95 -0.639 7.254 -6.651 773 1HB TYR 95 1HB TYR 95 0.101 6.395 -4.297 774 2HB TYR 95 2HB TYR 95 -0.386 4.818 -4.913 775 HD1 TYR 95 HD1 TYR 95 1.648 7.761 -6.011 776 HD2 TYR 95 HD2 TYR 95 1.251 3.527 -5.892 777 HE1 TYR 95 HE1 TYR 95 3.822 7.532 -7.136 778 HE2 TYR 95 HE2 TYR 95 3.425 3.286 -7.016 779 HH TYR 95 HH TYR 95 4.862 5.414 -8.717 780 H VAL 96 H VAL 96 -2.515 4.419 -5.501 781 HA VAL 96 HA VAL 96 -2.291 2.941 -7.852 782 HB VAL 96 HB VAL 96 -4.197 1.622 -7.125 783 1HG1 VAL 96 1HG1 VAL 96 -1.970 1.366 -6.020 784 2HG1 VAL 96 2HG1 VAL 96 -3.341 0.833 -5.048 785 3HG1 VAL 96 3HG1 VAL 96 -2.571 2.382 -4.708 786 1HG2 VAL 96 1HG2 VAL 96 -5.606 2.189 -5.314 787 2HG2 VAL 96 2HG2 VAL 96 -5.556 3.600 -6.367 788 3HG2 VAL 96 3HG2 VAL 96 -4.612 3.570 -4.887 789 H ASN 97 H ASN 97 -4.721 5.430 -6.980 790 HA ASN 97 HA ASN 97 -5.807 5.144 -9.701 791 1HB ASN 97 1HB ASN 97 -7.077 6.338 -7.228 792 2HB ASN 97 2HB ASN 97 -7.745 6.496 -8.841 793 1HD2 ASN 97 1HD2 ASN 97 -6.302 3.500 -8.560 794 2HD2 ASN 97 2HD2 ASN 97 -7.707 2.599 -8.154 795 H LYS 98 H LYS 98 -3.433 6.456 -9.549 796 HA LYS 98 HA LYS 98 -3.884 9.282 -9.206 797 1HB LYS 98 1HB LYS 98 -1.594 9.577 -9.882 798 2HB LYS 98 2HB LYS 98 -1.662 8.208 -8.779 799 1HG LYS 98 1HG LYS 98 -1.916 6.888 -11.073 800 2HG LYS 98 2HG LYS 98 -1.035 8.298 -11.666 801 1HD LYS 98 1HD LYS 98 0.261 7.548 -9.303 802 2HD LYS 98 2HD LYS 98 -0.080 6.039 -10.151 803 1HE LYS 98 1HE LYS 98 1.568 8.378 -11.033 804 2HE LYS 98 2HE LYS 98 1.997 6.669 -10.985 805 1HZ LYS 98 1HZ LYS 98 1.563 6.743 -13.163 806 2HZ LYS 98 2HZ LYS 98 0.675 8.177 -13.057 807 3HZ LYS 98 3HZ LYS 98 -0.068 6.697 -12.716 808 H PHE 99 H PHE 99 -4.920 7.201 -11.498 809 HA PHE 99 HA PHE 99 -4.274 8.721 -13.843 810 1HB PHE 99 1HB PHE 99 -6.329 7.190 -14.700 811 2HB PHE 99 2HB PHE 99 -4.669 6.635 -14.624 812 HD1 PHE 99 HD1 PHE 99 -4.388 4.505 -13.818 813 HD2 PHE 99 HD2 PHE 99 -7.594 6.846 -12.292 814 HE1 PHE 99 HE1 PHE 99 -5.112 2.612 -12.425 815 HE2 PHE 99 HE2 PHE 99 -8.314 4.969 -10.891 816 HZ PHE 99 HZ PHE 99 -7.075 2.839 -10.957 817 H VAL 100 H VAL 100 -7.182 8.265 -11.853 818 HA VAL 100 HA VAL 100 -8.531 10.406 -13.294 819 HB VAL 100 HB VAL 100 -9.653 8.811 -10.995 820 1HG1 VAL 100 1HG1 VAL 100 -11.526 9.549 -13.031 821 2HG1 VAL 100 2HG1 VAL 100 -10.631 10.975 -12.506 822 3HG1 VAL 100 3HG1 VAL 100 -11.502 9.996 -11.325 823 1HG2 VAL 100 1HG2 VAL 100 -9.434 7.008 -12.309 824 2HG2 VAL 100 2HG2 VAL 100 -9.095 7.975 -13.745 825 3HG2 VAL 100 3HG2 VAL 100 -10.762 7.709 -13.233 826 H ILE 101 H ILE 101 -6.703 9.991 -10.440 827 HA ILE 101 HA ILE 101 -7.922 12.262 -9.087 828 HB ILE 101 HB ILE 101 -5.992 10.137 -8.323 829 1HG1 ILE 101 1HG1 ILE 101 -7.643 10.971 -6.190 830 2HG1 ILE 101 2HG1 ILE 101 -8.642 11.022 -7.638 831 1HG2 ILE 101 1HG2 ILE 101 -4.595 11.827 -7.606 832 2HG2 ILE 101 2HG2 ILE 101 -5.581 11.529 -6.175 833 3HG2 ILE 101 3HG2 ILE 101 -5.930 12.911 -7.216 834 1HD1 ILE 101 1HD1 ILE 101 -7.120 8.662 -6.568 835 2HD1 ILE 101 2HD1 ILE 101 -7.963 8.687 -8.117 836 3HD1 ILE 101 3HD1 ILE 101 -8.870 8.880 -6.616 837 H CYS 102 H CYS 102 -4.645 11.344 -10.175 838 HA CYS 102 HA CYS 102 -3.759 14.088 -10.000 839 1HB CYS 102 1HB CYS 102 -2.289 12.160 -9.415 840 2HB CYS 102 2HB CYS 102 -2.281 11.697 -11.113 841 H HIS 103 H HIS 103 -5.889 13.644 -11.852 842 HA HIS 103 HA HIS 103 -6.529 13.967 -14.016 843 1HB HIS 103 1HB HIS 103 -4.439 16.003 -13.403 844 2HB HIS 103 2HB HIS 103 -5.030 15.897 -15.059 845 HD2 HIS 103 HD2 HIS 103 -6.261 18.437 -14.662 846 HE1 HIS 103 HE1 HIS 103 -9.264 16.936 -12.066 847 HE2 HIS 103 HE2 HIS 103 -8.454 18.928 -13.380 848 H GLU 104 H GLU 104 -5.013 11.708 -13.898 849 HA GLU 104 HA GLU 104 -3.586 10.316 -14.995 850 1HB GLU 104 1HB GLU 104 -4.087 10.030 -17.318 851 2HB GLU 104 2HB GLU 104 -5.571 10.431 -16.470 852 1HG GLU 104 1HG GLU 104 -4.400 12.841 -17.426 853 2HG GLU 104 2HG GLU 104 -4.438 11.670 -18.739 854 H CYS 105 H CYS 105 -1.769 11.555 -14.122 855 HA CYS 105 HA CYS 105 -0.340 13.339 -15.853 856 1HB CYS 105 1HB CYS 105 -0.296 12.689 -13.132 857 2HB CYS 105 2HB CYS 105 1.266 12.158 -13.744 858 H ASN 106 H ASN 106 -0.788 11.109 -17.366 859 HA ASN 106 HA ASN 106 1.359 9.232 -17.238 860 1HB ASN 106 1HB ASN 106 -0.923 9.789 -19.068 861 2HB ASN 106 2HB ASN 106 0.446 8.900 -19.729 862 1HD2 ASN 106 1HD2 ASN 106 -2.398 8.706 -17.963 863 2HD2 ASN 106 2HD2 ASN 106 -2.237 7.083 -17.391 864 H ARG 107 H ARG 107 0.478 11.425 -19.874 865 HA ARG 107 HA ARG 107 3.150 11.501 -20.888 866 1HB ARG 107 1HB ARG 107 0.692 11.864 -21.981 867 2HB ARG 107 2HB ARG 107 1.214 13.533 -21.803 868 1HG ARG 107 1HG ARG 107 1.757 12.677 -24.001 869 2HG ARG 107 2HG ARG 107 3.222 13.051 -23.093 870 1HD ARG 107 1HD ARG 107 2.806 10.431 -22.443 871 2HD ARG 107 2HD ARG 107 2.232 10.491 -24.108 872 HE ARG 107 HE ARG 107 4.880 11.557 -23.422 873 1HH1 ARG 107 1HH1 ARG 107 2.919 9.232 -25.149 874 2HH1 ARG 107 2HH1 ARG 107 4.215 8.728 -26.177 875 1HH2 ARG 107 1HH2 ARG 107 6.571 10.895 -24.778 876 2HH2 ARG 107 2HH2 ARG 107 6.288 9.668 -25.968 877 HA PRO 108 HA PRO 108 4.722 14.782 -18.309 878 1HB PRO 108 1HB PRO 108 6.441 15.326 -20.673 879 2HB PRO 108 2HB PRO 108 6.897 15.034 -18.991 880 1HG PRO 108 1HG PRO 108 7.256 13.151 -20.834 881 2HG PRO 108 2HG PRO 108 6.703 12.730 -19.202 882 1HD PRO 108 1HD PRO 108 5.138 12.924 -21.745 883 2HD PRO 108 2HD PRO 108 5.007 11.745 -20.423 884 H ASP 109 H ASP 109 2.574 15.870 -18.750 885 HA ASP 109 HA ASP 109 2.809 18.071 -20.676 886 1HB ASP 109 1HB ASP 109 0.622 16.431 -19.776 887 2HB ASP 109 2HB ASP 109 0.261 18.126 -19.460 888 H THR 110 H THR 110 3.409 17.473 -17.479 889 HA THR 110 HA THR 110 3.197 20.316 -16.817 890 HB THR 110 HB THR 110 2.426 19.680 -14.517 891 HG1 THR 110 HG1 THR 110 1.815 17.184 -15.704 892 1HG2 THR 110 1HG2 THR 110 0.566 18.847 -16.729 893 2HG2 THR 110 2HG2 THR 110 0.800 20.493 -16.138 894 3HG2 THR 110 3HG2 THR 110 0.103 19.265 -15.080 895 H ARG 111 H ARG 111 4.356 20.632 -14.553 896 HA ARG 111 HA ARG 111 7.013 19.521 -14.932 897 1HB ARG 111 1HB ARG 111 5.968 21.987 -13.989 898 2HB ARG 111 2HB ARG 111 6.873 21.264 -12.665 899 1HG ARG 111 1HG ARG 111 8.441 22.563 -13.789 900 2HG ARG 111 2HG ARG 111 8.745 20.925 -14.375 901 1HD ARG 111 1HD ARG 111 7.564 21.364 -16.410 902 2HD ARG 111 2HD ARG 111 7.009 22.926 -15.809 903 HE ARG 111 HE ARG 111 9.585 22.310 -16.939 904 1HH1 ARG 111 1HH1 ARG 111 7.789 24.505 -14.906 905 2HH1 ARG 111 2HH1 ARG 111 8.887 25.822 -15.144 906 1HH2 ARG 111 1HH2 ARG 111 11.030 24.037 -17.251 907 2HH2 ARG 111 2HH2 ARG 111 10.728 25.557 -16.476 908 H ILE 112 H ILE 112 7.171 17.511 -14.132 909 HA ILE 112 HA ILE 112 6.198 16.989 -11.409 910 HB ILE 112 HB ILE 112 7.107 14.996 -13.491 911 1HG1 ILE 112 1HG1 ILE 112 4.273 15.538 -12.604 912 2HG1 ILE 112 2HG1 ILE 112 4.988 16.313 -14.014 913 1HG2 ILE 112 1HG2 ILE 112 5.906 14.710 -10.754 914 2HG2 ILE 112 2HG2 ILE 112 7.404 14.018 -11.378 915 3HG2 ILE 112 3HG2 ILE 112 5.848 13.414 -11.949 916 1HD1 ILE 112 1HD1 ILE 112 5.251 14.220 -15.118 917 2HD1 ILE 112 2HD1 ILE 112 3.598 14.314 -14.514 918 3HD1 ILE 112 3HD1 ILE 112 4.793 13.334 -13.664 919 H ILE 113 H ILE 113 7.564 16.412 -9.789 920 HA ILE 113 HA ILE 113 10.390 15.929 -10.402 921 HB ILE 113 HB ILE 113 9.429 17.946 -8.362 922 1HG1 ILE 113 1HG1 ILE 113 9.352 18.754 -10.701 923 2HG1 ILE 113 2HG1 ILE 113 10.553 19.610 -9.739 924 1HG2 ILE 113 1HG2 ILE 113 11.418 16.589 -7.675 925 2HG2 ILE 113 2HG2 ILE 113 11.712 18.323 -7.789 926 3HG2 ILE 113 3HG2 ILE 113 12.272 17.249 -9.070 927 1HD1 ILE 113 1HD1 ILE 113 11.295 19.027 -12.033 928 2HD1 ILE 113 2HD1 ILE 113 11.196 17.324 -11.583 929 3HD1 ILE 113 3HD1 ILE 113 12.333 18.390 -10.758 930 H ARG 114 H ARG 114 11.188 14.263 -9.232 931 HA ARG 114 HA ARG 114 9.692 13.455 -6.830 932 1HB ARG 114 1HB ARG 114 10.435 11.094 -7.412 933 2HB ARG 114 2HB ARG 114 9.184 11.795 -8.427 934 1HG ARG 114 1HG ARG 114 12.028 12.054 -9.255 935 2HG ARG 114 2HG ARG 114 11.194 10.514 -9.477 936 1HD ARG 114 1HD ARG 114 9.763 12.951 -10.354 937 2HD ARG 114 2HD ARG 114 11.162 12.460 -11.310 938 HE ARG 114 HE ARG 114 9.400 10.279 -10.791 939 1HH1 ARG 114 1HH1 ARG 114 9.853 13.080 -12.819 940 2HH1 ARG 114 2HH1 ARG 114 8.951 12.423 -14.142 941 1HH2 ARG 114 1HH2 ARG 114 8.211 9.412 -12.530 942 2HH2 ARG 114 2HH2 ARG 114 8.019 10.341 -13.979 943 H GLU 115 H GLU 115 10.815 13.246 -5.007 944 HA GLU 115 HA GLU 115 13.753 13.055 -5.202 945 1HB GLU 115 1HB GLU 115 13.197 15.290 -4.506 946 2HB GLU 115 2HB GLU 115 12.085 14.688 -3.287 947 1HG GLU 115 1HG GLU 115 13.817 15.085 -1.913 948 2HG GLU 115 2HG GLU 115 14.352 13.499 -2.463 949 H GLY 116 H GLY 116 14.768 11.606 -3.918 950 1HA GLY 116 1HA GLY 116 15.009 10.194 -2.040 951 2HA GLY 116 2HA GLY 116 13.281 10.318 -1.755 952 H ARG 117 H ARG 117 14.756 9.529 -4.858 953 HA ARG 117 HA ARG 117 14.524 7.716 -6.214 954 1HB ARG 117 1HB ARG 117 15.638 6.832 -3.848 955 2HB ARG 117 2HB ARG 117 14.296 5.721 -4.082 956 1HG ARG 117 1HG ARG 117 16.477 6.292 -6.078 957 2HG ARG 117 2HG ARG 117 16.354 4.859 -5.055 958 1HD ARG 117 1HD ARG 117 13.888 5.009 -6.304 959 2HD ARG 117 2HD ARG 117 15.029 5.475 -7.564 960 HE ARG 117 HE ARG 117 16.228 3.328 -6.871 961 1HH1 ARG 117 1HH1 ARG 117 12.753 3.734 -6.776 962 2HH1 ARG 117 2HH1 ARG 117 12.433 2.046 -6.976 963 1HH2 ARG 117 1HH2 ARG 117 15.794 1.114 -7.136 964 2HH2 ARG 117 2HH2 ARG 117 14.153 0.561 -7.181 965 H ILE 118 H ILE 118 12.237 8.927 -6.092 966 HA ILE 118 HA ILE 118 10.021 8.662 -6.535 967 HB ILE 118 HB ILE 118 10.414 5.700 -6.083 968 1HG1 ILE 118 1HG1 ILE 118 11.944 6.529 -7.827 969 2HG1 ILE 118 2HG1 ILE 118 10.679 5.518 -8.513 970 1HG2 ILE 118 1HG2 ILE 118 8.079 6.980 -6.233 971 2HG2 ILE 118 2HG2 ILE 118 8.327 5.368 -6.901 972 3HG2 ILE 118 3HG2 ILE 118 8.395 6.779 -7.956 973 1HD1 ILE 118 1HD1 ILE 118 10.878 7.308 -9.987 974 2HD1 ILE 118 2HD1 ILE 118 10.994 8.489 -8.683 975 3HD1 ILE 118 3HD1 ILE 118 9.456 7.695 -9.019 976 H SER 119 H SER 119 10.442 9.658 -4.209 977 HA SER 119 HA SER 119 8.763 8.140 -2.326 978 1HB SER 119 1HB SER 119 11.290 8.613 -1.782 979 2HB SER 119 2HB SER 119 10.702 10.221 -1.373 980 HG SER 119 HG SER 119 10.617 8.029 0.105 981 H LEU 120 H LEU 120 9.599 11.308 -3.613 982 HA LEU 120 HA LEU 120 6.946 12.271 -2.777 983 1HB LEU 120 1HB LEU 120 9.553 13.779 -2.655 984 2HB LEU 120 2HB LEU 120 7.983 14.548 -2.554 985 HG LEU 120 HG LEU 120 8.629 14.386 -0.345 986 1HD1 LEU 120 1HD1 LEU 120 6.945 13.242 0.603 987 2HD1 LEU 120 2HD1 LEU 120 7.311 11.756 -0.273 988 3HD1 LEU 120 3HD1 LEU 120 6.431 13.057 -1.073 989 1HD2 LEU 120 1HD2 LEU 120 9.544 11.558 -0.759 990 2HD2 LEU 120 2HD2 LEU 120 9.788 12.568 0.663 991 3HD2 LEU 120 3HD2 LEU 120 10.605 12.962 -0.848 992 H LEU 121 H LEU 121 6.166 14.105 -4.097 993 HA LEU 121 HA LEU 121 7.448 14.680 -6.581 994 1HB LEU 121 1HB LEU 121 5.109 12.806 -6.508 995 2HB LEU 121 2HB LEU 121 5.396 13.827 -7.905 996 HG LEU 121 HG LEU 121 7.855 12.645 -7.487 997 1HD1 LEU 121 1HD1 LEU 121 7.537 10.827 -6.229 998 2HD1 LEU 121 2HD1 LEU 121 6.687 10.155 -7.620 999 3HD1 LEU 121 3HD1 LEU 121 5.782 10.959 -6.338 1000 1HD2 LEU 121 1HD2 LEU 121 5.711 11.557 -9.290 1001 2HD2 LEU 121 2HD2 LEU 121 7.456 11.557 -9.548 1002 3HD2 LEU 121 3HD2 LEU 121 6.557 13.072 -9.597 1003 H LYS 122 H LYS 122 6.549 16.481 -7.649 1004 HA LYS 122 HA LYS 122 4.326 17.785 -6.195 1005 1HB LYS 122 1HB LYS 122 6.763 18.786 -6.244 1006 2HB LYS 122 2HB LYS 122 6.271 19.362 -7.827 1007 1HG LYS 122 1HG LYS 122 4.373 19.875 -5.633 1008 2HG LYS 122 2HG LYS 122 5.908 20.739 -5.547 1009 1HD LYS 122 1HD LYS 122 4.757 20.763 -8.217 1010 2HD LYS 122 2HD LYS 122 3.689 21.487 -7.014 1011 1HE LYS 122 1HE LYS 122 4.893 23.348 -7.165 1012 2HE LYS 122 2HE LYS 122 6.243 22.475 -6.441 1013 1HZ LYS 122 1HZ LYS 122 5.819 22.136 -9.308 1014 2HZ LYS 122 2HZ LYS 122 7.262 22.219 -8.431 1015 3HZ LYS 122 3HZ LYS 122 6.413 23.635 -8.794 1016 H CYS 123 H CYS 123 2.683 18.784 -7.345 1017 HA CYS 123 HA CYS 123 2.784 18.738 -10.266 1018 1HB CYS 123 1HB CYS 123 0.988 17.088 -8.569 1019 2HB CYS 123 2HB CYS 123 0.287 17.807 -10.010 1020 H GLU 124 H GLU 124 2.982 21.061 -8.964 1021 HA GLU 124 HA GLU 124 0.659 22.299 -8.060 1022 1HB GLU 124 1HB GLU 124 3.124 23.134 -8.061 1023 2HB GLU 124 2HB GLU 124 2.709 23.833 -9.622 1024 1HG GLU 124 1HG GLU 124 1.957 25.598 -8.519 1025 2HG GLU 124 2HG GLU 124 0.621 24.588 -7.972 1026 H ALA 125 H ALA 125 1.716 21.619 -11.304 1027 HA ALA 125 HA ALA 125 0.027 23.435 -12.664 1028 1HB ALA 125 1HB ALA 125 0.324 21.452 -14.465 1029 2HB ALA 125 2HB ALA 125 1.673 21.104 -13.386 1030 3HB ALA 125 3HB ALA 125 1.542 22.687 -14.154 1031 H CYS 126 H CYS 126 -0.339 19.888 -12.708 1032 HA CYS 126 HA CYS 126 -3.175 20.148 -13.154 1033 1HB CYS 126 1HB CYS 126 -3.195 17.795 -13.491 1034 2HB CYS 126 2HB CYS 126 -1.699 18.381 -14.207 1035 H GLY 127 H GLY 127 -2.516 21.277 -10.681 1036 1HA GLY 127 1HA GLY 127 -4.153 21.034 -8.836 1037 2HA GLY 127 2HA GLY 127 -3.716 19.331 -8.812 1038 H ALA 128 H ALA 128 -2.522 18.854 -7.107 1039 HA ALA 128 HA ALA 128 -0.161 20.415 -6.531 1040 1HB ALA 128 1HB ALA 128 -1.062 21.632 -4.912 1041 2HB ALA 128 2HB ALA 128 -1.204 20.144 -3.978 1042 3HB ALA 128 3HB ALA 128 -2.562 20.707 -4.950 1043 H LYS 129 H LYS 129 1.345 19.346 -5.239 1044 HA LYS 129 HA LYS 129 0.775 16.692 -4.251 1045 1HB LYS 129 1HB LYS 129 1.821 17.031 -6.866 1046 2HB LYS 129 2HB LYS 129 3.123 16.428 -5.864 1047 1HG LYS 129 1HG LYS 129 2.305 14.384 -6.009 1048 2HG LYS 129 2HG LYS 129 0.816 14.921 -5.234 1049 1HD LYS 129 1HD LYS 129 0.362 15.812 -7.721 1050 2HD LYS 129 2HD LYS 129 1.410 14.444 -8.096 1051 1HE LYS 129 1HE LYS 129 -0.349 13.106 -7.876 1052 2HE LYS 129 2HE LYS 129 -0.414 13.533 -6.166 1053 1HZ LYS 129 1HZ LYS 129 -2.021 14.540 -8.396 1054 2HZ LYS 129 2HZ LYS 129 -1.674 15.610 -7.132 1055 3HZ LYS 129 3HZ LYS 129 -2.484 14.160 -6.814 1056 H ALA 130 H ALA 130 2.542 15.851 -2.915 1057 HA ALA 130 HA ALA 130 4.033 18.057 -1.720 1058 1HB ALA 130 1HB ALA 130 4.036 16.894 0.236 1059 2HB ALA 130 2HB ALA 130 4.118 15.326 -0.565 1060 3HB ALA 130 3HB ALA 130 2.593 16.209 -0.511 1061 HA PRO 131 HA PRO 131 7.615 16.409 -4.017 1062 1HB PRO 131 1HB PRO 131 9.115 18.660 -3.766 1063 2HB PRO 131 2HB PRO 131 7.884 18.454 -5.011 1064 1HG PRO 131 1HG PRO 131 7.738 19.947 -2.434 1065 2HG PRO 131 2HG PRO 131 7.076 20.379 -4.018 1066 1HD PRO 131 1HD PRO 131 5.581 19.331 -1.992 1067 2HD PRO 131 2HD PRO 131 5.195 19.116 -3.709 1068 H LEU 132 H LEU 132 7.191 17.411 -0.783 1069 HA LEU 132 HA LEU 132 9.286 15.739 0.134 1070 1HB LEU 132 1HB LEU 132 10.641 17.458 1.265 1071 2HB LEU 132 2HB LEU 132 10.742 17.517 -0.483 1072 HG LEU 132 HG LEU 132 8.674 19.301 0.464 1073 1HD1 LEU 132 1HD1 LEU 132 10.672 20.861 1.354 1074 2HD1 LEU 132 2HD1 LEU 132 11.239 19.291 1.921 1075 3HD1 LEU 132 3HD1 LEU 132 9.654 19.885 2.413 1076 1HD2 LEU 132 1HD2 LEU 132 10.486 20.891 -0.676 1077 2HD2 LEU 132 2HD2 LEU 132 9.414 19.852 -1.614 1078 3HD2 LEU 132 3HD2 LEU 132 11.068 19.341 -1.286 1079 H LYS 133 H LYS 133 6.822 15.402 0.802 1080 HA LYS 133 HA LYS 133 5.769 16.872 2.961 1081 1HB LYS 133 1HB LYS 133 4.678 15.063 1.419 1082 2HB LYS 133 2HB LYS 133 5.285 13.923 2.610 1083 1HG LYS 133 1HG LYS 133 3.763 14.536 4.173 1084 2HG LYS 133 2HG LYS 133 3.727 16.219 3.648 1085 1HD LYS 133 1HD LYS 133 1.716 15.680 2.799 1086 2HD LYS 133 2HD LYS 133 2.645 14.936 1.496 1087 1HE LYS 133 1HE LYS 133 2.353 13.194 3.810 1088 2HE LYS 133 2HE LYS 133 0.802 13.670 3.119 1089 1HZ LYS 133 1HZ LYS 133 2.227 13.051 0.929 1090 2HZ LYS 133 2HZ LYS 133 1.185 11.983 1.724 1091 3HZ LYS 133 3HZ LYS 133 2.845 11.938 2.044 1092 H ASN 134 H ASN 134 5.300 14.717 4.875 1093 HA ASN 134 HA ASN 134 7.250 15.143 6.733 1094 1HB ASN 134 1HB ASN 134 6.451 13.079 7.846 1095 2HB ASN 134 2HB ASN 134 5.126 14.097 7.289 1096 1HD2 ASN 134 1HD2 ASN 134 4.657 11.488 7.863 1097 2HD2 ASN 134 2HD2 ASN 134 4.350 10.606 6.409 1098 H VAL 135 H VAL 135 9.282 14.514 7.054 1099 HA VAL 135 HA VAL 135 10.282 12.171 5.577 1100 HB VAL 135 HB VAL 135 12.050 14.537 6.126 1101 1HG1 VAL 135 1HG1 VAL 135 13.346 12.728 5.509 1102 2HG1 VAL 135 2HG1 VAL 135 13.079 13.529 3.961 1103 3HG1 VAL 135 3HG1 VAL 135 12.132 12.105 4.391 1104 1HG2 VAL 135 1HG2 VAL 135 10.588 15.705 4.815 1105 2HG2 VAL 135 2HG2 VAL 135 9.999 14.261 3.989 1106 3HG2 VAL 135 3HG2 VAL 135 11.565 14.950 3.555 Start of MODEL 10 1 H MET 1 H MET 1 -19.142 -1.300 -26.357 2 HA MET 1 HA MET 1 -17.792 -2.024 -28.819 3 1HB MET 1 1HB MET 1 -18.822 0.271 -27.597 4 2HB MET 1 2HB MET 1 -17.077 0.441 -27.458 5 1HG MET 1 1HG MET 1 -16.802 0.263 -29.821 6 2HG MET 1 2HG MET 1 -18.500 -0.157 -30.038 7 1HE MET 1 1HE MET 1 -16.436 1.889 -31.200 8 2HE MET 1 2HE MET 1 -16.866 3.588 -30.999 9 3HE MET 1 3HE MET 1 -17.889 2.529 -31.970 10 H ASP 2 H ASP 2 -17.238 -1.889 -25.381 11 HA ASP 2 HA ASP 2 -14.407 -2.551 -25.858 12 1HB ASP 2 1HB ASP 2 -14.679 -0.302 -24.846 13 2HB ASP 2 2HB ASP 2 -15.529 -1.038 -23.489 14 H ASP 3 H ASP 3 -13.553 -4.255 -24.737 15 HA ASP 3 HA ASP 3 -15.357 -6.205 -23.741 16 1HB ASP 3 1HB ASP 3 -12.354 -6.005 -23.819 17 2HB ASP 3 2HB ASP 3 -13.164 -7.354 -23.029 18 H TYR 4 H TYR 4 -15.417 -7.125 -21.615 19 HA TYR 4 HA TYR 4 -15.728 -5.264 -19.559 20 1HB TYR 4 1HB TYR 4 -16.112 -8.059 -19.915 21 2HB TYR 4 2HB TYR 4 -15.200 -7.838 -18.427 22 HD1 TYR 4 HD1 TYR 4 -18.300 -8.524 -19.355 23 HD2 TYR 4 HD2 TYR 4 -16.281 -5.406 -17.285 24 HE1 TYR 4 HE1 TYR 4 -20.381 -7.968 -18.171 25 HE2 TYR 4 HE2 TYR 4 -18.352 -4.842 -16.095 26 HH TYR 4 HH TYR 4 -20.899 -6.787 -15.817 27 H GLU 5 H GLU 5 -14.585 -5.468 -17.379 28 HA GLU 5 HA GLU 5 -11.839 -4.829 -17.755 29 1HB GLU 5 1HB GLU 5 -13.462 -5.235 -15.239 30 2HB GLU 5 2HB GLU 5 -11.804 -4.650 -15.263 31 1HG GLU 5 1HG GLU 5 -12.452 -2.679 -16.456 32 2HG GLU 5 2HG GLU 5 -14.094 -3.287 -16.654 33 H LYS 6 H LYS 6 -10.619 -6.495 -18.436 34 HA LYS 6 HA LYS 6 -10.835 -9.160 -17.561 35 1HB LYS 6 1HB LYS 6 -9.437 -7.803 -19.516 36 2HB LYS 6 2HB LYS 6 -8.166 -8.359 -18.442 37 1HG LYS 6 1HG LYS 6 -8.385 -10.482 -19.098 38 2HG LYS 6 2HG LYS 6 -10.147 -10.411 -19.043 39 1HD LYS 6 1HD LYS 6 -8.860 -8.896 -21.224 40 2HD LYS 6 2HD LYS 6 -8.723 -10.652 -21.321 41 1HE LYS 6 1HE LYS 6 -10.933 -10.937 -21.704 42 2HE LYS 6 2HE LYS 6 -11.395 -9.598 -20.654 43 1HZ LYS 6 1HZ LYS 6 -11.152 -9.633 -23.460 44 2HZ LYS 6 2HZ LYS 6 -10.056 -8.506 -22.833 45 3HZ LYS 6 3HZ LYS 6 -11.700 -8.383 -22.459 46 H LEU 7 H LEU 7 -9.800 -10.311 -15.982 47 HA LEU 7 HA LEU 7 -8.603 -8.755 -13.839 48 1HB LEU 7 1HB LEU 7 -10.022 -11.280 -14.084 49 2HB LEU 7 2HB LEU 7 -8.594 -11.434 -13.081 50 HG LEU 7 HG LEU 7 -10.121 -9.073 -12.369 51 1HD1 LEU 7 1HD1 LEU 7 -12.109 -10.062 -11.567 52 2HD1 LEU 7 2HD1 LEU 7 -11.539 -11.689 -11.936 53 3HD1 LEU 7 3HD1 LEU 7 -11.949 -10.581 -13.245 54 1HD2 LEU 7 1HD2 LEU 7 -9.687 -9.778 -10.205 55 2HD2 LEU 7 2HD2 LEU 7 -8.322 -10.439 -11.105 56 3HD2 LEU 7 3HD2 LEU 7 -9.670 -11.484 -10.655 57 H LEU 8 H LEU 8 -6.698 -8.355 -15.350 58 HA LEU 8 HA LEU 8 -4.835 -10.603 -15.479 59 1HB LEU 8 1HB LEU 8 -4.992 -7.925 -16.780 60 2HB LEU 8 2HB LEU 8 -3.416 -8.675 -16.603 61 HG LEU 8 HG LEU 8 -4.404 -10.709 -17.772 62 1HD1 LEU 8 1HD1 LEU 8 -6.380 -9.109 -19.163 63 2HD1 LEU 8 2HD1 LEU 8 -6.770 -9.313 -17.455 64 3HD1 LEU 8 3HD1 LEU 8 -6.515 -10.728 -18.477 65 1HD2 LEU 8 1HD2 LEU 8 -4.228 -9.605 -20.023 66 2HD2 LEU 8 2HD2 LEU 8 -2.864 -9.328 -18.941 67 3HD2 LEU 8 3HD2 LEU 8 -4.074 -8.066 -19.176 68 H GLU 9 H GLU 9 -2.449 -9.914 -15.052 69 HA GLU 9 HA GLU 9 -1.772 -7.936 -13.250 70 1HB GLU 9 1HB GLU 9 -3.244 -10.035 -12.002 71 2HB GLU 9 2HB GLU 9 -1.590 -10.100 -11.412 72 1HG GLU 9 1HG GLU 9 -1.851 -8.272 -10.173 73 2HG GLU 9 2HG GLU 9 -2.634 -7.394 -11.486 74 H ARG 10 H ARG 10 -0.439 -8.730 -15.338 75 HA ARG 10 HA ARG 10 1.718 -10.498 -14.396 76 1HB ARG 10 1HB ARG 10 0.378 -10.878 -16.623 77 2HB ARG 10 2HB ARG 10 1.449 -9.633 -17.251 78 1HG ARG 10 1HG ARG 10 3.081 -11.467 -15.879 79 2HG ARG 10 2HG ARG 10 1.951 -12.419 -16.843 80 1HD ARG 10 1HD ARG 10 2.642 -11.399 -18.849 81 2HD ARG 10 2HD ARG 10 3.469 -10.097 -17.996 82 HE ARG 10 HE ARG 10 4.490 -12.733 -18.565 83 1HH1 ARG 10 1HH1 ARG 10 4.797 -9.908 -16.536 84 2HH1 ARG 10 2HH1 ARG 10 6.462 -10.201 -16.164 85 1HH2 ARG 10 1HH2 ARG 10 6.681 -13.123 -18.072 86 2HH2 ARG 10 2HH2 ARG 10 7.531 -12.028 -17.033 87 H ALA 11 H ALA 11 3.777 -9.778 -14.235 88 HA ALA 11 HA ALA 11 5.498 -8.309 -13.997 89 1HB ALA 11 1HB ALA 11 5.112 -6.452 -16.067 90 2HB ALA 11 2HB ALA 11 4.487 -7.989 -16.664 91 3HB ALA 11 3HB ALA 11 6.146 -7.881 -16.078 92 H ILE 12 H ILE 12 2.952 -7.707 -12.662 93 HA ILE 12 HA ILE 12 3.058 -4.776 -12.584 94 HB ILE 12 HB ILE 12 0.921 -6.569 -11.442 95 1HG1 ILE 12 1HG1 ILE 12 1.020 -5.041 -14.049 96 2HG1 ILE 12 2HG1 ILE 12 0.935 -6.787 -13.853 97 1HG2 ILE 12 1HG2 ILE 12 1.525 -3.835 -11.029 98 2HG2 ILE 12 2HG2 ILE 12 0.133 -4.748 -10.446 99 3HG2 ILE 12 3HG2 ILE 12 0.054 -3.913 -11.997 100 1HD1 ILE 12 1HD1 ILE 12 -1.235 -6.303 -14.336 101 2HD1 ILE 12 2HD1 ILE 12 -1.183 -4.733 -13.537 102 3HD1 ILE 12 3HD1 ILE 12 -1.278 -6.208 -12.576 103 H ASP 13 H ASP 13 1.724 -6.557 -9.913 104 HA ASP 13 HA ASP 13 3.507 -5.261 -8.081 105 1HB ASP 13 1HB ASP 13 1.493 -7.431 -7.475 106 2HB ASP 13 2HB ASP 13 2.161 -6.248 -6.353 107 H GLN 14 H GLN 14 2.710 -8.683 -8.641 108 HA GLN 14 HA GLN 14 5.057 -9.597 -7.266 109 1HB GLN 14 1HB GLN 14 2.631 -10.741 -8.387 110 2HB GLN 14 2HB GLN 14 4.032 -11.729 -8.761 111 1HG GLN 14 1HG GLN 14 3.337 -12.631 -6.773 112 2HG GLN 14 2HG GLN 14 4.560 -11.483 -6.233 113 1HE2 GLN 14 1HE2 GLN 14 1.232 -12.334 -6.214 114 2HE2 GLN 14 2HE2 GLN 14 0.693 -11.094 -5.141 115 H LEU 15 H LEU 15 5.797 -11.756 -9.034 116 HA LEU 15 HA LEU 15 7.235 -12.219 -10.733 117 1HB LEU 15 1HB LEU 15 5.916 -9.780 -11.935 118 2HB LEU 15 2HB LEU 15 7.055 -10.786 -12.800 119 HG LEU 15 HG LEU 15 4.960 -11.498 -13.550 120 1HD1 LEU 15 1HD1 LEU 15 4.848 -13.628 -11.636 121 2HD1 LEU 15 2HD1 LEU 15 6.525 -13.263 -12.039 122 3HD1 LEU 15 3HD1 LEU 15 5.379 -13.656 -13.317 123 1HD2 LEU 15 1HD2 LEU 15 4.084 -11.197 -10.704 124 2HD2 LEU 15 2HD2 LEU 15 3.180 -12.210 -11.824 125 3HD2 LEU 15 3HD2 LEU 15 3.397 -10.495 -12.166 126 HA PRO 16 HA PRO 16 11.082 -10.164 -10.106 127 1HB PRO 16 1HB PRO 16 11.842 -9.541 -12.743 128 2HB PRO 16 2HB PRO 16 12.255 -11.005 -11.847 129 1HG PRO 16 1HG PRO 16 10.082 -10.548 -13.835 130 2HG PRO 16 2HG PRO 16 11.058 -12.000 -13.549 131 1HD PRO 16 1HD PRO 16 8.530 -11.872 -12.709 132 2HD PRO 16 2HD PRO 16 9.777 -12.643 -11.707 133 HA PRO 17 HA PRO 17 9.292 -5.952 -10.295 134 1HB PRO 17 1HB PRO 17 10.934 -4.995 -8.302 135 2HB PRO 17 2HB PRO 17 9.373 -5.769 -8.018 136 1HG PRO 17 1HG PRO 17 12.123 -6.934 -7.859 137 2HG PRO 17 2HG PRO 17 10.736 -7.183 -6.782 138 1HD PRO 17 1HD PRO 17 11.425 -9.008 -8.625 139 2HD PRO 17 2HD PRO 17 9.724 -8.688 -8.225 140 H GLU 18 H GLU 18 10.958 -3.804 -9.791 141 HA GLU 18 HA GLU 18 12.672 -2.527 -10.613 142 1HB GLU 18 1HB GLU 18 13.759 -5.143 -10.752 143 2HB GLU 18 2HB GLU 18 14.108 -4.364 -12.287 144 1HG GLU 18 1HG GLU 18 15.742 -3.198 -11.369 145 2HG GLU 18 2HG GLU 18 14.645 -2.540 -10.155 146 H VAL 19 H VAL 19 10.631 -4.496 -12.504 147 HA VAL 19 HA VAL 19 11.240 -3.130 -14.997 148 HB VAL 19 HB VAL 19 9.160 -5.245 -14.412 149 1HG1 VAL 19 1HG1 VAL 19 8.855 -3.681 -16.424 150 2HG1 VAL 19 2HG1 VAL 19 8.778 -5.419 -16.707 151 3HG1 VAL 19 3HG1 VAL 19 10.242 -4.526 -17.114 152 1HG2 VAL 19 1HG2 VAL 19 11.940 -5.474 -15.553 153 2HG2 VAL 19 2HG2 VAL 19 10.738 -6.766 -15.583 154 3HG2 VAL 19 3HG2 VAL 19 11.345 -6.162 -14.041 155 H PHE 20 H PHE 20 10.204 -1.347 -15.602 156 HA PHE 20 HA PHE 20 7.724 -0.617 -14.204 157 1HB PHE 20 1HB PHE 20 8.225 1.693 -14.993 158 2HB PHE 20 2HB PHE 20 9.479 1.026 -13.953 159 HD1 PHE 20 HD1 PHE 20 11.677 0.591 -14.780 160 HD2 PHE 20 HD2 PHE 20 8.607 1.946 -17.396 161 HE1 PHE 20 HE1 PHE 20 13.364 1.064 -16.507 162 HE2 PHE 20 HE2 PHE 20 10.288 2.422 -19.129 163 HZ PHE 20 HZ PHE 20 12.670 1.980 -18.686 164 H GLU 21 H GLU 21 5.892 -0.009 -15.332 165 HA GLU 21 HA GLU 21 5.825 0.256 -18.164 166 1HB GLU 21 1HB GLU 21 5.692 -2.393 -17.134 167 2HB GLU 21 2HB GLU 21 4.098 -1.979 -17.748 168 1HG GLU 21 1HG GLU 21 6.009 -1.101 -19.644 169 2HG GLU 21 2HG GLU 21 6.419 -2.753 -19.184 170 H THR 22 H THR 22 3.272 -0.219 -18.803 171 HA THR 22 HA THR 22 1.860 1.721 -17.176 172 HB THR 22 HB THR 22 1.738 1.960 -19.590 173 HG1 THR 22 HG1 THR 22 -0.606 1.866 -19.777 174 1HG2 THR 22 1HG2 THR 22 1.623 0.211 -20.935 175 2HG2 THR 22 2HG2 THR 22 -0.034 -0.050 -20.393 176 3HG2 THR 22 3HG2 THR 22 1.298 -0.868 -19.579 177 H LYS 23 H LYS 23 1.183 0.805 -15.315 178 HA LYS 23 HA LYS 23 -0.166 -1.772 -15.382 179 1HB LYS 23 1HB LYS 23 -0.277 -1.419 -12.866 180 2HB LYS 23 2HB LYS 23 1.322 -1.612 -13.562 181 1HG LYS 23 1HG LYS 23 1.183 1.045 -13.620 182 2HG LYS 23 2HG LYS 23 0.073 0.746 -12.284 183 1HD LYS 23 1HD LYS 23 1.868 0.599 -10.968 184 2HD LYS 23 2HD LYS 23 2.228 -0.930 -11.773 185 1HE LYS 23 1HE LYS 23 3.977 -0.064 -12.869 186 2HE LYS 23 2HE LYS 23 3.099 1.406 -13.287 187 1HZ LYS 23 1HZ LYS 23 3.576 2.306 -11.128 188 2HZ LYS 23 2HZ LYS 23 5.028 1.814 -11.844 189 3HZ LYS 23 3HZ LYS 23 4.318 0.868 -10.635 190 H ARG 24 H ARG 24 -2.077 -1.320 -16.439 191 HA ARG 24 HA ARG 24 -3.853 0.715 -15.336 192 1HB ARG 24 1HB ARG 24 -3.917 -1.000 -17.804 193 2HB ARG 24 2HB ARG 24 -5.347 -0.130 -17.267 194 1HG ARG 24 1HG ARG 24 -4.479 1.911 -17.799 195 2HG ARG 24 2HG ARG 24 -2.811 1.386 -17.556 196 1HD ARG 24 1HD ARG 24 -4.601 0.649 -19.866 197 2HD ARG 24 2HD ARG 24 -3.248 1.778 -19.917 198 HE ARG 24 HE ARG 24 -1.941 -0.338 -19.165 199 1HH1 ARG 24 1HH1 ARG 24 -4.578 -0.230 -21.458 200 2HH1 ARG 24 2HH1 ARG 24 -4.031 -1.619 -22.333 201 1HH2 ARG 24 1HH2 ARG 24 -1.226 -2.157 -20.323 202 2HH2 ARG 24 2HH2 ARG 24 -2.130 -2.711 -21.692 203 H PHE 25 H PHE 25 -3.290 -1.521 -13.657 204 HA PHE 25 HA PHE 25 -5.356 -3.462 -13.784 205 1HB PHE 25 1HB PHE 25 -4.667 -4.005 -11.457 206 2HB PHE 25 2HB PHE 25 -3.308 -3.932 -12.574 207 HD1 PHE 25 HD1 PHE 25 -1.467 -2.651 -12.057 208 HD2 PHE 25 HD2 PHE 25 -5.158 -1.853 -10.106 209 HE1 PHE 25 HE1 PHE 25 -0.334 -1.024 -10.596 210 HE2 PHE 25 HE2 PHE 25 -4.033 -0.230 -8.646 211 HZ PHE 25 HZ PHE 25 -1.623 0.191 -8.884 212 H GLU 26 H GLU 26 -7.026 -3.736 -12.074 213 HA GLU 26 HA GLU 26 -7.972 -1.315 -10.788 214 1HB GLU 26 1HB GLU 26 -9.000 -2.176 -13.326 215 2HB GLU 26 2HB GLU 26 -10.262 -2.339 -12.113 216 1HG GLU 26 1HG GLU 26 -9.082 0.160 -11.657 217 2HG GLU 26 2HG GLU 26 -9.261 0.017 -13.405 218 H VAL 27 H VAL 27 -8.233 -2.058 -8.781 219 HA VAL 27 HA VAL 27 -10.089 -4.246 -8.305 220 HB VAL 27 HB VAL 27 -7.365 -4.330 -7.012 221 1HG1 VAL 27 1HG1 VAL 27 -9.029 -6.738 -7.116 222 2HG1 VAL 27 2HG1 VAL 27 -9.712 -5.416 -6.169 223 3HG1 VAL 27 3HG1 VAL 27 -8.111 -6.046 -5.780 224 1HG2 VAL 27 1HG2 VAL 27 -7.267 -6.514 -8.471 225 2HG2 VAL 27 2HG2 VAL 27 -6.753 -4.960 -9.125 226 3HG2 VAL 27 3HG2 VAL 27 -8.348 -5.598 -9.517 227 HA PRO 28 HA PRO 28 -10.936 -0.773 -5.425 228 1HB PRO 28 1HB PRO 28 -13.211 -2.623 -4.899 229 2HB PRO 28 2HB PRO 28 -13.219 -0.877 -5.171 230 1HG PRO 28 1HG PRO 28 -14.013 -2.548 -7.084 231 2HG PRO 28 2HG PRO 28 -13.067 -1.100 -7.475 232 1HD PRO 28 1HD PRO 28 -12.206 -3.955 -7.358 233 2HD PRO 28 2HD PRO 28 -11.691 -2.664 -8.462 234 H LYS 29 H LYS 29 -11.312 -4.240 -4.722 235 HA LYS 29 HA LYS 29 -11.014 -3.920 -1.905 236 1HB LYS 29 1HB LYS 29 -11.892 -5.943 -3.535 237 2HB LYS 29 2HB LYS 29 -10.329 -6.554 -3.012 238 1HG LYS 29 1HG LYS 29 -12.162 -5.451 -0.951 239 2HG LYS 29 2HG LYS 29 -12.533 -7.028 -1.650 240 1HD LYS 29 1HD LYS 29 -9.881 -6.282 -0.422 241 2HD LYS 29 2HD LYS 29 -11.165 -7.149 0.423 242 1HE LYS 29 1HE LYS 29 -10.242 -9.026 -0.345 243 2HE LYS 29 2HE LYS 29 -10.843 -8.563 -1.936 244 1HZ LYS 29 1HZ LYS 29 -8.797 -8.054 -2.645 245 2HZ LYS 29 2HZ LYS 29 -8.262 -9.003 -1.352 246 3HZ LYS 29 3HZ LYS 29 -8.344 -7.322 -1.189 247 H ALA 30 H ALA 30 -9.154 -2.894 -1.361 248 HA ALA 30 HA ALA 30 -6.760 -4.417 -1.277 249 1HB ALA 30 1HB ALA 30 -5.773 -3.813 -3.175 250 2HB ALA 30 2HB ALA 30 -5.792 -2.139 -2.624 251 3HB ALA 30 3HB ALA 30 -7.129 -2.765 -3.588 252 H TYR 31 H TYR 31 -8.325 -3.259 0.651 253 HA TYR 31 HA TYR 31 -6.423 -1.469 1.895 254 1HB TYR 31 1HB TYR 31 -7.957 0.304 2.362 255 2HB TYR 31 2HB TYR 31 -8.022 0.001 0.632 256 HD1 TYR 31 HD1 TYR 31 -10.029 1.138 2.954 257 HD2 TYR 31 HD2 TYR 31 -9.851 -2.295 0.450 258 HE1 TYR 31 HE1 TYR 31 -12.472 0.912 3.095 259 HE2 TYR 31 HE2 TYR 31 -12.290 -2.534 0.589 260 HH TYR 31 HH TYR 31 -14.272 -0.923 1.043 261 H SER 32 H SER 32 -7.360 -0.846 4.177 262 HA SER 32 HA SER 32 -7.910 -3.361 5.475 263 1HB SER 32 1HB SER 32 -6.286 -1.891 6.489 264 2HB SER 32 2HB SER 32 -7.457 -0.575 6.562 265 HG SER 32 HG SER 32 -8.505 -1.573 8.171 266 H VAL 33 H VAL 33 -9.478 -3.067 7.509 267 HA VAL 33 HA VAL 33 -11.959 -1.803 6.566 268 HB VAL 33 HB VAL 33 -12.467 -4.209 8.125 269 1HG1 VAL 33 1HG1 VAL 33 -13.536 -4.276 5.478 270 2HG1 VAL 33 2HG1 VAL 33 -13.687 -2.640 6.119 271 3HG1 VAL 33 3HG1 VAL 33 -14.372 -4.001 7.007 272 1HG2 VAL 33 1HG2 VAL 33 -10.461 -5.040 7.024 273 2HG2 VAL 33 2HG2 VAL 33 -11.099 -4.547 5.456 274 3HG2 VAL 33 3HG2 VAL 33 -11.898 -5.827 6.370 275 H ILE 34 H ILE 34 -13.416 -1.145 8.194 276 HA ILE 34 HA ILE 34 -12.092 -0.622 10.745 277 HB ILE 34 HB ILE 34 -14.570 0.615 9.545 278 1HG1 ILE 34 1HG1 ILE 34 -12.664 2.561 9.659 279 2HG1 ILE 34 2HG1 ILE 34 -11.685 1.144 9.305 280 1HG2 ILE 34 1HG2 ILE 34 -14.883 1.035 11.771 281 2HG2 ILE 34 2HG2 ILE 34 -13.855 2.404 11.342 282 3HG2 ILE 34 3HG2 ILE 34 -13.158 0.991 12.135 283 1HD1 ILE 34 1HD1 ILE 34 -12.565 2.508 7.343 284 2HD1 ILE 34 2HD1 ILE 34 -14.131 1.779 7.703 285 3HD1 ILE 34 3HD1 ILE 34 -12.757 0.758 7.279 286 H GLN 35 H GLN 35 -13.167 -0.902 12.733 287 HA GLN 35 HA GLN 35 -15.635 -2.415 12.799 288 1HB GLN 35 1HB GLN 35 -13.080 -3.701 12.918 289 2HB GLN 35 2HB GLN 35 -13.877 -3.874 14.476 290 1HG GLN 35 1HG GLN 35 -15.767 -4.921 13.475 291 2HG GLN 35 2HG GLN 35 -15.177 -4.557 11.853 292 1HE2 GLN 35 1HE2 GLN 35 -15.159 -6.754 14.432 293 2HE2 GLN 35 2HE2 GLN 35 -14.017 -7.878 13.784 294 H GLY 36 H GLY 36 -16.567 -0.827 14.044 295 1HA GLY 36 1HA GLY 36 -17.168 0.208 16.008 296 2HA GLY 36 2HA GLY 36 -16.096 -0.910 16.840 297 H ASN 37 H ASN 37 -13.732 -0.399 16.646 298 HA ASN 37 HA ASN 37 -13.059 2.378 16.187 299 1HB ASN 37 1HB ASN 37 -12.676 1.183 18.939 300 2HB ASN 37 2HB ASN 37 -12.260 2.816 18.432 301 1HD2 ASN 37 1HD2 ASN 37 -13.900 4.327 18.119 302 2HD2 ASN 37 2HD2 ASN 37 -15.488 4.097 18.759 303 H ARG 38 H ARG 38 -12.320 -0.354 15.238 304 HA ARG 38 HA ARG 38 -9.424 -0.046 15.567 305 1HB ARG 38 1HB ARG 38 -9.233 -2.566 15.653 306 2HB ARG 38 2HB ARG 38 -9.858 -1.795 17.097 307 1HG ARG 38 1HG ARG 38 -12.142 -2.394 16.382 308 2HG ARG 38 2HG ARG 38 -11.447 -3.249 15.001 309 1HD ARG 38 1HD ARG 38 -10.334 -4.797 16.417 310 2HD ARG 38 2HD ARG 38 -10.696 -3.845 17.852 311 HE ARG 38 HE ARG 38 -12.861 -4.694 17.855 312 1HH1 ARG 38 1HH1 ARG 38 -11.168 -5.734 14.988 313 2HH1 ARG 38 2HH1 ARG 38 -12.242 -7.051 14.672 314 1HH2 ARG 38 1HH2 ARG 38 -14.294 -6.427 17.426 315 2HH2 ARG 38 2HH2 ARG 38 -14.018 -7.441 16.050 316 H THR 39 H THR 39 -8.159 -1.081 13.888 317 HA THR 39 HA THR 39 -9.660 -1.243 11.371 318 HB THR 39 HB THR 39 -7.473 0.310 12.037 319 HG1 THR 39 HG1 THR 39 -8.206 -0.508 9.435 320 1HG2 THR 39 1HG2 THR 39 -5.549 -0.378 11.022 321 2HG2 THR 39 2HG2 THR 39 -6.380 -1.514 9.960 322 3HG2 THR 39 3HG2 THR 39 -6.131 -1.913 11.655 323 H PHE 40 H PHE 40 -9.795 -3.106 10.317 324 HA PHE 40 HA PHE 40 -8.237 -5.379 11.302 325 1HB PHE 40 1HB PHE 40 -10.518 -5.919 11.345 326 2HB PHE 40 2HB PHE 40 -10.834 -5.118 9.811 327 HD1 PHE 40 HD1 PHE 40 -11.804 -6.788 8.516 328 HD2 PHE 40 HD2 PHE 40 -8.197 -7.593 10.623 329 HE1 PHE 40 HE1 PHE 40 -11.613 -8.950 7.352 330 HE2 PHE 40 HE2 PHE 40 -7.998 -9.749 9.465 331 HZ PHE 40 HZ PHE 40 -9.705 -10.436 7.829 332 H ILE 41 H ILE 41 -6.273 -4.845 10.192 333 HA ILE 41 HA ILE 41 -6.344 -4.708 7.305 334 HB ILE 41 HB ILE 41 -4.593 -3.748 9.222 335 1HG1 ILE 41 1HG1 ILE 41 -3.419 -3.820 6.560 336 2HG1 ILE 41 2HG1 ILE 41 -5.128 -3.405 6.520 337 1HG2 ILE 41 1HG2 ILE 41 -3.584 -6.100 9.183 338 2HG2 ILE 41 2HG2 ILE 41 -2.490 -4.736 9.003 339 3HG2 ILE 41 3HG2 ILE 41 -2.972 -5.671 7.588 340 1HD1 ILE 41 1HD1 ILE 41 -4.787 -1.391 7.463 341 2HD1 ILE 41 2HD1 ILE 41 -3.148 -1.623 6.859 342 3HD1 ILE 41 3HD1 ILE 41 -3.527 -1.989 8.541 343 H GLN 42 H GLN 42 -6.307 -6.397 6.004 344 HA GLN 42 HA GLN 42 -5.261 -8.952 7.038 345 1HB GLN 42 1HB GLN 42 -6.856 -9.907 5.195 346 2HB GLN 42 2HB GLN 42 -7.506 -9.432 6.756 347 1HG GLN 42 1HG GLN 42 -8.574 -7.591 5.908 348 2HG GLN 42 2HG GLN 42 -7.460 -7.436 4.550 349 1HE2 GLN 42 1HE2 GLN 42 -10.450 -8.615 5.606 350 2HE2 GLN 42 2HE2 GLN 42 -10.892 -9.480 4.176 351 H ASN 43 H ASN 43 -5.409 -6.722 4.358 352 HA ASN 43 HA ASN 43 -3.495 -8.381 2.876 353 1HB ASN 43 1HB ASN 43 -5.742 -6.746 2.069 354 2HB ASN 43 2HB ASN 43 -4.272 -6.233 1.246 355 1HD2 ASN 43 1HD2 ASN 43 -6.143 -9.122 2.053 356 2HD2 ASN 43 2HD2 ASN 43 -5.780 -9.978 0.598 357 H PHE 44 H PHE 44 -2.497 -7.129 5.059 358 HA PHE 44 HA PHE 44 -1.525 -4.587 4.930 359 1HB PHE 44 1HB PHE 44 0.315 -5.314 6.347 360 2HB PHE 44 2HB PHE 44 -1.174 -6.112 6.833 361 HD1 PHE 44 HD1 PHE 44 2.064 -6.702 6.869 362 HD2 PHE 44 HD2 PHE 44 -1.385 -8.370 5.013 363 HE1 PHE 44 HE1 PHE 44 3.195 -8.881 6.718 364 HE2 PHE 44 HE2 PHE 44 -0.262 -10.540 4.856 365 HZ PHE 44 HZ PHE 44 2.032 -10.805 5.708 366 H ARG 45 H ARG 45 -0.660 -7.224 2.874 367 HA ARG 45 HA ARG 45 1.855 -6.165 2.016 368 1HB ARG 45 1HB ARG 45 0.669 -8.600 1.820 369 2HB ARG 45 2HB ARG 45 0.395 -7.975 0.200 370 1HG ARG 45 1HG ARG 45 2.433 -8.671 -0.313 371 2HG ARG 45 2HG ARG 45 3.057 -7.388 0.728 372 1HD ARG 45 1HD ARG 45 2.217 -9.702 2.253 373 2HD ARG 45 2HD ARG 45 3.426 -10.124 1.044 374 HE ARG 45 HE ARG 45 3.777 -8.330 3.319 375 1HH1 ARG 45 1HH1 ARG 45 5.126 -9.807 0.452 376 2HH1 ARG 45 2HH1 ARG 45 6.763 -9.461 0.897 377 1HH2 ARG 45 1HH2 ARG 45 5.932 -7.874 3.895 378 2HH2 ARG 45 2HH2 ARG 45 7.219 -8.364 2.844 379 H GLU 46 H GLU 46 -1.276 -6.523 0.349 380 HA GLU 46 HA GLU 46 -0.545 -4.822 -1.805 381 1HB GLU 46 1HB GLU 46 -2.233 -6.508 -2.142 382 2HB GLU 46 2HB GLU 46 -3.227 -5.815 -0.872 383 1HG GLU 46 1HG GLU 46 -4.104 -4.266 -2.223 384 2HG GLU 46 2HG GLU 46 -2.562 -3.947 -3.018 385 H VAL 47 H VAL 47 -2.461 -4.370 1.135 386 HA VAL 47 HA VAL 47 -3.282 -1.733 0.609 387 HB VAL 47 HB VAL 47 -2.797 -2.991 3.315 388 1HG1 VAL 47 1HG1 VAL 47 -3.305 -0.370 2.782 389 2HG1 VAL 47 2HG1 VAL 47 -3.745 -1.196 4.276 390 3HG1 VAL 47 3HG1 VAL 47 -4.934 -1.011 2.989 391 1HG2 VAL 47 1HG2 VAL 47 -5.506 -3.013 2.866 392 2HG2 VAL 47 2HG2 VAL 47 -4.427 -4.399 2.711 393 3HG2 VAL 47 3HG2 VAL 47 -4.845 -3.444 1.289 394 H ALA 48 H ALA 48 -0.417 -3.033 2.242 395 HA ALA 48 HA ALA 48 0.597 -0.602 3.157 396 1HB ALA 48 1HB ALA 48 1.522 -2.580 4.051 397 2HB ALA 48 2HB ALA 48 2.817 -1.768 3.172 398 3HB ALA 48 3HB ALA 48 2.001 -3.158 2.454 399 H ASP 49 H ASP 49 1.249 -2.355 0.178 400 HA ASP 49 HA ASP 49 3.160 -0.631 -0.904 401 1HB ASP 49 1HB ASP 49 2.242 -2.918 -1.787 402 2HB ASP 49 2HB ASP 49 1.130 -1.907 -2.707 403 H ALA 50 H ALA 50 -0.248 -0.693 -1.966 404 HA ALA 50 HA ALA 50 -0.249 1.666 -3.349 405 1HB ALA 50 1HB ALA 50 -2.678 0.856 -1.804 406 2HB ALA 50 2HB ALA 50 -2.063 -0.148 -3.114 407 3HB ALA 50 3HB ALA 50 -2.552 1.515 -3.433 408 H LEU 51 H LEU 51 -0.999 1.287 0.111 409 HA LEU 51 HA LEU 51 -1.558 4.032 0.520 410 1HB LEU 51 1HB LEU 51 -2.525 2.688 2.125 411 2HB LEU 51 2HB LEU 51 -1.110 1.671 2.286 412 HG LEU 51 HG LEU 51 0.024 3.377 3.565 413 1HD1 LEU 51 1HD1 LEU 51 -0.605 5.529 3.753 414 2HD1 LEU 51 2HD1 LEU 51 -2.321 5.131 3.803 415 3HD1 LEU 51 3HD1 LEU 51 -1.470 5.171 2.262 416 1HD2 LEU 51 1HD2 LEU 51 -2.498 2.200 4.374 417 2HD2 LEU 51 2HD2 LEU 51 -2.122 3.668 5.277 418 3HD2 LEU 51 3HD2 LEU 51 -0.983 2.325 5.261 419 H ASN 52 H ASN 52 1.325 2.285 0.131 420 HA ASN 52 HA ASN 52 3.044 4.348 -0.062 421 1HB ASN 52 1HB ASN 52 2.307 4.074 2.695 422 2HB ASN 52 2HB ASN 52 4.008 3.669 2.517 423 1HD2 ASN 52 1HD2 ASN 52 5.371 5.299 2.621 424 2HD2 ASN 52 2HD2 ASN 52 5.007 6.955 2.291 425 H ARG 53 H ARG 53 4.305 3.208 -1.373 426 HA ARG 53 HA ARG 53 4.917 0.523 -1.258 427 1HB ARG 53 1HB ARG 53 6.799 1.012 -2.718 428 2HB ARG 53 2HB ARG 53 5.411 1.986 -3.182 429 1HG ARG 53 1HG ARG 53 6.567 3.854 -2.933 430 2HG ARG 53 2HG ARG 53 7.001 3.418 -1.278 431 1HD ARG 53 1HD ARG 53 9.036 3.691 -2.448 432 2HD ARG 53 2HD ARG 53 8.802 1.955 -2.263 433 HE ARG 53 HE ARG 53 8.517 3.491 -4.746 434 1HH1 ARG 53 1HH1 ARG 53 8.631 0.406 -3.106 435 2HH1 ARG 53 2HH1 ARG 53 8.800 -0.501 -4.569 436 1HH2 ARG 53 1HH2 ARG 53 8.735 2.291 -6.666 437 2HH2 ARG 53 2HH2 ARG 53 8.860 0.565 -6.586 438 H ASP 54 H ASP 54 6.135 3.121 0.664 439 HA ASP 54 HA ASP 54 8.364 1.561 1.696 440 1HB ASP 54 1HB ASP 54 8.597 4.010 1.221 441 2HB ASP 54 2HB ASP 54 7.441 4.321 2.513 442 HA PRO 55 HA PRO 55 5.726 0.066 5.002 443 1HB PRO 55 1HB PRO 55 7.614 -1.332 6.338 444 2HB PRO 55 2HB PRO 55 6.901 -1.905 4.825 445 1HG PRO 55 1HG PRO 55 9.521 -0.528 5.285 446 2HG PRO 55 2HG PRO 55 9.155 -1.919 4.247 447 1HD PRO 55 1HD PRO 55 9.413 0.611 3.292 448 2HD PRO 55 2HD PRO 55 8.347 -0.598 2.548 449 H GLN 56 H GLN 56 8.829 1.652 5.554 450 HA GLN 56 HA GLN 56 8.617 2.088 8.310 451 1HB GLN 56 1HB GLN 56 10.572 2.510 6.586 452 2HB GLN 56 2HB GLN 56 9.903 4.134 6.554 453 1HG GLN 56 1HG GLN 56 10.322 3.028 9.236 454 2HG GLN 56 2HG GLN 56 11.789 3.274 8.290 455 1HE2 GLN 56 1HE2 GLN 56 11.162 4.674 10.638 456 2HE2 GLN 56 2HE2 GLN 56 10.950 6.340 10.235 457 H HIS 57 H HIS 57 7.325 3.864 5.577 458 HA HIS 57 HA HIS 57 6.452 6.111 7.123 459 1HB HIS 57 1HB HIS 57 6.821 5.681 4.453 460 2HB HIS 57 2HB HIS 57 5.068 5.585 4.578 461 HD2 HIS 57 HD2 HIS 57 4.063 8.010 6.105 462 HE1 HIS 57 HE1 HIS 57 7.058 10.382 4.260 463 HE2 HIS 57 HE2 HIS 57 4.943 10.395 5.631 464 H LEU 58 H LEU 58 4.700 3.524 5.451 465 HA LEU 58 HA LEU 58 2.146 3.985 6.195 466 1HB LEU 58 1HB LEU 58 3.516 1.882 5.097 467 2HB LEU 58 2HB LEU 58 2.902 1.183 6.584 468 HG LEU 58 HG LEU 58 0.803 2.649 5.326 469 1HD1 LEU 58 1HD1 LEU 58 0.957 0.660 3.431 470 2HD1 LEU 58 2HD1 LEU 58 2.589 1.308 3.485 471 3HD1 LEU 58 3HD1 LEU 58 1.223 2.372 3.161 472 1HD2 LEU 58 1HD2 LEU 58 -0.146 0.264 5.240 473 2HD2 LEU 58 2HD2 LEU 58 0.250 0.942 6.818 474 3HD2 LEU 58 3HD2 LEU 58 1.345 -0.210 6.055 475 H LEU 59 H LEU 59 4.561 2.292 8.139 476 HA LEU 59 HA LEU 59 2.861 1.776 10.333 477 1HB LEU 59 1HB LEU 59 5.342 0.969 9.604 478 2HB LEU 59 2HB LEU 59 5.743 2.115 10.869 479 HG LEU 59 HG LEU 59 4.009 -0.339 11.138 480 1HD1 LEU 59 1HD1 LEU 59 5.742 -1.142 12.597 481 2HD1 LEU 59 2HD1 LEU 59 6.628 0.375 12.447 482 3HD1 LEU 59 3HD1 LEU 59 6.461 -0.691 11.052 483 1HD2 LEU 59 1HD2 LEU 59 3.734 0.249 13.458 484 2HD2 LEU 59 2HD2 LEU 59 3.156 1.578 12.453 485 3HD2 LEU 59 3HD2 LEU 59 4.724 1.692 13.247 486 H LYS 60 H LYS 60 5.247 4.328 9.708 487 HA LYS 60 HA LYS 60 5.059 5.690 12.124 488 1HB LYS 60 1HB LYS 60 6.197 6.136 9.546 489 2HB LYS 60 2HB LYS 60 5.355 7.599 10.031 490 1HG LYS 60 1HG LYS 60 7.078 6.350 12.073 491 2HG LYS 60 2HG LYS 60 7.897 7.059 10.681 492 1HD LYS 60 1HD LYS 60 5.917 8.471 12.468 493 2HD LYS 60 2HD LYS 60 7.669 8.667 12.517 494 1HE LYS 60 1HE LYS 60 6.207 9.136 9.955 495 2HE LYS 60 2HE LYS 60 6.178 10.373 11.209 496 1HZ LYS 60 1HZ LYS 60 8.563 10.473 11.161 497 2HZ LYS 60 2HZ LYS 60 7.980 10.680 9.587 498 3HZ LYS 60 3HZ LYS 60 8.649 9.198 10.052 499 H PHE 61 H PHE 61 3.034 5.896 9.236 500 HA PHE 61 HA PHE 61 1.473 8.095 10.186 501 1HB PHE 61 1HB PHE 61 1.668 6.529 7.781 502 2HB PHE 61 2HB PHE 61 -0.018 6.665 8.263 503 HD1 PHE 61 HD1 PHE 61 -0.202 9.303 9.411 504 HD2 PHE 61 HD2 PHE 61 1.999 7.976 6.019 505 HE1 PHE 61 HE1 PHE 61 -0.302 11.571 8.464 506 HE2 PHE 61 HE2 PHE 61 1.904 10.242 5.066 507 HZ PHE 61 HZ PHE 61 0.753 12.044 6.290 508 H LEU 62 H LEU 62 1.195 4.608 10.290 509 HA LEU 62 HA LEU 62 -1.445 4.329 11.123 510 1HB LEU 62 1HB LEU 62 -0.393 2.360 10.526 511 2HB LEU 62 2HB LEU 62 1.062 2.744 11.417 512 HG LEU 62 HG LEU 62 -0.458 2.392 13.519 513 1HD1 LEU 62 1HD1 LEU 62 -2.229 1.686 11.378 514 2HD1 LEU 62 2HD1 LEU 62 -2.538 1.744 13.111 515 3HD1 LEU 62 3HD1 LEU 62 -1.902 0.277 12.384 516 1HD2 LEU 62 1HD2 LEU 62 0.490 0.108 11.798 517 2HD2 LEU 62 2HD2 LEU 62 0.139 0.018 13.523 518 3HD2 LEU 62 3HD2 LEU 62 1.470 1.017 12.945 519 H LEU 63 H LEU 63 1.464 4.334 13.210 520 HA LEU 63 HA LEU 63 0.005 4.555 15.618 521 1HB LEU 63 1HB LEU 63 2.864 4.918 14.845 522 2HB LEU 63 2HB LEU 63 2.336 5.423 16.441 523 HG LEU 63 HG LEU 63 3.322 3.099 16.276 524 1HD1 LEU 63 1HD1 LEU 63 2.090 3.694 18.223 525 2HD1 LEU 63 2HD1 LEU 63 1.532 2.099 17.719 526 3HD1 LEU 63 3HD1 LEU 63 0.552 3.523 17.377 527 1HD2 LEU 63 1HD2 LEU 63 0.650 2.349 15.125 528 2HD2 LEU 63 2HD2 LEU 63 2.083 1.342 15.321 529 3HD2 LEU 63 3HD2 LEU 63 2.066 2.624 14.111 530 H ARG 64 H ARG 64 1.228 6.922 13.373 531 HA ARG 64 HA ARG 64 1.070 9.175 15.084 532 1HB ARG 64 1HB ARG 64 1.272 8.770 12.142 533 2HB ARG 64 2HB ARG 64 0.779 10.355 12.724 534 1HG ARG 64 1HG ARG 64 3.309 8.916 13.494 535 2HG ARG 64 2HG ARG 64 3.183 10.241 12.335 536 1HD ARG 64 1HD ARG 64 2.400 10.427 15.242 537 2HD ARG 64 2HD ARG 64 3.953 10.944 14.594 538 HE ARG 64 HE ARG 64 1.389 12.266 14.263 539 1HH1 ARG 64 1HH1 ARG 64 4.733 12.050 13.276 540 2HH1 ARG 64 2HH1 ARG 64 4.775 13.657 12.636 541 1HH2 ARG 64 1HH2 ARG 64 1.449 14.379 13.417 542 2HH2 ARG 64 2HH2 ARG 64 2.914 14.977 12.714 543 H GLU 65 H GLU 65 -1.316 7.400 13.328 544 HA GLU 65 HA GLU 65 -3.312 9.483 13.912 545 1HB GLU 65 1HB GLU 65 -2.843 7.985 11.576 546 2HB GLU 65 2HB GLU 65 -4.330 7.347 12.264 547 1HG GLU 65 1HG GLU 65 -5.450 9.351 12.049 548 2HG GLU 65 2HG GLU 65 -3.964 10.295 11.985 549 H LEU 66 H LEU 66 -2.162 6.495 14.950 550 HA LEU 66 HA LEU 66 -4.646 5.362 15.823 551 1HB LEU 66 1HB LEU 66 -1.836 4.614 15.815 552 2HB LEU 66 2HB LEU 66 -2.625 4.176 17.316 553 HG LEU 66 HG LEU 66 -4.237 2.829 16.151 554 1HD1 LEU 66 1HD1 LEU 66 -4.426 2.661 13.814 555 2HD1 LEU 66 2HD1 LEU 66 -2.902 3.500 13.548 556 3HD1 LEU 66 3HD1 LEU 66 -4.303 4.388 14.137 557 1HD2 LEU 66 1HD2 LEU 66 -2.788 1.121 15.220 558 2HD2 LEU 66 2HD2 LEU 66 -2.076 1.810 16.677 559 3HD2 LEU 66 3HD2 LEU 66 -1.472 2.286 15.092 560 H GLY 67 H GLY 67 -5.652 6.930 17.097 561 1HA GLY 67 1HA GLY 67 -4.320 8.086 19.366 562 2HA GLY 67 2HA GLY 67 -6.030 8.222 18.983 563 H THR 68 H THR 68 -5.709 5.060 18.806 564 HA THR 68 HA THR 68 -6.340 4.679 21.642 565 HB THR 68 HB THR 68 -7.892 3.149 21.079 566 HG1 THR 68 HG1 THR 68 -5.843 2.062 19.633 567 1HG2 THR 68 1HG2 THR 68 -8.342 3.149 18.419 568 2HG2 THR 68 2HG2 THR 68 -7.517 4.691 18.620 569 3HG2 THR 68 3HG2 THR 68 -8.973 4.348 19.546 570 H ALA 69 H ALA 69 -5.710 2.456 22.510 571 HA ALA 69 HA ALA 69 -3.172 2.159 23.087 572 1HB ALA 69 1HB ALA 69 -5.123 0.585 23.625 573 2HB ALA 69 2HB ALA 69 -3.492 -0.086 23.591 574 3HB ALA 69 3HB ALA 69 -4.577 -0.339 22.224 575 H GLY 70 H GLY 70 -4.347 0.275 20.267 576 1HA GLY 70 1HA GLY 70 -3.310 0.101 18.167 577 2HA GLY 70 2HA GLY 70 -1.932 0.988 18.799 578 H ASN 71 H ASN 71 -3.310 -2.104 18.203 579 HA ASN 71 HA ASN 71 -0.793 -3.411 18.489 580 1HB ASN 71 1HB ASN 71 -2.579 -3.408 20.756 581 2HB ASN 71 2HB ASN 71 -2.386 -5.044 20.145 582 1HD2 ASN 71 1HD2 ASN 71 0.376 -3.286 19.408 583 2HD2 ASN 71 2HD2 ASN 71 1.340 -3.764 20.752 584 H LEU 72 H LEU 72 -0.974 -5.772 17.987 585 HA LEU 72 HA LEU 72 -2.864 -6.115 15.824 586 1HB LEU 72 1HB LEU 72 -0.858 -8.124 16.822 587 2HB LEU 72 2HB LEU 72 -1.600 -8.044 15.235 588 HG LEU 72 HG LEU 72 -0.331 -5.606 15.424 589 1HD1 LEU 72 1HD1 LEU 72 1.630 -5.728 16.538 590 2HD1 LEU 72 2HD1 LEU 72 1.817 -7.458 16.249 591 3HD1 LEU 72 3HD1 LEU 72 0.735 -6.888 17.520 592 1HD2 LEU 72 1HD2 LEU 72 1.254 -7.825 14.300 593 2HD2 LEU 72 2HD2 LEU 72 0.725 -6.313 13.560 594 3HD2 LEU 72 3HD2 LEU 72 -0.396 -7.668 13.699 595 H GLU 73 H GLU 73 -4.878 -6.728 16.320 596 HA GLU 73 HA GLU 73 -5.257 -8.713 18.453 597 1HB GLU 73 1HB GLU 73 -6.949 -6.507 17.384 598 2HB GLU 73 2HB GLU 73 -7.764 -7.945 17.978 599 1HG GLU 73 1HG GLU 73 -5.708 -6.547 19.641 600 2HG GLU 73 2HG GLU 73 -7.377 -5.982 19.587 601 H GLY 74 H GLY 74 -6.627 -10.522 18.091 602 1HA GLY 74 1HA GLY 74 -7.614 -12.204 16.862 603 2HA GLY 74 2HA GLY 74 -7.777 -11.063 15.536 604 H GLY 75 H GLY 75 -7.272 -13.417 14.637 605 1HA GLY 75 1HA GLY 75 -4.545 -14.235 14.633 606 2HA GLY 75 2HA GLY 75 -5.795 -14.797 13.535 607 H ARG 76 H ARG 76 -6.025 -11.632 13.143 608 HA ARG 76 HA ARG 76 -4.037 -11.570 10.977 609 1HB ARG 76 1HB ARG 76 -6.350 -9.684 11.010 610 2HB ARG 76 2HB ARG 76 -5.546 -10.448 9.645 611 1HG ARG 76 1HG ARG 76 -6.774 -12.508 11.142 612 2HG ARG 76 2HG ARG 76 -7.952 -11.209 10.966 613 1HD ARG 76 1HD ARG 76 -8.221 -11.609 8.783 614 2HD ARG 76 2HD ARG 76 -6.488 -11.773 8.513 615 HE ARG 76 HE ARG 76 -8.183 -13.947 9.566 616 1HH1 ARG 76 1HH1 ARG 76 -5.596 -12.820 7.498 617 2HH1 ARG 76 2HH1 ARG 76 -5.183 -14.409 6.953 618 1HH2 ARG 76 1HH2 ARG 76 -7.626 -16.027 8.849 619 2HH2 ARG 76 2HH2 ARG 76 -6.330 -16.224 7.716 620 H ALA 77 H ALA 77 -4.423 -8.690 10.553 621 HA ALA 77 HA ALA 77 -2.944 -7.771 12.932 622 1HB ALA 77 1HB ALA 77 -2.525 -5.877 10.951 623 2HB ALA 77 2HB ALA 77 -2.481 -7.420 10.097 624 3HB ALA 77 3HB ALA 77 -1.403 -7.137 11.463 625 H ILE 78 H ILE 78 -5.253 -7.636 13.759 626 HA ILE 78 HA ILE 78 -6.713 -5.298 12.845 627 HB ILE 78 HB ILE 78 -7.342 -7.276 15.035 628 1HG1 ILE 78 1HG1 ILE 78 -8.839 -6.889 12.456 629 2HG1 ILE 78 2HG1 ILE 78 -7.432 -7.947 12.533 630 1HG2 ILE 78 1HG2 ILE 78 -8.681 -5.667 15.823 631 2HG2 ILE 78 2HG2 ILE 78 -9.676 -5.987 14.403 632 3HG2 ILE 78 3HG2 ILE 78 -8.496 -4.680 14.373 633 1HD1 ILE 78 1HD1 ILE 78 -9.197 -8.553 14.691 634 2HD1 ILE 78 2HD1 ILE 78 -8.676 -9.578 13.354 635 3HD1 ILE 78 3HD1 ILE 78 -10.095 -8.547 13.174 636 H LEU 79 H LEU 79 -5.424 -3.584 13.421 637 HA LEU 79 HA LEU 79 -4.518 -3.273 16.146 638 1HB LEU 79 1HB LEU 79 -3.578 -1.163 15.328 639 2HB LEU 79 2HB LEU 79 -3.115 -2.524 14.315 640 HG LEU 79 HG LEU 79 -5.444 -1.623 13.152 641 1HD1 LEU 79 1HD1 LEU 79 -3.785 0.800 13.678 642 2HD1 LEU 79 2HD1 LEU 79 -5.169 0.384 14.677 643 3HD1 LEU 79 3HD1 LEU 79 -5.384 0.700 12.955 644 1HD2 LEU 79 1HD2 LEU 79 -3.573 -0.468 11.608 645 2HD2 LEU 79 2HD2 LEU 79 -3.905 -2.200 11.611 646 3HD2 LEU 79 3HD2 LEU 79 -2.563 -1.558 12.557 647 H GLN 80 H GLN 80 -4.836 -0.661 16.711 648 HA GLN 80 HA GLN 80 -7.663 0.002 16.440 649 1HB GLN 80 1HB GLN 80 -7.096 -1.453 18.545 650 2HB GLN 80 2HB GLN 80 -6.468 0.057 19.184 651 1HG GLN 80 1HG GLN 80 -8.506 0.706 19.739 652 2HG GLN 80 2HG GLN 80 -9.037 0.535 18.070 653 1HE2 GLN 80 1HE2 GLN 80 -11.071 -0.032 19.189 654 2HE2 GLN 80 2HE2 GLN 80 -11.317 -1.684 19.633 655 H GLY 81 H GLY 81 -7.745 2.091 15.834 656 1HA GLY 81 1HA GLY 81 -6.387 4.126 17.304 657 2HA GLY 81 2HA GLY 81 -5.609 3.830 15.769 658 H LYS 82 H LYS 82 -6.205 5.083 14.168 659 HA LYS 82 HA LYS 82 -8.989 5.943 13.949 660 1HB LYS 82 1HB LYS 82 -7.177 7.636 15.071 661 2HB LYS 82 2HB LYS 82 -7.031 8.072 13.377 662 1HG LYS 82 1HG LYS 82 -8.955 9.181 13.403 663 2HG LYS 82 2HG LYS 82 -9.801 7.849 14.194 664 1HD LYS 82 1HD LYS 82 -8.076 9.910 15.568 665 2HD LYS 82 2HD LYS 82 -9.840 9.885 15.558 666 1HE LYS 82 1HE LYS 82 -8.300 7.514 16.535 667 2HE LYS 82 2HE LYS 82 -8.553 8.902 17.588 668 1HZ LYS 82 1HZ LYS 82 -10.526 8.054 18.067 669 2HZ LYS 82 2HZ LYS 82 -10.353 6.828 16.916 670 3HZ LYS 82 3HZ LYS 82 -11.013 8.320 16.470 671 H PHE 83 H PHE 83 -6.942 4.190 12.506 672 HA PHE 83 HA PHE 83 -6.572 5.487 9.964 673 1HB PHE 83 1HB PHE 83 -5.699 3.033 11.256 674 2HB PHE 83 2HB PHE 83 -6.185 2.750 9.587 675 HD1 PHE 83 HD1 PHE 83 -4.703 5.887 10.867 676 HD2 PHE 83 HD2 PHE 83 -4.053 2.302 8.673 677 HE1 PHE 83 HE1 PHE 83 -2.537 6.758 10.086 678 HE2 PHE 83 HE2 PHE 83 -1.889 3.166 7.886 679 HZ PHE 83 HZ PHE 83 -1.130 5.393 8.596 680 H THR 84 H THR 84 -9.171 5.710 10.566 681 HA THR 84 HA THR 84 -10.813 3.633 9.494 682 HB THR 84 HB THR 84 -11.613 6.519 9.819 683 HG1 THR 84 HG1 THR 84 -11.152 6.371 11.841 684 1HG2 THR 84 1HG2 THR 84 -13.058 4.160 9.279 685 2HG2 THR 84 2HG2 THR 84 -13.677 5.783 9.564 686 3HG2 THR 84 3HG2 THR 84 -13.465 4.672 10.916 687 H HIS 85 H HIS 85 -9.576 3.422 7.469 688 HA HIS 85 HA HIS 85 -9.098 3.864 5.273 689 1HB HIS 85 1HB HIS 85 -11.062 4.263 3.903 690 2HB HIS 85 2HB HIS 85 -11.476 3.146 5.199 691 HD2 HIS 85 HD2 HIS 85 -13.359 4.110 7.036 692 HE1 HIS 85 HE1 HIS 85 -14.090 7.769 5.022 693 HE2 HIS 85 HE2 HIS 85 -14.774 6.268 6.925 694 H PHE 86 H PHE 86 -8.319 5.965 7.016 695 HA PHE 86 HA PHE 86 -8.997 8.415 5.593 696 1HB PHE 86 1HB PHE 86 -8.303 7.833 8.272 697 2HB PHE 86 2HB PHE 86 -7.014 8.840 7.620 698 HD1 PHE 86 HD1 PHE 86 -10.497 8.706 8.637 699 HD2 PHE 86 HD2 PHE 86 -7.504 11.088 6.771 700 HE1 PHE 86 HE1 PHE 86 -11.920 10.697 8.901 701 HE2 PHE 86 HE2 PHE 86 -8.919 13.082 7.034 702 HZ PHE 86 HZ PHE 86 -11.133 12.887 8.097 703 H LEU 87 H LEU 87 -5.873 7.373 6.913 704 HA LEU 87 HA LEU 87 -4.452 8.584 4.757 705 1HB LEU 87 1HB LEU 87 -3.837 7.431 7.318 706 2HB LEU 87 2HB LEU 87 -2.752 6.775 6.109 707 HG LEU 87 HG LEU 87 -1.597 8.603 6.964 708 1HD1 LEU 87 1HD1 LEU 87 -1.606 10.338 5.192 709 2HD1 LEU 87 2HD1 LEU 87 -3.024 9.562 4.493 710 3HD1 LEU 87 3HD1 LEU 87 -1.496 8.689 4.578 711 1HD2 LEU 87 1HD2 LEU 87 -3.302 10.845 6.691 712 2HD2 LEU 87 2HD2 LEU 87 -2.616 10.155 8.161 713 3HD2 LEU 87 3HD2 LEU 87 -4.184 9.600 7.578 714 H ILE 88 H ILE 88 -5.179 5.217 5.682 715 HA ILE 88 HA ILE 88 -3.696 3.957 3.666 716 HB ILE 88 HB ILE 88 -6.323 2.948 4.760 717 1HG1 ILE 88 1HG1 ILE 88 -3.532 2.706 5.921 718 2HG1 ILE 88 2HG1 ILE 88 -4.949 3.402 6.685 719 1HG2 ILE 88 1HG2 ILE 88 -4.023 1.668 3.327 720 2HG2 ILE 88 2HG2 ILE 88 -5.739 1.632 2.928 721 3HG2 ILE 88 3HG2 ILE 88 -5.138 0.721 4.310 722 1HD1 ILE 88 1HD1 ILE 88 -5.864 1.347 7.168 723 2HD1 ILE 88 2HD1 ILE 88 -4.141 1.014 7.337 724 3HD1 ILE 88 3HD1 ILE 88 -4.991 0.531 5.872 725 H ASN 89 H ASN 89 -7.220 4.492 3.701 726 HA ASN 89 HA ASN 89 -7.668 3.766 1.060 727 1HB ASN 89 1HB ASN 89 -9.274 4.364 3.107 728 2HB ASN 89 2HB ASN 89 -9.419 5.868 2.204 729 1HD2 ASN 89 1HD2 ASN 89 -10.754 2.914 2.635 730 2HD2 ASN 89 2HD2 ASN 89 -11.554 2.729 1.116 731 H GLU 90 H GLU 90 -7.300 7.083 2.344 732 HA GLU 90 HA GLU 90 -7.617 8.429 -0.072 733 1HB GLU 90 1HB GLU 90 -6.142 9.105 2.450 734 2HB GLU 90 2HB GLU 90 -6.057 10.172 1.061 735 1HG GLU 90 1HG GLU 90 -8.699 9.884 1.191 736 2HG GLU 90 2HG GLU 90 -8.305 9.618 2.889 737 H ARG 91 H ARG 91 -4.571 7.542 1.518 738 HA ARG 91 HA ARG 91 -2.888 8.382 -0.533 739 1HB ARG 91 1HB ARG 91 -2.187 7.865 1.781 740 2HB ARG 91 2HB ARG 91 -2.433 6.159 1.447 741 1HG ARG 91 1HG ARG 91 -0.195 6.305 1.126 742 2HG ARG 91 2HG ARG 91 -0.741 6.649 -0.512 743 1HD ARG 91 1HD ARG 91 -0.130 8.760 1.551 744 2HD ARG 91 2HD ARG 91 1.035 8.189 0.358 745 HE ARG 91 HE ARG 91 -1.401 9.061 -0.838 746 1HH1 ARG 91 1HH1 ARG 91 1.659 10.137 0.438 747 2HH1 ARG 91 2HH1 ARG 91 1.646 11.624 -0.449 748 1HH2 ARG 91 1HH2 ARG 91 -1.433 11.012 -1.995 749 2HH2 ARG 91 2HH2 ARG 91 -0.115 12.123 -1.832 750 H ILE 92 H ILE 92 -4.219 5.153 0.129 751 HA ILE 92 HA ILE 92 -3.012 3.764 -1.952 752 HB ILE 92 HB ILE 92 -5.666 3.391 -0.573 753 1HG1 ILE 92 1HG1 ILE 92 -3.002 1.984 -0.501 754 2HG1 ILE 92 2HG1 ILE 92 -3.753 2.907 0.785 755 1HG2 ILE 92 1HG2 ILE 92 -5.927 1.242 -1.658 756 2HG2 ILE 92 2HG2 ILE 92 -4.463 1.512 -2.599 757 3HG2 ILE 92 3HG2 ILE 92 -5.884 2.521 -2.872 758 1HD1 ILE 92 1HD1 ILE 92 -5.638 1.061 0.458 759 2HD1 ILE 92 2HD1 ILE 92 -4.250 0.838 1.524 760 3HD1 ILE 92 3HD1 ILE 92 -4.240 0.137 -0.094 761 H GLU 93 H GLU 93 -6.238 5.278 -1.930 762 HA GLU 93 HA GLU 93 -6.920 4.836 -4.577 763 1HB GLU 93 1HB GLU 93 -8.266 5.870 -2.592 764 2HB GLU 93 2HB GLU 93 -7.675 7.400 -3.224 765 1HG GLU 93 1HG GLU 93 -8.616 6.444 -5.489 766 2HG GLU 93 2HG GLU 93 -9.608 5.477 -4.399 767 H ASP 94 H ASP 94 -4.667 7.128 -3.255 768 HA ASP 94 HA ASP 94 -4.613 8.862 -5.529 769 1HB ASP 94 1HB ASP 94 -3.123 8.607 -2.990 770 2HB ASP 94 2HB ASP 94 -2.236 9.340 -4.323 771 H TYR 95 H TYR 95 -2.744 6.053 -4.503 772 HA TYR 95 HA TYR 95 -0.926 6.287 -6.749 773 1HB TYR 95 1HB TYR 95 -1.187 4.244 -4.536 774 2HB TYR 95 2HB TYR 95 -0.014 4.106 -5.843 775 HD1 TYR 95 HD1 TYR 95 1.961 5.471 -5.884 776 HD2 TYR 95 HD2 TYR 95 -0.977 6.037 -2.872 777 HE1 TYR 95 HE1 TYR 95 3.539 6.869 -4.618 778 HE2 TYR 95 HE2 TYR 95 0.585 7.440 -1.599 779 HH TYR 95 HH TYR 95 2.812 8.950 -2.442 780 H VAL 96 H VAL 96 -3.245 3.860 -5.574 781 HA VAL 96 HA VAL 96 -3.210 2.167 -7.772 782 HB VAL 96 HB VAL 96 -5.570 2.814 -5.997 783 1HG1 VAL 96 1HG1 VAL 96 -5.020 0.377 -7.680 784 2HG1 VAL 96 2HG1 VAL 96 -6.233 1.609 -8.017 785 3HG1 VAL 96 3HG1 VAL 96 -6.383 0.587 -6.587 786 1HG2 VAL 96 1HG2 VAL 96 -4.436 0.377 -5.249 787 2HG2 VAL 96 2HG2 VAL 96 -4.377 1.902 -4.369 788 3HG2 VAL 96 3HG2 VAL 96 -3.074 1.475 -5.474 789 H ASN 97 H ASN 97 -5.222 5.020 -7.157 790 HA ASN 97 HA ASN 97 -6.129 4.901 -9.948 791 1HB ASN 97 1HB ASN 97 -7.422 5.901 -7.436 792 2HB ASN 97 2HB ASN 97 -7.897 6.581 -8.989 793 1HD2 ASN 97 1HD2 ASN 97 -8.910 5.261 -10.508 794 2HD2 ASN 97 2HD2 ASN 97 -9.643 3.759 -10.069 795 H LYS 98 H LYS 98 -3.645 5.877 -9.737 796 HA LYS 98 HA LYS 98 -3.642 8.726 -9.307 797 1HB LYS 98 1HB LYS 98 -1.331 8.659 -9.781 798 2HB LYS 98 2HB LYS 98 -1.666 7.148 -8.949 799 1HG LYS 98 1HG LYS 98 -1.889 6.953 -11.857 800 2HG LYS 98 2HG LYS 98 -0.282 7.408 -11.291 801 1HD LYS 98 1HD LYS 98 -0.253 5.463 -9.811 802 2HD LYS 98 2HD LYS 98 -1.869 5.018 -10.360 803 1HE LYS 98 1HE LYS 98 -0.714 5.117 -12.728 804 2HE LYS 98 2HE LYS 98 0.739 4.824 -11.773 805 1HZ LYS 98 1HZ LYS 98 -1.180 3.053 -10.849 806 2HZ LYS 98 2HZ LYS 98 0.195 2.690 -11.765 807 3HZ LYS 98 3HZ LYS 98 -1.278 2.997 -12.538 808 H PHE 99 H PHE 99 -4.566 6.717 -11.850 809 HA PHE 99 HA PHE 99 -3.793 8.376 -14.035 810 1HB PHE 99 1HB PHE 99 -5.763 6.996 -15.157 811 2HB PHE 99 2HB PHE 99 -4.192 6.271 -14.837 812 HD1 PHE 99 HD1 PHE 99 -3.917 4.617 -13.110 813 HD2 PHE 99 HD2 PHE 99 -7.712 6.391 -13.854 814 HE1 PHE 99 HE1 PHE 99 -4.996 2.848 -11.784 815 HE2 PHE 99 HE2 PHE 99 -8.800 4.626 -12.527 816 HZ PHE 99 HZ PHE 99 -7.442 2.852 -11.489 817 H VAL 100 H VAL 100 -6.866 7.896 -12.294 818 HA VAL 100 HA VAL 100 -8.089 10.077 -13.759 819 HB VAL 100 HB VAL 100 -9.411 8.081 -13.161 820 1HG1 VAL 100 1HG1 VAL 100 -9.281 7.206 -11.128 821 2HG1 VAL 100 2HG1 VAL 100 -10.083 8.634 -10.475 822 3HG1 VAL 100 3HG1 VAL 100 -8.323 8.576 -10.568 823 1HG2 VAL 100 1HG2 VAL 100 -11.129 9.730 -11.730 824 2HG2 VAL 100 2HG2 VAL 100 -11.050 9.553 -13.483 825 3HG2 VAL 100 3HG2 VAL 100 -10.145 10.840 -12.686 826 H ILE 101 H ILE 101 -6.595 9.552 -10.656 827 HA ILE 101 HA ILE 101 -7.615 11.990 -9.505 828 HB ILE 101 HB ILE 101 -5.413 10.164 -8.526 829 1HG1 ILE 101 1HG1 ILE 101 -7.400 8.893 -8.461 830 2HG1 ILE 101 2HG1 ILE 101 -7.250 9.543 -6.836 831 1HG2 ILE 101 1HG2 ILE 101 -6.746 11.724 -6.498 832 2HG2 ILE 101 2HG2 ILE 101 -6.004 12.762 -7.713 833 3HG2 ILE 101 3HG2 ILE 101 -5.026 11.574 -6.854 834 1HD1 ILE 101 1HD1 ILE 101 -9.511 9.751 -7.441 835 2HD1 ILE 101 2HD1 ILE 101 -9.105 10.416 -9.023 836 3HD1 ILE 101 3HD1 ILE 101 -8.826 11.371 -7.567 837 H CYS 102 H CYS 102 -4.366 10.863 -10.482 838 HA CYS 102 HA CYS 102 -3.388 13.601 -10.406 839 1HB CYS 102 1HB CYS 102 -2.086 11.573 -9.559 840 2HB CYS 102 2HB CYS 102 -1.820 11.173 -11.252 841 H HIS 103 H HIS 103 -4.970 11.741 -12.654 842 HA HIS 103 HA HIS 103 -5.343 11.959 -14.886 843 1HB HIS 103 1HB HIS 103 -3.691 14.469 -14.909 844 2HB HIS 103 2HB HIS 103 -5.099 14.065 -15.885 845 HD2 HIS 103 HD2 HIS 103 -4.243 15.572 -12.409 846 HE1 HIS 103 HE1 HIS 103 -8.457 15.682 -12.897 847 HE2 HIS 103 HE2 HIS 103 -6.513 16.335 -11.432 848 H GLU 104 H GLU 104 -3.402 10.227 -14.284 849 HA GLU 104 HA GLU 104 -1.457 9.215 -14.933 850 1HB GLU 104 1HB GLU 104 -1.246 9.134 -17.465 851 2HB GLU 104 2HB GLU 104 -2.762 8.569 -16.777 852 1HG GLU 104 1HG GLU 104 -3.874 10.587 -17.395 853 2HG GLU 104 2HG GLU 104 -2.355 11.332 -17.891 854 H CYS 105 H CYS 105 -0.140 10.811 -13.794 855 HA CYS 105 HA CYS 105 1.018 13.028 -15.107 856 1HB CYS 105 1HB CYS 105 0.958 12.140 -12.535 857 2HB CYS 105 2HB CYS 105 2.612 11.737 -12.980 858 H ASN 106 H ASN 106 1.394 11.660 -17.153 859 HA ASN 106 HA ASN 106 3.636 9.899 -17.173 860 1HB ASN 106 1HB ASN 106 1.729 10.977 -19.140 861 2HB ASN 106 2HB ASN 106 3.333 10.654 -19.787 862 1HD2 ASN 106 1HD2 ASN 106 2.227 9.066 -21.075 863 2HD2 ASN 106 2HD2 ASN 106 1.923 7.501 -20.411 864 H ARG 107 H ARG 107 3.820 12.270 -19.678 865 HA ARG 107 HA ARG 107 6.300 13.296 -18.490 866 1HB ARG 107 1HB ARG 107 5.419 13.022 -21.360 867 2HB ARG 107 2HB ARG 107 6.843 13.933 -20.879 868 1HG ARG 107 1HG ARG 107 6.672 11.170 -19.865 869 2HG ARG 107 2HG ARG 107 6.899 11.356 -21.605 870 1HD ARG 107 1HD ARG 107 8.686 13.160 -20.637 871 2HD ARG 107 2HD ARG 107 8.737 11.921 -19.385 872 HE ARG 107 HE ARG 107 8.924 10.789 -21.989 873 1HH1 ARG 107 1HH1 ARG 107 10.768 12.465 -19.545 874 2HH1 ARG 107 2HH1 ARG 107 12.282 11.798 -20.053 875 1HH2 ARG 107 1HH2 ARG 107 10.915 9.912 -22.659 876 2HH2 ARG 107 2HH2 ARG 107 12.367 10.349 -21.820 877 HA PRO 108 HA PRO 108 3.062 16.801 -18.524 878 1HB PRO 108 1HB PRO 108 4.663 17.419 -16.095 879 2HB PRO 108 2HB PRO 108 2.919 17.528 -16.353 880 1HG PRO 108 1HG PRO 108 3.982 15.535 -14.925 881 2HG PRO 108 2HG PRO 108 2.586 15.272 -15.985 882 1HD PRO 108 1HD PRO 108 5.434 14.496 -16.376 883 2HD PRO 108 2HD PRO 108 3.949 13.691 -16.913 884 H ASP 109 H ASP 109 3.472 18.797 -19.350 885 HA ASP 109 HA ASP 109 6.178 19.402 -20.170 886 1HB ASP 109 1HB ASP 109 3.548 20.824 -20.605 887 2HB ASP 109 2HB ASP 109 5.080 21.385 -21.263 888 H THR 110 H THR 110 5.250 19.542 -17.295 889 HA THR 110 HA THR 110 6.053 22.308 -16.729 890 HB THR 110 HB THR 110 4.895 21.524 -14.414 891 HG1 THR 110 HG1 THR 110 4.332 19.510 -15.621 892 1HG2 THR 110 1HG2 THR 110 4.277 23.549 -15.579 893 2HG2 THR 110 2HG2 THR 110 2.835 22.635 -15.143 894 3HG2 THR 110 3HG2 THR 110 3.427 22.610 -16.804 895 H ARG 111 H ARG 111 6.929 22.364 -14.322 896 HA ARG 111 HA ARG 111 9.226 20.589 -14.341 897 1HB ARG 111 1HB ARG 111 9.221 23.135 -13.889 898 2HB ARG 111 2HB ARG 111 8.648 22.706 -12.283 899 1HG ARG 111 1HG ARG 111 10.717 21.126 -12.276 900 2HG ARG 111 2HG ARG 111 11.296 22.207 -13.546 901 1HD ARG 111 1HD ARG 111 10.669 22.820 -10.685 902 2HD ARG 111 2HD ARG 111 12.148 23.138 -11.585 903 HE ARG 111 HE ARG 111 10.770 24.821 -12.845 904 1HH1 ARG 111 1HH1 ARG 111 9.979 23.922 -9.556 905 2HH1 ARG 111 2HH1 ARG 111 9.190 25.422 -9.210 906 1HH2 ARG 111 1HH2 ARG 111 9.733 26.791 -12.378 907 2HH2 ARG 111 2HH2 ARG 111 9.051 27.049 -10.807 908 H ILE 112 H ILE 112 8.637 18.614 -13.646 909 HA ILE 112 HA ILE 112 7.089 18.302 -11.191 910 HB ILE 112 HB ILE 112 8.182 16.149 -13.004 911 1HG1 ILE 112 1HG1 ILE 112 6.671 17.463 -14.324 912 2HG1 ILE 112 2HG1 ILE 112 5.814 16.004 -13.839 913 1HG2 ILE 112 1HG2 ILE 112 6.172 16.120 -10.767 914 2HG2 ILE 112 2HG2 ILE 112 7.700 15.245 -10.870 915 3HG2 ILE 112 3HG2 ILE 112 6.358 14.801 -11.923 916 1HD1 ILE 112 1HD1 ILE 112 5.543 18.518 -12.250 917 2HD1 ILE 112 2HD1 ILE 112 4.443 17.146 -12.370 918 3HD1 ILE 112 3HD1 ILE 112 4.604 18.269 -13.720 919 H ILE 113 H ILE 113 7.845 17.258 -9.356 920 HA ILE 113 HA ILE 113 10.623 16.394 -9.244 921 HB ILE 113 HB ILE 113 9.668 18.495 -7.306 922 1HG1 ILE 113 1HG1 ILE 113 11.405 18.864 -9.758 923 2HG1 ILE 113 2HG1 ILE 113 9.767 19.475 -9.558 924 1HG2 ILE 113 1HG2 ILE 113 11.551 16.818 -6.777 925 2HG2 ILE 113 2HG2 ILE 113 11.840 18.533 -6.482 926 3HG2 ILE 113 3HG2 ILE 113 12.505 17.763 -7.922 927 1HD1 ILE 113 1HD1 ILE 113 10.979 20.543 -7.389 928 2HD1 ILE 113 2HD1 ILE 113 10.807 21.356 -8.945 929 3HD1 ILE 113 3HD1 ILE 113 12.309 20.521 -8.548 930 H ARG 114 H ARG 114 10.854 14.703 -7.897 931 HA ARG 114 HA ARG 114 8.784 14.252 -5.851 932 1HB ARG 114 1HB ARG 114 9.022 12.751 -8.148 933 2HB ARG 114 2HB ARG 114 9.942 11.807 -6.986 934 1HG ARG 114 1HG ARG 114 7.921 11.982 -5.463 935 2HG ARG 114 2HG ARG 114 7.053 12.591 -6.869 936 1HD ARG 114 1HD ARG 114 8.411 9.923 -6.610 937 2HD ARG 114 2HD ARG 114 6.677 10.226 -6.651 938 HE ARG 114 HE ARG 114 8.316 11.002 -8.949 939 1HH1 ARG 114 1HH1 ARG 114 5.845 8.941 -7.582 940 2HH1 ARG 114 2HH1 ARG 114 5.328 8.341 -9.119 941 1HH2 ARG 114 1HH2 ARG 114 7.626 10.213 -10.963 942 2HH2 ARG 114 2HH2 ARG 114 6.335 9.060 -11.034 943 H GLU 115 H GLU 115 9.630 14.134 -3.889 944 HA GLU 115 HA GLU 115 12.339 13.021 -3.581 945 1HB GLU 115 1HB GLU 115 12.445 15.459 -3.376 946 2HB GLU 115 2HB GLU 115 11.198 15.420 -2.136 947 1HG GLU 115 1HG GLU 115 12.614 14.598 -0.537 948 2HG GLU 115 2HG GLU 115 13.683 13.840 -1.716 949 H GLY 116 H GLY 116 12.676 11.675 -1.866 950 1HA GLY 116 1HA GLY 116 12.124 10.890 0.348 951 2HA GLY 116 2HA GLY 116 10.450 11.311 0.030 952 H ARG 117 H ARG 117 12.385 9.643 -2.355 953 HA ARG 117 HA ARG 117 12.212 7.570 -3.283 954 1HB ARG 117 1HB ARG 117 11.989 7.150 -0.394 955 2HB ARG 117 2HB ARG 117 11.234 5.872 -1.335 956 1HG ARG 117 1HG ARG 117 13.561 5.365 -0.782 957 2HG ARG 117 2HG ARG 117 13.302 5.476 -2.523 958 1HD ARG 117 1HD ARG 117 14.841 7.066 -2.690 959 2HD ARG 117 2HD ARG 117 13.998 8.056 -1.503 960 HE ARG 117 HE ARG 117 16.165 6.155 -0.961 961 1HH1 ARG 117 1HH1 ARG 117 14.000 8.657 0.175 962 2HH1 ARG 117 2HH1 ARG 117 14.879 8.917 1.641 963 1HH2 ARG 117 1HH2 ARG 117 17.310 6.503 0.973 964 2HH2 ARG 117 2HH2 ARG 117 16.752 7.697 2.096 965 H ILE 118 H ILE 118 10.140 9.168 -3.895 966 HA ILE 118 HA ILE 118 8.089 9.068 -4.880 967 HB ILE 118 HB ILE 118 7.828 6.204 -3.985 968 1HG1 ILE 118 1HG1 ILE 118 9.969 6.331 -5.088 969 2HG1 ILE 118 2HG1 ILE 118 8.819 5.609 -6.210 970 1HG2 ILE 118 1HG2 ILE 118 5.801 7.073 -4.869 971 2HG2 ILE 118 2HG2 ILE 118 6.521 6.070 -6.128 972 3HG2 ILE 118 3HG2 ILE 118 6.641 7.825 -6.222 973 1HD1 ILE 118 1HD1 ILE 118 9.612 8.507 -6.238 974 2HD1 ILE 118 2HD1 ILE 118 8.643 7.652 -7.438 975 3HD1 ILE 118 3HD1 ILE 118 10.351 7.260 -7.239 976 H SER 119 H SER 119 8.233 10.154 -2.378 977 HA SER 119 HA SER 119 5.705 9.253 -1.167 978 1HB SER 119 1HB SER 119 8.155 9.136 0.072 979 2HB SER 119 2HB SER 119 7.513 10.664 0.660 980 HG SER 119 HG SER 119 5.726 8.556 0.671 981 H LEU 120 H LEU 120 7.751 11.978 -2.050 982 HA LEU 120 HA LEU 120 5.409 13.742 -1.737 983 1HB LEU 120 1HB LEU 120 8.288 14.467 -1.170 984 2HB LEU 120 2HB LEU 120 6.964 15.607 -1.234 985 HG LEU 120 HG LEU 120 7.349 15.267 1.041 986 1HD1 LEU 120 1HD1 LEU 120 5.041 13.602 0.101 987 2HD1 LEU 120 2HD1 LEU 120 5.033 15.233 0.768 988 3HD1 LEU 120 3HD1 LEU 120 5.375 13.855 1.813 989 1HD2 LEU 120 1HD2 LEU 120 8.814 13.346 0.863 990 2HD2 LEU 120 2HD2 LEU 120 7.437 12.314 0.494 991 3HD2 LEU 120 3HD2 LEU 120 7.570 13.064 2.081 992 H LEU 121 H LEU 121 5.266 15.476 -3.262 993 HA LEU 121 HA LEU 121 7.138 15.989 -5.265 994 1HB LEU 121 1HB LEU 121 6.763 14.544 -6.925 995 2HB LEU 121 2HB LEU 121 6.004 13.551 -5.702 996 HG LEU 121 HG LEU 121 3.899 15.082 -6.492 997 1HD1 LEU 121 1HD1 LEU 121 5.838 15.586 -8.439 998 2HD1 LEU 121 2HD1 LEU 121 4.114 15.941 -8.530 999 3HD1 LEU 121 3HD1 LEU 121 4.734 14.420 -9.167 1000 1HD2 LEU 121 1HD2 LEU 121 4.360 12.502 -6.319 1001 2HD2 LEU 121 2HD2 LEU 121 4.536 12.636 -8.070 1002 3HD2 LEU 121 3HD2 LEU 121 3.026 13.118 -7.296 1003 H LYS 122 H LYS 122 6.243 17.348 -7.051 1004 HA LYS 122 HA LYS 122 3.845 18.781 -6.112 1005 1HB LYS 122 1HB LYS 122 4.786 20.827 -6.918 1006 2HB LYS 122 2HB LYS 122 6.001 20.033 -5.928 1007 1HG LYS 122 1HG LYS 122 7.222 19.335 -7.860 1008 2HG LYS 122 2HG LYS 122 5.932 19.885 -8.933 1009 1HD LYS 122 1HD LYS 122 7.395 21.656 -9.084 1010 2HD LYS 122 2HD LYS 122 6.365 22.192 -7.757 1011 1HE LYS 122 1HE LYS 122 8.329 20.696 -6.505 1012 2HE LYS 122 2HE LYS 122 9.201 21.564 -7.767 1013 1HZ LYS 122 1HZ LYS 122 7.662 22.654 -5.502 1014 2HZ LYS 122 2HZ LYS 122 7.921 23.592 -6.884 1015 3HZ LYS 122 3HZ LYS 122 9.240 23.022 -5.991 1016 H CYS 123 H CYS 123 2.219 19.222 -7.524 1017 HA CYS 123 HA CYS 123 2.613 18.553 -10.362 1018 1HB CYS 123 1HB CYS 123 0.425 17.566 -8.540 1019 2HB CYS 123 2HB CYS 123 0.215 17.631 -10.283 1020 H GLU 124 H GLU 124 2.733 21.125 -9.473 1021 HA GLU 124 HA GLU 124 0.416 22.599 -9.239 1022 1HB GLU 124 1HB GLU 124 3.009 23.303 -10.616 1023 2HB GLU 124 2HB GLU 124 1.731 24.470 -10.302 1024 1HG GLU 124 1HG GLU 124 2.669 24.847 -8.334 1025 2HG GLU 124 2HG GLU 124 2.169 23.226 -7.855 1026 H ALA 125 H ALA 125 1.746 21.068 -12.060 1027 HA ALA 125 HA ALA 125 0.234 22.506 -13.998 1028 1HB ALA 125 1HB ALA 125 1.350 21.275 -15.515 1029 2HB ALA 125 2HB ALA 125 1.054 19.760 -14.662 1030 3HB ALA 125 3HB ALA 125 2.347 20.835 -14.129 1031 H CYS 126 H CYS 126 -0.037 19.027 -13.296 1032 HA CYS 126 HA CYS 126 -2.804 19.039 -14.094 1033 1HB CYS 126 1HB CYS 126 -2.715 16.632 -13.745 1034 2HB CYS 126 2HB CYS 126 -1.292 17.154 -14.640 1035 H GLY 127 H GLY 127 -2.878 20.747 -12.145 1036 1HA GLY 127 1HA GLY 127 -4.503 20.929 -10.401 1037 2HA GLY 127 2HA GLY 127 -4.137 19.275 -9.936 1038 H ALA 128 H ALA 128 -3.021 19.082 -8.117 1039 HA ALA 128 HA ALA 128 -0.829 20.884 -7.521 1040 1HB ALA 128 1HB ALA 128 -2.560 22.167 -6.552 1041 2HB ALA 128 2HB ALA 128 -1.747 21.341 -5.222 1042 3HB ALA 128 3HB ALA 128 -3.299 20.746 -5.815 1043 H LYS 129 H LYS 129 0.559 20.113 -5.833 1044 HA LYS 129 HA LYS 129 -0.003 17.531 -4.641 1045 1HB LYS 129 1HB LYS 129 1.296 17.585 -7.082 1046 2HB LYS 129 2HB LYS 129 2.608 17.449 -5.935 1047 1HG LYS 129 1HG LYS 129 0.283 15.581 -6.285 1048 2HG LYS 129 2HG LYS 129 1.986 15.258 -6.612 1049 1HD LYS 129 1HD LYS 129 2.030 16.037 -3.993 1050 2HD LYS 129 2HD LYS 129 0.505 15.159 -4.094 1051 1HE LYS 129 1HE LYS 129 2.906 13.941 -5.334 1052 2HE LYS 129 2HE LYS 129 2.811 13.950 -3.577 1053 1HZ LYS 129 1HZ LYS 129 1.846 11.964 -4.860 1054 2HZ LYS 129 2HZ LYS 129 0.544 12.988 -5.201 1055 3HZ LYS 129 3HZ LYS 129 0.930 12.620 -3.596 1056 H ALA 130 H ALA 130 1.235 17.099 -2.830 1057 HA ALA 130 HA ALA 130 2.553 19.369 -1.640 1058 1HB ALA 130 1HB ALA 130 2.144 18.366 0.342 1059 2HB ALA 130 2HB ALA 130 2.572 16.763 -0.256 1060 3HB ALA 130 3HB ALA 130 0.989 17.448 -0.625 1061 HA PRO 131 HA PRO 131 6.553 17.763 -3.126 1062 1HB PRO 131 1HB PRO 131 7.969 20.003 -2.609 1063 2HB PRO 131 2HB PRO 131 6.923 19.851 -4.026 1064 1HG PRO 131 1HG PRO 131 6.365 21.179 -1.399 1065 2HG PRO 131 2HG PRO 131 6.037 21.770 -3.039 1066 1HD PRO 131 1HD PRO 131 4.120 20.643 -1.501 1067 2HD PRO 131 2HD PRO 131 4.148 20.469 -3.267 1068 H LEU 132 H LEU 132 5.978 19.454 -0.064 1069 HA LEU 132 HA LEU 132 7.626 17.508 1.323 1070 1HB LEU 132 1HB LEU 132 8.256 20.460 1.343 1071 2HB LEU 132 2HB LEU 132 8.861 19.336 2.544 1072 HG LEU 132 HG LEU 132 9.633 18.121 0.216 1073 1HD1 LEU 132 1HD1 LEU 132 10.221 19.589 -1.413 1074 2HD1 LEU 132 2HD1 LEU 132 10.438 20.927 -0.284 1075 3HD1 LEU 132 3HD1 LEU 132 8.815 20.443 -0.777 1076 1HD2 LEU 132 1HD2 LEU 132 10.963 19.907 2.191 1077 2HD2 LEU 132 2HD2 LEU 132 11.863 19.403 0.761 1078 3HD2 LEU 132 3HD2 LEU 132 11.218 18.193 1.869 1079 H LYS 133 H LYS 133 6.499 16.886 3.036 1080 HA LYS 133 HA LYS 133 4.284 18.476 3.979 1081 1HB LYS 133 1HB LYS 133 5.114 15.705 4.119 1082 2HB LYS 133 2HB LYS 133 4.590 16.288 5.693 1083 1HG LYS 133 1HG LYS 133 2.448 16.877 4.855 1084 2HG LYS 133 2HG LYS 133 2.962 16.617 3.187 1085 1HD LYS 133 1HD LYS 133 1.622 14.744 3.929 1086 2HD LYS 133 2HD LYS 133 3.293 14.223 3.696 1087 1HE LYS 133 1HE LYS 133 2.367 13.288 5.746 1088 2HE LYS 133 2HE LYS 133 3.686 14.403 6.102 1089 1HZ LYS 133 1HZ LYS 133 2.031 16.110 6.606 1090 2HZ LYS 133 2HZ LYS 133 1.844 14.757 7.602 1091 3HZ LYS 133 3HZ LYS 133 0.784 15.007 6.308 1092 H ASN 134 H ASN 134 4.039 18.219 6.572 1093 HA ASN 134 HA ASN 134 5.898 20.067 7.642 1094 1HB ASN 134 1HB ASN 134 3.625 18.468 8.767 1095 2HB ASN 134 2HB ASN 134 4.705 19.333 9.857 1096 1HD2 ASN 134 1HD2 ASN 134 1.815 19.606 8.716 1097 2HD2 ASN 134 2HD2 ASN 134 1.699 21.300 8.402 1098 H VAL 135 H VAL 135 7.148 19.696 9.665 1099 HA VAL 135 HA VAL 135 8.906 17.474 9.305 1100 HB VAL 135 HB VAL 135 9.800 19.594 10.065 1101 1HG1 VAL 135 1HG1 VAL 135 9.272 20.014 12.651 1102 2HG1 VAL 135 2HG1 VAL 135 7.734 19.308 12.159 1103 3HG1 VAL 135 3HG1 VAL 135 8.340 20.750 11.348 1104 1HG2 VAL 135 1HG2 VAL 135 10.220 18.012 12.517 1105 2HG2 VAL 135 2HG2 VAL 135 11.390 18.671 11.373 1106 3HG2 VAL 135 3HG2 VAL 135 10.535 17.175 10.997 Start of MODEL 11 1 H MET 1 H MET 1 -31.692 -14.852 -30.552 2 HA MET 1 HA MET 1 -28.901 -14.301 -30.231 3 1HB MET 1 1HB MET 1 -31.453 -12.744 -30.652 4 2HB MET 1 2HB MET 1 -29.886 -11.963 -30.481 5 1HG MET 1 1HG MET 1 -29.065 -13.030 -32.453 6 2HG MET 1 2HG MET 1 -30.513 -14.028 -32.574 7 1HE MET 1 1HE MET 1 -29.211 -12.559 -34.771 8 2HE MET 1 2HE MET 1 -30.159 -11.255 -35.487 9 3HE MET 1 3HE MET 1 -30.822 -12.888 -35.409 10 H ASP 2 H ASP 2 -31.885 -13.599 -28.416 11 HA ASP 2 HA ASP 2 -30.374 -12.416 -26.249 12 1HB ASP 2 1HB ASP 2 -33.023 -12.211 -27.193 13 2HB ASP 2 2HB ASP 2 -33.134 -12.910 -25.580 14 H ASP 3 H ASP 3 -31.512 -15.521 -27.110 15 HA ASP 3 HA ASP 3 -31.959 -16.633 -24.560 16 1HB ASP 3 1HB ASP 3 -31.072 -17.940 -27.139 17 2HB ASP 3 2HB ASP 3 -31.591 -18.819 -25.704 18 H TYR 4 H TYR 4 -30.617 -17.379 -23.030 19 HA TYR 4 HA TYR 4 -27.836 -16.773 -23.178 20 1HB TYR 4 1HB TYR 4 -29.312 -18.423 -21.116 21 2HB TYR 4 2HB TYR 4 -27.707 -17.724 -20.932 22 HD1 TYR 4 HD1 TYR 4 -31.302 -17.030 -21.004 23 HD2 TYR 4 HD2 TYR 4 -27.423 -15.350 -20.526 24 HE1 TYR 4 HE1 TYR 4 -32.310 -14.981 -20.093 25 HE2 TYR 4 HE2 TYR 4 -28.419 -13.296 -19.612 26 HH TYR 4 HH TYR 4 -30.412 -12.118 -19.464 27 H GLU 5 H GLU 5 -27.588 -18.123 -25.202 28 HA GLU 5 HA GLU 5 -27.483 -20.978 -24.856 29 1HB GLU 5 1HB GLU 5 -26.292 -19.392 -27.129 30 2HB GLU 5 2HB GLU 5 -26.798 -21.076 -27.138 31 1HG GLU 5 1HG GLU 5 -29.080 -19.653 -26.428 32 2HG GLU 5 2HG GLU 5 -28.317 -18.690 -27.692 33 H LYS 6 H LYS 6 -25.025 -18.479 -25.533 34 HA LYS 6 HA LYS 6 -23.057 -20.174 -24.139 35 1HB LYS 6 1HB LYS 6 -22.997 -19.057 -26.830 36 2HB LYS 6 2HB LYS 6 -21.588 -18.592 -25.888 37 1HG LYS 6 1HG LYS 6 -20.790 -20.532 -26.718 38 2HG LYS 6 2HG LYS 6 -21.625 -21.196 -25.313 39 1HD LYS 6 1HD LYS 6 -23.195 -20.866 -27.809 40 2HD LYS 6 2HD LYS 6 -21.987 -22.151 -27.773 41 1HE LYS 6 1HE LYS 6 -23.438 -22.211 -25.327 42 2HE LYS 6 2HE LYS 6 -24.595 -22.141 -26.657 43 1HZ LYS 6 1HZ LYS 6 -24.128 -24.409 -26.233 44 2HZ LYS 6 2HZ LYS 6 -22.457 -24.151 -26.231 45 3HZ LYS 6 3HZ LYS 6 -23.329 -24.019 -27.673 46 H LEU 7 H LEU 7 -21.159 -18.920 -23.304 47 HA LEU 7 HA LEU 7 -22.063 -16.299 -22.314 48 1HB LEU 7 1HB LEU 7 -20.913 -18.587 -20.982 49 2HB LEU 7 2HB LEU 7 -19.913 -17.172 -20.730 50 HG LEU 7 HG LEU 7 -22.821 -17.496 -19.993 51 1HD1 LEU 7 1HD1 LEU 7 -22.096 -17.365 -17.755 52 2HD1 LEU 7 2HD1 LEU 7 -20.477 -16.851 -18.228 53 3HD1 LEU 7 3HD1 LEU 7 -21.006 -18.502 -18.546 54 1HD2 LEU 7 1HD2 LEU 7 -21.957 -15.172 -20.906 55 2HD2 LEU 7 2HD2 LEU 7 -21.269 -15.056 -19.290 56 3HD2 LEU 7 3HD2 LEU 7 -23.006 -15.271 -19.494 57 H LEU 8 H LEU 8 -20.191 -14.850 -21.659 58 HA LEU 8 HA LEU 8 -18.231 -14.828 -23.846 59 1HB LEU 8 1HB LEU 8 -19.931 -12.815 -22.636 60 2HB LEU 8 2HB LEU 8 -18.255 -12.305 -22.647 61 HG LEU 8 HG LEU 8 -18.382 -13.073 -25.174 62 1HD1 LEU 8 1HD1 LEU 8 -21.045 -11.985 -25.326 63 2HD1 LEU 8 2HD1 LEU 8 -21.029 -13.475 -24.384 64 3HD1 LEU 8 3HD1 LEU 8 -20.394 -13.466 -26.029 65 1HD2 LEU 8 1HD2 LEU 8 -18.952 -10.771 -25.778 66 2HD2 LEU 8 2HD2 LEU 8 -17.843 -10.828 -24.407 67 3HD2 LEU 8 3HD2 LEU 8 -19.554 -10.494 -24.144 68 H GLU 9 H GLU 9 -16.559 -12.808 -22.617 69 HA GLU 9 HA GLU 9 -14.746 -12.617 -21.259 70 1HB GLU 9 1HB GLU 9 -16.113 -14.536 -19.372 71 2HB GLU 9 2HB GLU 9 -14.890 -13.335 -18.983 72 1HG GLU 9 1HG GLU 9 -17.744 -12.845 -19.785 73 2HG GLU 9 2HG GLU 9 -16.995 -12.532 -18.220 74 H ARG 10 H ARG 10 -13.662 -13.806 -22.985 75 HA ARG 10 HA ARG 10 -12.987 -16.574 -22.283 76 1HB ARG 10 1HB ARG 10 -13.011 -15.033 -24.846 77 2HB ARG 10 2HB ARG 10 -11.925 -16.400 -24.680 78 1HG ARG 10 1HG ARG 10 -14.125 -17.604 -23.857 79 2HG ARG 10 2HG ARG 10 -14.888 -16.338 -24.816 80 1HD ARG 10 1HD ARG 10 -14.399 -18.544 -25.984 81 2HD ARG 10 2HD ARG 10 -13.873 -17.076 -26.800 82 HE ARG 10 HE ARG 10 -11.628 -17.585 -25.856 83 1HH1 ARG 10 1HH1 ARG 10 -13.916 -20.170 -26.388 84 2HH1 ARG 10 2HH1 ARG 10 -12.685 -21.378 -26.529 85 1HH2 ARG 10 1HH2 ARG 10 -10.028 -19.165 -26.048 86 2HH2 ARG 10 2HH2 ARG 10 -10.481 -20.810 -26.340 87 H ALA 11 H ALA 11 -11.412 -13.595 -23.450 88 HA ALA 11 HA ALA 11 -8.787 -14.528 -22.749 89 1HB ALA 11 1HB ALA 11 -9.673 -11.770 -23.572 90 2HB ALA 11 2HB ALA 11 -9.162 -13.048 -24.672 91 3HB ALA 11 3HB ALA 11 -8.016 -12.370 -23.518 92 H ILE 12 H ILE 12 -10.743 -14.388 -20.599 93 HA ILE 12 HA ILE 12 -9.641 -12.306 -18.860 94 HB ILE 12 HB ILE 12 -11.496 -12.935 -17.326 95 1HG1 ILE 12 1HG1 ILE 12 -13.190 -14.320 -19.140 96 2HG1 ILE 12 2HG1 ILE 12 -11.655 -15.176 -19.108 97 1HG2 ILE 12 1HG2 ILE 12 -11.611 -11.230 -19.295 98 2HG2 ILE 12 2HG2 ILE 12 -13.080 -11.664 -18.423 99 3HG2 ILE 12 3HG2 ILE 12 -12.734 -12.397 -19.990 100 1HD1 ILE 12 1HD1 ILE 12 -12.761 -16.225 -17.421 101 2HD1 ILE 12 2HD1 ILE 12 -13.648 -14.775 -16.949 102 3HD1 ILE 12 3HD1 ILE 12 -11.948 -14.950 -16.514 103 H ASP 13 H ASP 13 -7.601 -13.558 -18.756 104 HA ASP 13 HA ASP 13 -6.154 -14.744 -17.436 105 1HB ASP 13 1HB ASP 13 -8.320 -14.488 -15.756 106 2HB ASP 13 2HB ASP 13 -8.118 -16.234 -15.846 107 H GLN 14 H GLN 14 -9.027 -16.363 -18.678 108 HA GLN 14 HA GLN 14 -7.800 -18.958 -18.752 109 1HB GLN 14 1HB GLN 14 -10.425 -17.862 -19.114 110 2HB GLN 14 2HB GLN 14 -10.031 -18.871 -20.498 111 1HG GLN 14 1HG GLN 14 -9.239 -20.508 -18.538 112 2HG GLN 14 2HG GLN 14 -10.484 -19.605 -17.674 113 1HE2 GLN 14 1HE2 GLN 14 -9.963 -21.227 -20.784 114 2HE2 GLN 14 2HE2 GLN 14 -11.542 -21.919 -20.884 115 H LEU 15 H LEU 15 -8.919 -16.712 -21.317 116 HA LEU 15 HA LEU 15 -7.295 -18.116 -23.274 117 1HB LEU 15 1HB LEU 15 -9.637 -17.213 -23.723 118 2HB LEU 15 2HB LEU 15 -8.914 -15.627 -23.746 119 HG LEU 15 HG LEU 15 -8.132 -17.849 -25.629 120 1HD1 LEU 15 1HD1 LEU 15 -10.440 -16.165 -25.621 121 2HD1 LEU 15 2HD1 LEU 15 -9.968 -17.397 -26.791 122 3HD1 LEU 15 3HD1 LEU 15 -9.411 -15.737 -26.984 123 1HD2 LEU 15 1HD2 LEU 15 -6.476 -16.520 -26.276 124 2HD2 LEU 15 2HD2 LEU 15 -6.902 -15.380 -25.006 125 3HD2 LEU 15 3HD2 LEU 15 -7.619 -15.221 -26.601 126 HA PRO 16 HA PRO 16 -3.648 -15.653 -22.828 127 1HB PRO 16 1HB PRO 16 -2.996 -15.554 -25.553 128 2HB PRO 16 2HB PRO 16 -2.477 -16.787 -24.402 129 1HG PRO 16 1HG PRO 16 -4.703 -16.852 -26.376 130 2HG PRO 16 2HG PRO 16 -3.641 -18.161 -25.836 131 1HD PRO 16 1HD PRO 16 -6.173 -17.974 -24.978 132 2HD PRO 16 2HD PRO 16 -4.873 -18.534 -23.906 133 HA PRO 17 HA PRO 17 -4.615 -11.431 -23.634 134 1HB PRO 17 1HB PRO 17 -2.189 -10.464 -24.553 135 2HB PRO 17 2HB PRO 17 -2.621 -10.671 -22.853 136 1HG PRO 17 1HG PRO 17 -1.006 -12.446 -24.630 137 2HG PRO 17 2HG PRO 17 -0.766 -12.050 -22.919 138 1HD PRO 17 1HD PRO 17 -1.821 -14.398 -23.695 139 2HD PRO 17 2HD PRO 17 -2.355 -13.578 -22.213 140 H GLU 18 H GLU 18 -2.220 -12.190 -26.163 141 HA GLU 18 HA GLU 18 -2.273 -12.023 -28.425 142 1HB GLU 18 1HB GLU 18 -4.729 -13.179 -27.706 143 2HB GLU 18 2HB GLU 18 -5.124 -11.948 -28.896 144 1HG GLU 18 1HG GLU 18 -2.909 -13.885 -29.410 145 2HG GLU 18 2HG GLU 18 -4.589 -14.350 -29.676 146 H VAL 19 H VAL 19 -5.389 -10.387 -27.940 147 HA VAL 19 HA VAL 19 -4.495 -8.128 -29.480 148 HB VAL 19 HB VAL 19 -7.069 -8.307 -27.913 149 1HG1 VAL 19 1HG1 VAL 19 -7.271 -6.245 -28.764 150 2HG1 VAL 19 2HG1 VAL 19 -7.593 -7.062 -30.293 151 3HG1 VAL 19 3HG1 VAL 19 -5.967 -6.494 -29.924 152 1HG2 VAL 19 1HG2 VAL 19 -6.638 -9.294 -30.728 153 2HG2 VAL 19 2HG2 VAL 19 -8.121 -9.378 -29.778 154 3HG2 VAL 19 3HG2 VAL 19 -6.722 -10.342 -29.313 155 H PHE 20 H PHE 20 -4.964 -5.853 -28.605 156 HA PHE 20 HA PHE 20 -3.696 -5.631 -25.979 157 1HB PHE 20 1HB PHE 20 -3.479 -3.175 -26.710 158 2HB PHE 20 2HB PHE 20 -2.507 -4.367 -27.570 159 HD1 PHE 20 HD1 PHE 20 -2.529 -4.375 -29.873 160 HD2 PHE 20 HD2 PHE 20 -5.808 -2.654 -27.775 161 HE1 PHE 20 HE1 PHE 20 -3.506 -3.641 -32.008 162 HE2 PHE 20 HE2 PHE 20 -6.789 -1.915 -29.907 163 HZ PHE 20 HZ PHE 20 -5.638 -2.409 -32.027 164 H GLU 21 H GLU 21 -6.728 -5.958 -26.871 165 HA GLU 21 HA GLU 21 -8.016 -3.645 -25.828 166 1HB GLU 21 1HB GLU 21 -10.063 -4.998 -25.915 167 2HB GLU 21 2HB GLU 21 -9.147 -5.121 -27.409 168 1HG GLU 21 1HG GLU 21 -8.229 -7.275 -26.616 169 2HG GLU 21 2HG GLU 21 -9.272 -7.158 -25.198 170 H THR 22 H THR 22 -8.649 -3.156 -23.794 171 HA THR 22 HA THR 22 -7.521 -4.608 -21.624 172 HB THR 22 HB THR 22 -7.788 -2.206 -21.464 173 HG1 THR 22 HG1 THR 22 -7.980 -3.456 -19.531 174 1HG2 THR 22 1HG2 THR 22 -10.681 -2.768 -21.916 175 2HG2 THR 22 2HG2 THR 22 -9.649 -1.530 -22.629 176 3HG2 THR 22 3HG2 THR 22 -10.185 -1.376 -20.956 177 H LYS 23 H LYS 23 -8.271 -6.460 -20.867 178 HA LYS 23 HA LYS 23 -10.969 -7.312 -21.379 179 1HB LYS 23 1HB LYS 23 -9.038 -8.708 -19.540 180 2HB LYS 23 2HB LYS 23 -10.330 -9.408 -20.504 181 1HG LYS 23 1HG LYS 23 -7.945 -8.105 -21.771 182 2HG LYS 23 2HG LYS 23 -7.938 -9.797 -21.274 183 1HD LYS 23 1HD LYS 23 -9.902 -10.202 -22.693 184 2HD LYS 23 2HD LYS 23 -9.859 -8.519 -23.216 185 1HE LYS 23 1HE LYS 23 -7.679 -10.561 -23.636 186 2HE LYS 23 2HE LYS 23 -8.806 -9.986 -24.863 187 1HZ LYS 23 1HZ LYS 23 -6.377 -8.820 -23.967 188 2HZ LYS 23 2HZ LYS 23 -7.655 -7.726 -23.792 189 3HZ LYS 23 3HZ LYS 23 -7.330 -8.410 -25.304 190 H ARG 24 H ARG 24 -11.766 -8.664 -19.174 191 HA ARG 24 HA ARG 24 -12.756 -6.565 -17.510 192 1HB ARG 24 1HB ARG 24 -13.688 -9.018 -18.175 193 2HB ARG 24 2HB ARG 24 -13.024 -9.364 -16.584 194 1HG ARG 24 1HG ARG 24 -14.602 -8.153 -15.511 195 2HG ARG 24 2HG ARG 24 -14.718 -6.957 -16.803 196 1HD ARG 24 1HD ARG 24 -16.167 -8.276 -18.062 197 2HD ARG 24 2HD ARG 24 -15.718 -9.751 -17.207 198 HE ARG 24 HE ARG 24 -17.792 -7.953 -16.506 199 1HH1 ARG 24 1HH1 ARG 24 -15.347 -10.007 -15.100 200 2HH1 ARG 24 2HH1 ARG 24 -16.225 -10.256 -13.629 201 1HH2 ARG 24 1HH2 ARG 24 -18.951 -8.282 -14.572 202 2HH2 ARG 24 2HH2 ARG 24 -18.270 -9.278 -13.329 203 H PHE 25 H PHE 25 -10.287 -6.053 -17.125 204 HA PHE 25 HA PHE 25 -9.000 -7.603 -15.089 205 1HB PHE 25 1HB PHE 25 -8.334 -5.350 -16.794 206 2HB PHE 25 2HB PHE 25 -7.793 -5.079 -15.140 207 HD1 PHE 25 HD1 PHE 25 -6.646 -7.257 -14.062 208 HD2 PHE 25 HD2 PHE 25 -6.851 -6.351 -18.215 209 HE1 PHE 25 HE1 PHE 25 -4.689 -8.691 -14.468 210 HE2 PHE 25 HE2 PHE 25 -4.893 -7.784 -18.629 211 HZ PHE 25 HZ PHE 25 -3.810 -8.957 -16.753 212 H GLU 26 H GLU 26 -10.356 -7.691 -13.324 213 HA GLU 26 HA GLU 26 -10.517 -5.210 -11.778 214 1HB GLU 26 1HB GLU 26 -12.730 -6.309 -13.044 215 2HB GLU 26 2HB GLU 26 -12.866 -6.895 -11.392 216 1HG GLU 26 1HG GLU 26 -12.241 -4.031 -11.705 217 2HG GLU 26 2HG GLU 26 -13.844 -4.544 -12.229 218 H VAL 27 H VAL 27 -10.095 -5.446 -9.661 219 HA VAL 27 HA VAL 27 -10.222 -8.057 -8.386 220 HB VAL 27 HB VAL 27 -7.627 -6.507 -8.397 221 1HG1 VAL 27 1HG1 VAL 27 -7.592 -9.308 -7.589 222 2HG1 VAL 27 2HG1 VAL 27 -8.590 -8.294 -6.549 223 3HG1 VAL 27 3HG1 VAL 27 -6.893 -7.891 -6.806 224 1HG2 VAL 27 1HG2 VAL 27 -6.890 -8.734 -9.592 225 2HG2 VAL 27 2HG2 VAL 27 -7.543 -7.379 -10.511 226 3HG2 VAL 27 3HG2 VAL 27 -8.574 -8.751 -10.107 227 HA PRO 28 HA PRO 28 -11.721 -4.664 -5.655 228 1HB PRO 28 1HB PRO 28 -12.723 -7.073 -4.239 229 2HB PRO 28 2HB PRO 28 -13.568 -5.582 -4.657 230 1HG PRO 28 1HG PRO 28 -14.012 -7.853 -6.002 231 2HG PRO 28 2HG PRO 28 -14.009 -6.279 -6.817 232 1HD PRO 28 1HD PRO 28 -11.937 -8.421 -6.821 233 2HD PRO 28 2HD PRO 28 -12.405 -7.297 -8.112 234 H LYS 29 H LYS 29 -11.820 -5.013 -2.995 235 HA LYS 29 HA LYS 29 -10.558 -5.033 -1.101 236 1HB LYS 29 1HB LYS 29 -8.898 -7.205 -2.372 237 2HB LYS 29 2HB LYS 29 -9.167 -6.913 -0.661 238 1HG LYS 29 1HG LYS 29 -10.770 -8.432 -0.735 239 2HG LYS 29 2HG LYS 29 -11.709 -7.313 -1.725 240 1HD LYS 29 1HD LYS 29 -10.227 -8.313 -3.659 241 2HD LYS 29 2HD LYS 29 -10.072 -9.666 -2.539 242 1HE LYS 29 1HE LYS 29 -12.311 -10.187 -2.648 243 2HE LYS 29 2HE LYS 29 -12.779 -8.547 -3.092 244 1HZ LYS 29 1HZ LYS 29 -12.085 -10.764 -4.771 245 2HZ LYS 29 2HZ LYS 29 -11.232 -9.360 -5.174 246 3HZ LYS 29 3HZ LYS 29 -12.923 -9.344 -5.152 247 H ALA 30 H ALA 30 -9.566 -3.065 -1.181 248 HA ALA 30 HA ALA 30 -6.741 -3.056 -1.728 249 1HB ALA 30 1HB ALA 30 -6.618 -1.711 -3.558 250 2HB ALA 30 2HB ALA 30 -8.160 -0.924 -3.223 251 3HB ALA 30 3HB ALA 30 -8.129 -2.542 -3.924 252 H TYR 31 H TYR 31 -8.761 -2.488 0.433 253 HA TYR 31 HA TYR 31 -7.444 -0.145 1.466 254 1HB TYR 31 1HB TYR 31 -9.702 0.919 2.039 255 2HB TYR 31 2HB TYR 31 -9.156 1.046 0.372 256 HD1 TYR 31 HD1 TYR 31 -10.897 0.935 -1.117 257 HD2 TYR 31 HD2 TYR 31 -11.011 -1.562 2.328 258 HE1 TYR 31 HE1 TYR 31 -13.015 -0.039 -1.897 259 HE2 TYR 31 HE2 TYR 31 -13.126 -2.541 1.555 260 HH TYR 31 HH TYR 31 -15.073 -1.714 -0.005 261 H SER 32 H SER 32 -8.177 0.299 3.748 262 HA SER 32 HA SER 32 -8.195 -2.160 5.200 263 1HB SER 32 1HB SER 32 -7.880 0.691 5.799 264 2HB SER 32 2HB SER 32 -8.731 -0.200 7.062 265 HG SER 32 HG SER 32 -6.984 -1.660 7.100 266 H VAL 33 H VAL 33 -9.766 -2.163 7.236 267 HA VAL 33 HA VAL 33 -12.497 -1.647 6.270 268 HB VAL 33 HB VAL 33 -12.339 -3.921 8.089 269 1HG1 VAL 33 1HG1 VAL 33 -14.353 -3.429 6.920 270 2HG1 VAL 33 2HG1 VAL 33 -13.725 -4.946 6.275 271 3HG1 VAL 33 3HG1 VAL 33 -13.524 -3.450 5.363 272 1HG2 VAL 33 1HG2 VAL 33 -10.163 -4.064 6.654 273 2HG2 VAL 33 2HG2 VAL 33 -11.268 -4.538 5.365 274 3HG2 VAL 33 3HG2 VAL 33 -11.180 -5.490 6.845 275 H ILE 34 H ILE 34 -13.734 -0.515 7.649 276 HA ILE 34 HA ILE 34 -12.655 0.271 10.200 277 HB ILE 34 HB ILE 34 -13.820 1.876 8.734 278 1HG1 ILE 34 1HG1 ILE 34 -13.765 1.960 11.334 279 2HG1 ILE 34 2HG1 ILE 34 -14.806 3.075 10.461 280 1HG2 ILE 34 1HG2 ILE 34 -15.651 -0.130 8.364 281 2HG2 ILE 34 2HG2 ILE 34 -15.849 1.548 7.865 282 3HG2 ILE 34 3HG2 ILE 34 -16.523 1.000 9.396 283 1HD1 ILE 34 1HD1 ILE 34 -15.649 1.734 12.562 284 2HD1 ILE 34 2HD1 ILE 34 -15.966 0.497 11.345 285 3HD1 ILE 34 3HD1 ILE 34 -16.712 2.084 11.198 286 H GLN 35 H GLN 35 -13.463 -0.228 12.204 287 HA GLN 35 HA GLN 35 -15.858 -1.805 12.472 288 1HB GLN 35 1HB GLN 35 -13.459 -3.174 12.120 289 2HB GLN 35 2HB GLN 35 -13.732 -3.215 13.858 290 1HG GLN 35 1HG GLN 35 -16.078 -3.828 12.203 291 2HG GLN 35 2HG GLN 35 -14.758 -4.992 12.107 292 1HE2 GLN 35 1HE2 GLN 35 -15.838 -6.606 13.169 293 2HE2 GLN 35 2HE2 GLN 35 -16.218 -6.540 14.853 294 H GLY 36 H GLY 36 -16.621 -0.196 13.773 295 1HA GLY 36 1HA GLY 36 -17.051 0.814 15.789 296 2HA GLY 36 2HA GLY 36 -15.947 -0.338 16.525 297 H ASN 37 H ASN 37 -13.637 0.138 16.391 298 HA ASN 37 HA ASN 37 -12.855 2.856 15.762 299 1HB ASN 37 1HB ASN 37 -13.400 1.956 18.501 300 2HB ASN 37 2HB ASN 37 -11.799 2.658 18.300 301 1HD2 ASN 37 1HD2 ASN 37 -12.979 4.132 19.882 302 2HD2 ASN 37 2HD2 ASN 37 -13.763 5.507 19.189 303 H ARG 38 H ARG 38 -12.184 0.152 14.884 304 HA ARG 38 HA ARG 38 -9.299 0.307 15.294 305 1HB ARG 38 1HB ARG 38 -9.472 -2.338 15.411 306 2HB ARG 38 2HB ARG 38 -9.588 -1.343 16.857 307 1HG ARG 38 1HG ARG 38 -12.174 -1.422 16.166 308 2HG ARG 38 2HG ARG 38 -11.645 -2.957 15.499 309 1HD ARG 38 1HD ARG 38 -12.117 -3.675 17.588 310 2HD ARG 38 2HD ARG 38 -10.479 -3.104 17.902 311 HE ARG 38 HE ARG 38 -11.591 -0.965 18.606 312 1HH1 ARG 38 1HH1 ARG 38 -13.214 -4.054 18.897 313 2HH1 ARG 38 2HH1 ARG 38 -14.300 -3.494 20.120 314 1HH2 ARG 38 1HH2 ARG 38 -13.021 -0.247 20.200 315 2HH2 ARG 38 2HH2 ARG 38 -14.194 -1.338 20.860 316 H THR 39 H THR 39 -8.049 -0.766 13.647 317 HA THR 39 HA THR 39 -9.585 -1.118 11.163 318 HB THR 39 HB THR 39 -7.413 0.534 11.697 319 HG1 THR 39 HG1 THR 39 -8.153 -0.348 9.119 320 1HG2 THR 39 1HG2 THR 39 -5.984 -1.578 11.392 321 2HG2 THR 39 2HG2 THR 39 -5.554 -0.131 10.491 322 3HG2 THR 39 3HG2 THR 39 -6.418 -1.445 9.692 323 H PHE 40 H PHE 40 -9.787 -3.085 10.372 324 HA PHE 40 HA PHE 40 -8.083 -5.218 11.404 325 1HB PHE 40 1HB PHE 40 -10.657 -5.252 9.824 326 2HB PHE 40 2HB PHE 40 -9.745 -6.707 10.204 327 HD1 PHE 40 HD1 PHE 40 -11.445 -7.763 11.498 328 HD2 PHE 40 HD2 PHE 40 -10.091 -3.862 12.521 329 HE1 PHE 40 HE1 PHE 40 -12.611 -7.926 13.660 330 HE2 PHE 40 HE2 PHE 40 -11.239 -4.024 14.669 331 HZ PHE 40 HZ PHE 40 -12.509 -6.048 15.253 332 H ILE 41 H ILE 41 -6.308 -4.177 10.077 333 HA ILE 41 HA ILE 41 -6.359 -4.372 7.263 334 HB ILE 41 HB ILE 41 -4.497 -3.540 9.285 335 1HG1 ILE 41 1HG1 ILE 41 -3.726 -2.839 6.597 336 2HG1 ILE 41 2HG1 ILE 41 -5.469 -2.702 6.792 337 1HG2 ILE 41 1HG2 ILE 41 -3.446 -5.782 8.134 338 2HG2 ILE 41 2HG2 ILE 41 -2.521 -4.469 8.842 339 3HG2 ILE 41 3HG2 ILE 41 -2.816 -4.502 7.106 340 1HD1 ILE 41 1HD1 ILE 41 -5.297 -0.896 8.106 341 2HD1 ILE 41 2HD1 ILE 41 -3.674 -0.770 7.431 342 3HD1 ILE 41 3HD1 ILE 41 -3.922 -1.552 8.992 343 H GLN 42 H GLN 42 -6.333 -6.097 6.030 344 HA GLN 42 HA GLN 42 -5.280 -8.620 7.126 345 1HB GLN 42 1HB GLN 42 -6.887 -9.814 5.833 346 2HB GLN 42 2HB GLN 42 -7.759 -8.503 6.613 347 1HG GLN 42 1HG GLN 42 -7.341 -7.233 4.393 348 2HG GLN 42 2HG GLN 42 -7.036 -8.839 3.734 349 1HE2 GLN 42 1HE2 GLN 42 -8.767 -9.424 2.614 350 2HE2 GLN 42 2HE2 GLN 42 -10.407 -9.294 3.142 351 H ASN 43 H ASN 43 -5.365 -6.447 4.401 352 HA ASN 43 HA ASN 43 -3.364 -8.081 3.017 353 1HB ASN 43 1HB ASN 43 -5.543 -6.323 2.128 354 2HB ASN 43 2HB ASN 43 -4.032 -6.087 1.255 355 1HD2 ASN 43 1HD2 ASN 43 -5.186 -6.893 -0.589 356 2HD2 ASN 43 2HD2 ASN 43 -5.366 -8.597 -0.814 357 H PHE 44 H PHE 44 -2.515 -6.701 5.254 358 HA PHE 44 HA PHE 44 -1.553 -4.159 5.040 359 1HB PHE 44 1HB PHE 44 0.337 -4.857 6.503 360 2HB PHE 44 2HB PHE 44 -1.221 -5.425 7.078 361 HD1 PHE 44 HD1 PHE 44 -1.880 -7.840 6.429 362 HD2 PHE 44 HD2 PHE 44 2.097 -6.332 6.290 363 HE1 PHE 44 HE1 PHE 44 -1.015 -10.135 6.518 364 HE2 PHE 44 HE2 PHE 44 2.972 -8.630 6.380 365 HZ PHE 44 HZ PHE 44 1.416 -10.535 6.493 366 H ARG 45 H ARG 45 -0.492 -6.940 3.250 367 HA ARG 45 HA ARG 45 2.050 -5.905 2.499 368 1HB ARG 45 1HB ARG 45 0.890 -8.335 2.302 369 2HB ARG 45 2HB ARG 45 0.679 -7.765 0.652 370 1HG ARG 45 1HG ARG 45 2.701 -8.834 0.515 371 2HG ARG 45 2HG ARG 45 3.207 -7.172 0.826 372 1HD ARG 45 1HD ARG 45 4.290 -7.846 2.642 373 2HD ARG 45 2HD ARG 45 2.776 -8.423 3.331 374 HE ARG 45 HE ARG 45 3.228 -10.577 2.339 375 1HH1 ARG 45 1HH1 ARG 45 5.918 -8.339 2.381 376 2HH1 ARG 45 2HH1 ARG 45 7.108 -9.586 2.238 377 1HH2 ARG 45 1HH2 ARG 45 4.797 -12.204 2.145 378 2HH2 ARG 45 2HH2 ARG 45 6.475 -11.775 2.103 379 H GLU 46 H GLU 46 -1.047 -6.122 0.770 380 HA GLU 46 HA GLU 46 -0.082 -4.449 -1.375 381 1HB GLU 46 1HB GLU 46 -1.643 -6.288 -1.824 382 2HB GLU 46 2HB GLU 46 -2.849 -5.497 -0.825 383 1HG GLU 46 1HG GLU 46 -3.209 -3.805 -2.366 384 2HG GLU 46 2HG GLU 46 -1.671 -4.089 -3.180 385 H VAL 47 H VAL 47 -2.477 -4.171 1.222 386 HA VAL 47 HA VAL 47 -3.394 -1.608 0.640 387 HB VAL 47 HB VAL 47 -3.164 -2.965 3.331 388 1HG1 VAL 47 1HG1 VAL 47 -4.692 -1.392 4.208 389 2HG1 VAL 47 2HG1 VAL 47 -5.023 -0.711 2.616 390 3HG1 VAL 47 3HG1 VAL 47 -3.456 -0.447 3.380 391 1HG2 VAL 47 1HG2 VAL 47 -5.815 -2.927 2.532 392 2HG2 VAL 47 2HG2 VAL 47 -4.727 -4.314 2.484 393 3HG2 VAL 47 3HG2 VAL 47 -4.932 -3.304 1.053 394 H ALA 48 H ALA 48 -0.584 -2.629 2.574 395 HA ALA 48 HA ALA 48 0.025 0.017 3.436 396 1HB ALA 48 1HB ALA 48 2.410 -1.368 3.600 397 2HB ALA 48 2HB ALA 48 1.178 -2.604 3.813 398 3HB ALA 48 3HB ALA 48 1.201 -1.203 4.874 399 H ASP 49 H ASP 49 1.422 -2.094 0.916 400 HA ASP 49 HA ASP 49 3.425 -0.444 0.006 401 1HB ASP 49 1HB ASP 49 2.513 -2.789 -0.852 402 2HB ASP 49 2HB ASP 49 1.741 -1.773 -2.066 403 H ALA 50 H ALA 50 0.208 -0.553 -1.557 404 HA ALA 50 HA ALA 50 0.442 1.667 -3.126 405 1HB ALA 50 1HB ALA 50 -2.203 1.363 -1.890 406 2HB ALA 50 2HB ALA 50 -1.534 -0.096 -2.616 407 3HB ALA 50 3HB ALA 50 -1.734 1.364 -3.588 408 H LEU 51 H LEU 51 -0.864 1.669 0.219 409 HA LEU 51 HA LEU 51 -1.252 4.453 0.311 410 1HB LEU 51 1HB LEU 51 -2.493 3.342 1.907 411 2HB LEU 51 2HB LEU 51 -1.184 2.252 2.325 412 HG LEU 51 HG LEU 51 -0.054 4.085 3.508 413 1HD1 LEU 51 1HD1 LEU 51 -2.445 5.790 3.508 414 2HD1 LEU 51 2HD1 LEU 51 -1.533 5.727 2.006 415 3HD1 LEU 51 3HD1 LEU 51 -0.735 6.226 3.487 416 1HD2 LEU 51 1HD2 LEU 51 -2.422 4.402 5.002 417 2HD2 LEU 51 2HD2 LEU 51 -1.112 3.263 5.284 418 3HD2 LEU 51 3HD2 LEU 51 -2.482 2.794 4.286 419 H ASN 52 H ASN 52 1.583 2.612 0.413 420 HA ASN 52 HA ASN 52 3.353 4.708 0.392 421 1HB ASN 52 1HB ASN 52 2.372 4.674 2.923 422 2HB ASN 52 2HB ASN 52 3.732 3.572 3.101 423 1HD2 ASN 52 1HD2 ASN 52 5.839 4.336 2.617 424 2HD2 ASN 52 2HD2 ASN 52 6.208 6.021 2.699 425 H ARG 53 H ARG 53 4.657 3.589 -0.940 426 HA ARG 53 HA ARG 53 5.149 0.899 -1.021 427 1HB ARG 53 1HB ARG 53 6.936 3.217 -1.740 428 2HB ARG 53 2HB ARG 53 7.421 1.550 -2.014 429 1HG ARG 53 1HG ARG 53 4.861 2.672 -3.107 430 2HG ARG 53 2HG ARG 53 6.396 2.788 -3.970 431 1HD ARG 53 1HD ARG 53 6.328 0.146 -3.278 432 2HD ARG 53 2HD ARG 53 4.625 0.491 -3.574 433 HE ARG 53 HE ARG 53 5.109 0.499 -5.793 434 1HH1 ARG 53 1HH1 ARG 53 8.024 1.321 -4.058 435 2HH1 ARG 53 2HH1 ARG 53 8.997 1.412 -5.487 436 1HH2 ARG 53 1HH2 ARG 53 6.389 0.621 -7.673 437 2HH2 ARG 53 2HH2 ARG 53 8.070 1.016 -7.540 438 H ASP 54 H ASP 54 6.538 3.271 1.126 439 HA ASP 54 HA ASP 54 8.489 1.410 2.191 440 1HB ASP 54 1HB ASP 54 7.752 4.236 2.980 441 2HB ASP 54 2HB ASP 54 9.027 3.297 3.749 442 HA PRO 55 HA PRO 55 5.479 -0.119 5.144 443 1HB PRO 55 1HB PRO 55 7.112 -1.841 6.444 444 2HB PRO 55 2HB PRO 55 6.452 -2.183 4.839 445 1HG PRO 55 1HG PRO 55 9.162 -1.156 5.593 446 2HG PRO 55 2HG PRO 55 8.725 -2.392 4.399 447 1HD PRO 55 1HD PRO 55 9.313 0.173 3.722 448 2HD PRO 55 2HD PRO 55 8.177 -0.831 2.799 449 H GLN 56 H GLN 56 8.706 0.981 6.083 450 HA GLN 56 HA GLN 56 8.263 1.230 8.842 451 1HB GLN 56 1HB GLN 56 10.402 1.570 7.201 452 2HB GLN 56 2HB GLN 56 10.027 3.241 7.597 453 1HG GLN 56 1HG GLN 56 10.225 1.222 9.780 454 2HG GLN 56 2HG GLN 56 11.693 1.878 9.056 455 1HE2 GLN 56 1HE2 GLN 56 11.263 4.431 8.664 456 2HE2 GLN 56 2HE2 GLN 56 10.854 5.258 10.125 457 H HIS 57 H HIS 57 7.475 3.327 6.156 458 HA HIS 57 HA HIS 57 6.869 5.624 7.738 459 1HB HIS 57 1HB HIS 57 6.944 4.939 4.949 460 2HB HIS 57 2HB HIS 57 5.414 5.734 5.309 461 HD2 HIS 57 HD2 HIS 57 6.065 8.161 4.154 462 HE1 HIS 57 HE1 HIS 57 9.432 8.970 6.610 463 HE2 HIS 57 HE2 HIS 57 7.807 9.911 4.928 464 H LEU 58 H LEU 58 4.748 3.462 5.872 465 HA LEU 58 HA LEU 58 2.300 4.288 6.731 466 1HB LEU 58 1HB LEU 58 3.235 2.162 5.305 467 2HB LEU 58 2HB LEU 58 2.593 1.364 6.728 468 HG LEU 58 HG LEU 58 0.742 3.335 5.684 469 1HD1 LEU 58 1HD1 LEU 58 1.846 1.269 3.830 470 2HD1 LEU 58 2HD1 LEU 58 1.452 2.958 3.515 471 3HD1 LEU 58 3HD1 LEU 58 0.161 1.776 3.709 472 1HD2 LEU 58 1HD2 LEU 58 0.543 1.212 7.260 473 2HD2 LEU 58 2HD2 LEU 58 0.186 0.421 5.724 474 3HD2 LEU 58 3HD2 LEU 58 -0.806 1.770 6.274 475 H LEU 59 H LEU 59 4.469 2.060 8.399 476 HA LEU 59 HA LEU 59 2.787 1.372 10.521 477 1HB LEU 59 1HB LEU 59 4.820 0.155 10.026 478 2HB LEU 59 2HB LEU 59 5.793 1.564 10.400 479 HG LEU 59 HG LEU 59 4.048 0.670 12.592 480 1HD1 LEU 59 1HD1 LEU 59 5.859 -1.193 11.231 481 2HD1 LEU 59 2HD1 LEU 59 4.528 -1.507 12.346 482 3HD1 LEU 59 3HD1 LEU 59 6.113 -1.055 12.971 483 1HD2 LEU 59 1HD2 LEU 59 5.545 1.836 13.745 484 2HD2 LEU 59 2HD2 LEU 59 6.345 2.234 12.225 485 3HD2 LEU 59 3HD2 LEU 59 6.862 0.826 13.152 486 H LYS 60 H LYS 60 5.358 3.852 10.426 487 HA LYS 60 HA LYS 60 4.828 4.879 12.985 488 1HB LYS 60 1HB LYS 60 6.184 6.777 12.355 489 2HB LYS 60 2HB LYS 60 6.915 5.310 11.720 490 1HG LYS 60 1HG LYS 60 6.891 6.148 9.677 491 2HG LYS 60 2HG LYS 60 5.146 6.373 9.764 492 1HD LYS 60 1HD LYS 60 5.739 8.493 11.129 493 2HD LYS 60 2HD LYS 60 7.332 8.312 10.391 494 1HE LYS 60 1HE LYS 60 6.410 9.575 8.762 495 2HE LYS 60 2HE LYS 60 5.778 8.022 8.218 496 1HZ LYS 60 1HZ LYS 60 3.803 8.993 8.357 497 2HZ LYS 60 2HZ LYS 60 4.375 10.291 9.270 498 3HZ LYS 60 3HZ LYS 60 3.939 8.846 10.033 499 H PHE 61 H PHE 61 3.296 5.426 9.902 500 HA PHE 61 HA PHE 61 1.957 7.842 10.630 501 1HB PHE 61 1HB PHE 61 2.246 6.322 8.278 502 2HB PHE 61 2HB PHE 61 0.520 6.341 8.622 503 HD1 PHE 61 HD1 PHE 61 0.022 8.944 9.723 504 HD2 PHE 61 HD2 PHE 61 2.670 7.821 6.585 505 HE1 PHE 61 HE1 PHE 61 -0.140 11.211 8.780 506 HE2 PHE 61 HE2 PHE 61 2.515 10.087 5.639 507 HZ PHE 61 HZ PHE 61 1.110 11.785 6.737 508 H LEU 62 H LEU 62 0.999 4.422 10.541 509 HA LEU 62 HA LEU 62 -1.658 4.734 11.275 510 1HB LEU 62 1HB LEU 62 0.321 2.557 11.337 511 2HB LEU 62 2HB LEU 62 -1.033 2.368 12.437 512 HG LEU 62 HG LEU 62 -1.594 3.076 9.597 513 1HD1 LEU 62 1HD1 LEU 62 -1.657 0.232 9.954 514 2HD1 LEU 62 2HD1 LEU 62 -0.031 0.844 10.256 515 3HD1 LEU 62 3HD1 LEU 62 -0.832 1.190 8.724 516 1HD2 LEU 62 1HD2 LEU 62 -3.308 2.933 11.465 517 2HD2 LEU 62 2HD2 LEU 62 -3.040 1.195 11.430 518 3HD2 LEU 62 3HD2 LEU 62 -3.653 2.015 10.000 519 H LEU 63 H LEU 63 1.153 4.156 13.397 520 HA LEU 63 HA LEU 63 -0.398 4.405 15.778 521 1HB LEU 63 1HB LEU 63 2.477 4.092 15.127 522 2HB LEU 63 2HB LEU 63 2.086 4.773 16.694 523 HG LEU 63 HG LEU 63 2.405 2.424 16.974 524 1HD1 LEU 63 1HD1 LEU 63 0.002 1.702 17.578 525 2HD1 LEU 63 2HD1 LEU 63 -0.438 3.344 17.120 526 3HD1 LEU 63 3HD1 LEU 63 0.719 3.073 18.421 527 1HD2 LEU 63 1HD2 LEU 63 1.312 2.243 14.382 528 2HD2 LEU 63 2HD2 LEU 63 0.262 1.312 15.450 529 3HD2 LEU 63 3HD2 LEU 63 1.986 0.950 15.374 530 H ARG 64 H ARG 64 1.268 6.641 13.716 531 HA ARG 64 HA ARG 64 1.731 8.760 15.480 532 1HB ARG 64 1HB ARG 64 2.211 8.447 12.870 533 2HB ARG 64 2HB ARG 64 0.757 9.419 12.743 534 1HG ARG 64 1HG ARG 64 3.263 10.180 14.232 535 2HG ARG 64 2HG ARG 64 2.766 10.792 12.654 536 1HD ARG 64 1HD ARG 64 0.566 11.221 14.299 537 2HD ARG 64 2HD ARG 64 1.952 11.623 15.309 538 HE ARG 64 HE ARG 64 0.896 13.202 13.259 539 1HH1 ARG 64 1HH1 ARG 64 4.003 12.087 14.398 540 2HH1 ARG 64 2HH1 ARG 64 4.857 13.461 13.786 541 1HH2 ARG 64 1HH2 ARG 64 2.021 15.014 12.465 542 2HH2 ARG 64 2HH2 ARG 64 3.734 15.122 12.693 543 H GLU 65 H GLU 65 -1.149 8.010 13.548 544 HA GLU 65 HA GLU 65 -2.623 10.139 14.895 545 1HB GLU 65 1HB GLU 65 -3.165 8.417 12.496 546 2HB GLU 65 2HB GLU 65 -4.461 9.326 13.264 547 1HG GLU 65 1HG GLU 65 -1.922 10.505 12.155 548 2HG GLU 65 2HG GLU 65 -3.493 10.513 11.355 549 H LEU 66 H LEU 66 -2.347 6.678 14.833 550 HA LEU 66 HA LEU 66 -4.776 5.867 15.903 551 1HB LEU 66 1HB LEU 66 -2.097 4.797 15.662 552 2HB LEU 66 2HB LEU 66 -2.827 4.299 17.169 553 HG LEU 66 HG LEU 66 -4.627 3.218 16.025 554 1HD1 LEU 66 1HD1 LEU 66 -5.384 3.905 14.068 555 2HD1 LEU 66 2HD1 LEU 66 -3.890 3.382 13.296 556 3HD1 LEU 66 3HD1 LEU 66 -4.027 5.023 13.928 557 1HD2 LEU 66 1HD2 LEU 66 -3.309 1.457 15.784 558 2HD2 LEU 66 2HD2 LEU 66 -1.903 2.514 15.659 559 3HD2 LEU 66 3HD2 LEU 66 -2.796 2.061 14.207 560 H GLY 67 H GLY 67 -5.619 7.226 17.477 561 1HA GLY 67 1HA GLY 67 -4.058 8.059 19.750 562 2HA GLY 67 2HA GLY 67 -5.770 8.351 19.498 563 H THR 68 H THR 68 -4.618 5.107 19.254 564 HA THR 68 HA THR 68 -5.532 4.522 21.977 565 HB THR 68 HB THR 68 -6.836 2.684 21.279 566 HG1 THR 68 HG1 THR 68 -5.246 2.039 19.620 567 1HG2 THR 68 1HG2 THR 68 -8.525 3.570 19.977 568 2HG2 THR 68 2HG2 THR 68 -7.409 4.508 18.992 569 3HG2 THR 68 3HG2 THR 68 -7.751 5.004 20.645 570 H ALA 69 H ALA 69 -4.862 2.225 22.607 571 HA ALA 69 HA ALA 69 -2.257 1.885 22.967 572 1HB ALA 69 1HB ALA 69 -3.669 0.292 23.945 573 2HB ALA 69 2HB ALA 69 -2.647 -0.632 22.844 574 3HB ALA 69 3HB ALA 69 -4.302 -0.232 22.384 575 H GLY 70 H GLY 70 -3.750 0.094 20.250 576 1HA GLY 70 1HA GLY 70 -2.966 -0.028 18.040 577 2HA GLY 70 2HA GLY 70 -1.513 0.829 18.532 578 H ASN 71 H ASN 71 -2.961 -2.231 17.971 579 HA ASN 71 HA ASN 71 -0.406 -3.517 18.038 580 1HB ASN 71 1HB ASN 71 -1.857 -3.560 20.444 581 2HB ASN 71 2HB ASN 71 -2.075 -5.158 19.732 582 1HD2 ASN 71 1HD2 ASN 71 -0.829 -5.948 21.526 583 2HD2 ASN 71 2HD2 ASN 71 0.896 -5.856 21.483 584 H LEU 72 H LEU 72 -0.631 -5.905 17.502 585 HA LEU 72 HA LEU 72 -2.642 -6.127 15.409 586 1HB LEU 72 1HB LEU 72 -1.041 -8.490 15.576 587 2HB LEU 72 2HB LEU 72 -1.096 -7.285 14.307 588 HG LEU 72 HG LEU 72 0.518 -5.998 16.022 589 1HD1 LEU 72 1HD1 LEU 72 0.903 -8.932 16.570 590 2HD1 LEU 72 2HD1 LEU 72 0.586 -7.645 17.734 591 3HD1 LEU 72 3HD1 LEU 72 2.134 -7.712 16.892 592 1HD2 LEU 72 1HD2 LEU 72 2.213 -6.440 14.538 593 2HD2 LEU 72 2HD2 LEU 72 0.801 -6.868 13.573 594 3HD2 LEU 72 3HD2 LEU 72 1.756 -8.132 14.348 595 H GLU 73 H GLU 73 -4.570 -6.921 15.927 596 HA GLU 73 HA GLU 73 -4.735 -8.954 18.045 597 1HB GLU 73 1HB GLU 73 -6.589 -6.825 17.104 598 2HB GLU 73 2HB GLU 73 -7.310 -8.320 17.673 599 1HG GLU 73 1HG GLU 73 -5.700 -7.930 19.714 600 2HG GLU 73 2HG GLU 73 -5.784 -6.257 19.166 601 H GLY 74 H GLY 74 -6.037 -10.817 17.744 602 1HA GLY 74 1HA GLY 74 -6.917 -12.583 16.568 603 2HA GLY 74 2HA GLY 74 -7.337 -11.434 15.307 604 H GLY 75 H GLY 75 -6.771 -13.519 14.098 605 1HA GLY 75 1HA GLY 75 -4.078 -14.331 13.846 606 2HA GLY 75 2HA GLY 75 -5.358 -14.647 12.685 607 H ARG 76 H ARG 76 -5.949 -11.844 12.221 608 HA ARG 76 HA ARG 76 -3.766 -11.300 10.371 609 1HB ARG 76 1HB ARG 76 -6.304 -9.703 10.593 610 2HB ARG 76 2HB ARG 76 -5.267 -9.923 9.192 611 1HG ARG 76 1HG ARG 76 -6.656 -11.502 8.503 612 2HG ARG 76 2HG ARG 76 -6.129 -12.489 9.867 613 1HD ARG 76 1HD ARG 76 -8.099 -12.276 10.873 614 2HD ARG 76 2HD ARG 76 -8.064 -10.523 10.702 615 HE ARG 76 HE ARG 76 -9.173 -12.423 8.746 616 1HH1 ARG 76 1HH1 ARG 76 -8.875 -9.161 9.975 617 2HH1 ARG 76 2HH1 ARG 76 -10.113 -8.533 8.944 618 1HH2 ARG 76 1HH2 ARG 76 -10.803 -11.583 7.396 619 2HH2 ARG 76 2HH2 ARG 76 -11.203 -9.900 7.483 620 H ALA 77 H ALA 77 -4.457 -8.411 10.263 621 HA ALA 77 HA ALA 77 -2.976 -7.583 12.668 622 1HB ALA 77 1HB ALA 77 -2.693 -5.494 10.949 623 2HB ALA 77 2HB ALA 77 -2.752 -6.861 9.836 624 3HB ALA 77 3HB ALA 77 -1.544 -6.820 11.121 625 H ILE 78 H ILE 78 -5.030 -7.482 13.815 626 HA ILE 78 HA ILE 78 -6.840 -5.334 13.015 627 HB ILE 78 HB ILE 78 -7.066 -7.232 15.352 628 1HG1 ILE 78 1HG1 ILE 78 -8.649 -7.401 12.800 629 2HG1 ILE 78 2HG1 ILE 78 -7.094 -8.213 12.962 630 1HG2 ILE 78 1HG2 ILE 78 -8.560 -5.675 15.985 631 2HG2 ILE 78 2HG2 ILE 78 -9.585 -6.451 14.779 632 3HG2 ILE 78 3HG2 ILE 78 -8.689 -4.990 14.365 633 1HD1 ILE 78 1HD1 ILE 78 -8.032 -9.337 15.009 634 2HD1 ILE 78 2HD1 ILE 78 -8.748 -9.810 13.468 635 3HD1 ILE 78 3HD1 ILE 78 -9.604 -8.694 14.533 636 H LEU 79 H LEU 79 -5.696 -3.460 13.474 637 HA LEU 79 HA LEU 79 -4.722 -3.069 16.208 638 1HB LEU 79 1HB LEU 79 -3.722 -0.989 15.322 639 2HB LEU 79 2HB LEU 79 -3.171 -2.428 14.484 640 HG LEU 79 HG LEU 79 -5.089 -1.827 12.806 641 1HD1 LEU 79 1HD1 LEU 79 -6.135 -0.035 13.905 642 2HD1 LEU 79 2HD1 LEU 79 -5.197 0.700 12.606 643 3HD1 LEU 79 3HD1 LEU 79 -4.598 0.749 14.265 644 1HD2 LEU 79 1HD2 LEU 79 -3.489 -0.949 11.401 645 2HD2 LEU 79 2HD2 LEU 79 -2.498 -1.778 12.604 646 3HD2 LEU 79 3HD2 LEU 79 -2.713 -0.031 12.692 647 H GLN 80 H GLN 80 -5.014 -0.505 16.765 648 HA GLN 80 HA GLN 80 -7.811 0.202 16.292 649 1HB GLN 80 1HB GLN 80 -7.552 -1.137 18.432 650 2HB GLN 80 2HB GLN 80 -6.636 0.225 19.063 651 1HG GLN 80 1HG GLN 80 -8.697 1.625 18.431 652 2HG GLN 80 2HG GLN 80 -9.535 0.076 18.348 653 1HE2 GLN 80 1HE2 GLN 80 -9.091 -1.348 20.321 654 2HE2 GLN 80 2HE2 GLN 80 -9.201 -0.561 21.855 655 H GLY 81 H GLY 81 -8.270 2.373 16.339 656 1HA GLY 81 1HA GLY 81 -6.988 4.453 17.499 657 2HA GLY 81 2HA GLY 81 -6.007 4.148 16.085 658 H LYS 82 H LYS 82 -6.458 5.399 14.442 659 HA LYS 82 HA LYS 82 -9.257 6.139 13.936 660 1HB LYS 82 1HB LYS 82 -7.058 7.868 14.656 661 2HB LYS 82 2HB LYS 82 -7.689 8.297 13.072 662 1HG LYS 82 1HG LYS 82 -10.001 8.145 14.300 663 2HG LYS 82 2HG LYS 82 -9.006 8.409 15.735 664 1HD LYS 82 1HD LYS 82 -8.959 10.584 15.282 665 2HD LYS 82 2HD LYS 82 -8.132 10.236 13.762 666 1HE LYS 82 1HE LYS 82 -11.052 9.805 13.792 667 2HE LYS 82 2HE LYS 82 -10.510 11.479 13.912 668 1HZ LYS 82 1HZ LYS 82 -9.043 10.881 11.919 669 2HZ LYS 82 2HZ LYS 82 -10.695 11.118 11.646 670 3HZ LYS 82 3HZ LYS 82 -10.068 9.548 11.725 671 H PHE 83 H PHE 83 -6.806 4.439 12.760 672 HA PHE 83 HA PHE 83 -6.749 5.469 10.054 673 1HB PHE 83 1HB PHE 83 -5.193 3.607 11.644 674 2HB PHE 83 2HB PHE 83 -5.578 2.924 10.069 675 HD1 PHE 83 HD1 PHE 83 -4.302 3.466 8.242 676 HD2 PHE 83 HD2 PHE 83 -4.192 6.001 11.650 677 HE1 PHE 83 HE1 PHE 83 -2.485 4.759 7.206 678 HE2 PHE 83 HE2 PHE 83 -2.371 7.303 10.626 679 HZ PHE 83 HZ PHE 83 -1.516 6.683 8.401 680 H THR 84 H THR 84 -9.342 4.899 10.764 681 HA THR 84 HA THR 84 -10.152 2.286 9.963 682 HB THR 84 HB THR 84 -12.403 3.136 10.140 683 HG1 THR 84 HG1 THR 84 -12.436 5.060 9.162 684 1HG2 THR 84 1HG2 THR 84 -12.026 4.689 12.304 685 2HG2 THR 84 2HG2 THR 84 -10.459 3.885 12.211 686 3HG2 THR 84 3HG2 THR 84 -11.935 2.928 12.327 687 H HIS 85 H HIS 85 -8.790 2.329 8.001 688 HA HIS 85 HA HIS 85 -8.394 2.598 5.762 689 1HB HIS 85 1HB HIS 85 -10.289 2.014 4.352 690 2HB HIS 85 2HB HIS 85 -10.294 1.013 5.801 691 HD2 HIS 85 HD2 HIS 85 -12.617 1.093 7.218 692 HE1 HIS 85 HE1 HIS 85 -14.344 4.448 5.286 693 HE2 HIS 85 HE2 HIS 85 -14.598 2.754 7.126 694 H PHE 86 H PHE 86 -8.575 5.081 7.121 695 HA PHE 86 HA PHE 86 -10.081 6.825 5.338 696 1HB PHE 86 1HB PHE 86 -8.947 7.048 8.032 697 2HB PHE 86 2HB PHE 86 -8.697 8.484 7.042 698 HD1 PHE 86 HD1 PHE 86 -11.015 8.815 5.486 699 HD2 PHE 86 HD2 PHE 86 -10.713 7.345 9.468 700 HE1 PHE 86 HE1 PHE 86 -13.332 9.519 5.917 701 HE2 PHE 86 HE2 PHE 86 -13.031 8.049 9.907 702 HZ PHE 86 HZ PHE 86 -14.344 9.136 8.129 703 H LEU 87 H LEU 87 -6.853 7.226 6.718 704 HA LEU 87 HA LEU 87 -5.857 8.633 4.483 705 1HB LEU 87 1HB LEU 87 -5.013 8.038 7.090 706 2HB LEU 87 2HB LEU 87 -3.780 7.368 6.040 707 HG LEU 87 HG LEU 87 -3.234 9.645 6.757 708 1HD1 LEU 87 1HD1 LEU 87 -2.148 9.821 4.835 709 2HD1 LEU 87 2HD1 LEU 87 -3.616 10.382 4.035 710 3HD1 LEU 87 3HD1 LEU 87 -3.254 8.658 4.105 711 1HD2 LEU 87 1HD2 LEU 87 -5.989 10.114 6.041 712 2HD2 LEU 87 2HD2 LEU 87 -4.918 11.249 5.218 713 3HD2 LEU 87 3HD2 LEU 87 -4.883 11.120 6.975 714 H ILE 88 H ILE 88 -5.798 5.253 5.426 715 HA ILE 88 HA ILE 88 -3.837 4.357 3.627 716 HB ILE 88 HB ILE 88 -6.236 2.771 4.533 717 1HG1 ILE 88 1HG1 ILE 88 -3.582 3.124 5.959 718 2HG1 ILE 88 2HG1 ILE 88 -5.124 3.788 6.484 719 1HG2 ILE 88 1HG2 ILE 88 -3.983 2.152 2.909 720 2HG2 ILE 88 2HG2 ILE 88 -5.315 1.107 3.402 721 3HG2 ILE 88 3HG2 ILE 88 -3.872 1.226 4.407 722 1HD1 ILE 88 1HD1 ILE 88 -5.394 0.973 6.077 723 2HD1 ILE 88 2HD1 ILE 88 -5.602 1.915 7.553 724 3HD1 ILE 88 3HD1 ILE 88 -4.008 1.296 7.120 725 H ASN 89 H ASN 89 -7.362 4.011 3.344 726 HA ASN 89 HA ASN 89 -7.454 3.108 0.737 727 1HB ASN 89 1HB ASN 89 -9.398 3.019 2.145 728 2HB ASN 89 2HB ASN 89 -9.435 4.773 2.294 729 1HD2 ASN 89 1HD2 ASN 89 -10.956 5.683 1.147 730 2HD2 ASN 89 2HD2 ASN 89 -11.570 5.129 -0.370 731 H GLU 90 H GLU 90 -7.371 6.442 1.915 732 HA GLU 90 HA GLU 90 -7.872 7.724 -0.528 733 1HB GLU 90 1HB GLU 90 -7.989 8.900 1.598 734 2HB GLU 90 2HB GLU 90 -6.263 8.675 1.842 735 1HG GLU 90 1HG GLU 90 -5.923 10.620 0.852 736 2HG GLU 90 2HG GLU 90 -6.502 9.908 -0.652 737 H ARG 91 H ARG 91 -4.742 7.088 1.060 738 HA ARG 91 HA ARG 91 -3.151 8.102 -1.021 739 1HB ARG 91 1HB ARG 91 -2.477 7.523 1.368 740 2HB ARG 91 2HB ARG 91 -2.372 5.860 0.812 741 1HG ARG 91 1HG ARG 91 -0.194 6.984 0.865 742 2HG ARG 91 2HG ARG 91 -0.634 6.441 -0.755 743 1HD ARG 91 1HD ARG 91 0.360 8.714 -0.689 744 2HD ARG 91 2HD ARG 91 -1.256 8.670 -1.387 745 HE ARG 91 HE ARG 91 -2.088 9.548 0.728 746 1HH1 ARG 91 1HH1 ARG 91 1.354 9.823 0.161 747 2HH1 ARG 91 2HH1 ARG 91 1.547 11.143 1.262 748 1HH2 ARG 91 1HH2 ARG 91 -1.822 11.278 2.170 749 2HH2 ARG 91 2HH2 ARG 91 -0.250 11.967 2.402 750 H ILE 92 H ILE 92 -4.231 4.796 -0.297 751 HA ILE 92 HA ILE 92 -2.870 3.472 -2.328 752 HB ILE 92 HB ILE 92 -5.624 2.811 -1.270 753 1HG1 ILE 92 1HG1 ILE 92 -2.960 1.696 -0.379 754 2HG1 ILE 92 2HG1 ILE 92 -3.785 3.005 0.449 755 1HG2 ILE 92 1HG2 ILE 92 -4.368 0.454 -1.921 756 2HG2 ILE 92 2HG2 ILE 92 -3.887 1.536 -3.227 757 3HG2 ILE 92 3HG2 ILE 92 -5.597 1.271 -2.886 758 1HD1 ILE 92 1HD1 ILE 92 -5.140 0.386 -0.038 759 2HD1 ILE 92 2HD1 ILE 92 -5.513 1.622 1.163 760 3HD1 ILE 92 3HD1 ILE 92 -4.067 0.627 1.341 761 H GLU 93 H GLU 93 -6.250 4.639 -2.373 762 HA GLU 93 HA GLU 93 -6.782 4.084 -5.052 763 1HB GLU 93 1HB GLU 93 -8.688 5.500 -4.859 764 2HB GLU 93 2HB GLU 93 -8.467 4.717 -3.301 765 1HG GLU 93 1HG GLU 93 -8.709 6.763 -2.459 766 2HG GLU 93 2HG GLU 93 -7.043 7.002 -2.972 767 H ASP 94 H ASP 94 -4.938 6.635 -3.626 768 HA ASP 94 HA ASP 94 -5.066 8.479 -5.773 769 1HB ASP 94 1HB ASP 94 -4.191 8.739 -3.294 770 2HB ASP 94 2HB ASP 94 -2.648 8.304 -4.024 771 H TYR 95 H TYR 95 -2.819 5.870 -4.960 772 HA TYR 95 HA TYR 95 -1.225 6.357 -7.329 773 1HB TYR 95 1HB TYR 95 -0.056 5.717 -5.301 774 2HB TYR 95 2HB TYR 95 -1.014 4.245 -5.175 775 HD1 TYR 95 HD1 TYR 95 1.304 5.965 -7.550 776 HD2 TYR 95 HD2 TYR 95 -0.120 2.272 -5.990 777 HE1 TYR 95 HE1 TYR 95 2.987 4.761 -8.879 778 HE2 TYR 95 HE2 TYR 95 1.559 1.058 -7.314 779 HH TYR 95 HH TYR 95 3.088 2.213 -9.850 780 H VAL 96 H VAL 96 -3.152 3.646 -6.036 781 HA VAL 96 HA VAL 96 -2.942 2.026 -8.317 782 HB VAL 96 HB VAL 96 -3.718 1.201 -6.107 783 1HG1 VAL 96 1HG1 VAL 96 -6.409 2.348 -6.803 784 2HG1 VAL 96 2HG1 VAL 96 -5.270 3.180 -5.752 785 3HG1 VAL 96 3HG1 VAL 96 -5.895 1.599 -5.292 786 1HG2 VAL 96 1HG2 VAL 96 -5.970 0.461 -7.839 787 2HG2 VAL 96 2HG2 VAL 96 -4.736 -0.550 -7.087 788 3HG2 VAL 96 3HG2 VAL 96 -4.381 0.310 -8.585 789 H ASN 97 H ASN 97 -5.437 4.382 -7.362 790 HA ASN 97 HA ASN 97 -6.558 4.164 -10.070 791 1HB ASN 97 1HB ASN 97 -8.007 3.683 -7.984 792 2HB ASN 97 2HB ASN 97 -7.972 5.426 -7.731 793 1HD2 ASN 97 1HD2 ASN 97 -10.334 5.019 -7.971 794 2HD2 ASN 97 2HD2 ASN 97 -10.999 5.104 -9.564 795 H LYS 98 H LYS 98 -4.327 5.610 -10.045 796 HA LYS 98 HA LYS 98 -4.832 8.389 -9.489 797 1HB LYS 98 1HB LYS 98 -2.622 8.745 -10.585 798 2HB LYS 98 2HB LYS 98 -2.585 7.645 -9.218 799 1HG LYS 98 1HG LYS 98 -2.163 5.815 -10.518 800 2HG LYS 98 2HG LYS 98 -2.913 6.524 -11.947 801 1HD LYS 98 1HD LYS 98 -0.986 8.203 -11.897 802 2HD LYS 98 2HD LYS 98 -0.210 7.090 -10.770 803 1HE LYS 98 1HE LYS 98 -0.887 5.353 -12.683 804 2HE LYS 98 2HE LYS 98 -0.736 6.807 -13.669 805 1HZ LYS 98 1HZ LYS 98 1.435 6.477 -11.826 806 2HZ LYS 98 2HZ LYS 98 1.470 6.765 -13.491 807 3HZ LYS 98 3HZ LYS 98 1.305 5.185 -12.912 808 H PHE 99 H PHE 99 -5.908 6.413 -11.876 809 HA PHE 99 HA PHE 99 -5.470 7.985 -14.196 810 1HB PHE 99 1HB PHE 99 -6.094 5.556 -14.190 811 2HB PHE 99 2HB PHE 99 -7.716 6.026 -13.688 812 HD1 PHE 99 HD1 PHE 99 -5.516 5.508 -16.441 813 HD2 PHE 99 HD2 PHE 99 -9.023 7.585 -15.217 814 HE1 PHE 99 HE1 PHE 99 -6.151 5.815 -18.799 815 HE2 PHE 99 HE2 PHE 99 -9.665 7.895 -17.573 816 HZ PHE 99 HZ PHE 99 -8.228 7.010 -19.366 817 H VAL 100 H VAL 100 -8.335 7.576 -12.114 818 HA VAL 100 HA VAL 100 -9.703 9.752 -13.413 819 HB VAL 100 HB VAL 100 -10.922 7.778 -12.566 820 1HG1 VAL 100 1HG1 VAL 100 -11.280 7.415 -10.230 821 2HG1 VAL 100 2HG1 VAL 100 -10.389 8.879 -9.813 822 3HG1 VAL 100 3HG1 VAL 100 -9.540 7.498 -10.507 823 1HG2 VAL 100 1HG2 VAL 100 -12.668 9.144 -12.592 824 2HG2 VAL 100 2HG2 VAL 100 -11.616 10.520 -12.261 825 3HG2 VAL 100 3HG2 VAL 100 -12.327 9.613 -10.927 826 H ILE 101 H ILE 101 -7.866 9.307 -10.449 827 HA ILE 101 HA ILE 101 -8.703 11.848 -9.368 828 HB ILE 101 HB ILE 101 -8.182 10.006 -7.853 829 1HG1 ILE 101 1HG1 ILE 101 -6.021 11.599 -6.888 830 2HG1 ILE 101 2HG1 ILE 101 -7.192 12.671 -7.652 831 1HG2 ILE 101 1HG2 ILE 101 -6.326 8.782 -7.903 832 2HG2 ILE 101 2HG2 ILE 101 -5.283 10.192 -8.092 833 3HG2 ILE 101 3HG2 ILE 101 -6.082 9.489 -9.497 834 1HD1 ILE 101 1HD1 ILE 101 -7.472 10.952 -5.249 835 2HD1 ILE 101 2HD1 ILE 101 -8.900 11.265 -6.235 836 3HD1 ILE 101 3HD1 ILE 101 -8.007 12.609 -5.525 837 H CYS 102 H CYS 102 -5.652 10.553 -10.735 838 HA CYS 102 HA CYS 102 -4.569 13.257 -10.817 839 1HB CYS 102 1HB CYS 102 -3.283 11.065 -10.155 840 2HB CYS 102 2HB CYS 102 -3.100 10.881 -11.896 841 H HIS 103 H HIS 103 -6.656 11.708 -12.707 842 HA HIS 103 HA HIS 103 -7.309 11.829 -14.876 843 1HB HIS 103 1HB HIS 103 -5.599 14.300 -14.664 844 2HB HIS 103 2HB HIS 103 -6.452 13.885 -16.148 845 HD2 HIS 103 HD2 HIS 103 -7.128 16.392 -13.794 846 HE1 HIS 103 HE1 HIS 103 -10.876 14.401 -13.896 847 HE2 HIS 103 HE2 HIS 103 -9.637 16.470 -13.164 848 H GLU 104 H GLU 104 -5.364 9.977 -14.457 849 HA GLU 104 HA GLU 104 -3.800 8.687 -15.474 850 1HB GLU 104 1HB GLU 104 -5.649 9.049 -17.291 851 2HB GLU 104 2HB GLU 104 -4.407 10.008 -18.088 852 1HG GLU 104 1HG GLU 104 -2.896 7.993 -17.864 853 2HG GLU 104 2HG GLU 104 -4.335 7.086 -17.406 854 H CYS 105 H CYS 105 -2.152 9.981 -14.347 855 HA CYS 105 HA CYS 105 -0.771 12.042 -15.750 856 1HB CYS 105 1HB CYS 105 -0.858 11.362 -13.164 857 2HB CYS 105 2HB CYS 105 0.623 10.520 -13.611 858 H ASN 106 H ASN 106 -0.780 10.465 -17.722 859 HA ASN 106 HA ASN 106 1.242 8.453 -17.781 860 1HB ASN 106 1HB ASN 106 -0.786 9.500 -19.587 861 2HB ASN 106 2HB ASN 106 0.723 9.176 -20.430 862 1HD2 ASN 106 1HD2 ASN 106 -0.038 7.455 -21.564 863 2HD2 ASN 106 2HD2 ASN 106 -0.433 5.941 -20.831 864 H ARG 107 H ARG 107 1.431 10.663 -20.447 865 HA ARG 107 HA ARG 107 4.127 11.432 -19.572 866 1HB ARG 107 1HB ARG 107 3.105 11.592 -22.398 867 2HB ARG 107 2HB ARG 107 4.770 11.563 -21.840 868 1HG ARG 107 1HG ARG 107 3.044 9.200 -21.294 869 2HG ARG 107 2HG ARG 107 3.657 9.454 -22.929 870 1HD ARG 107 1HD ARG 107 5.651 8.674 -22.342 871 2HD ARG 107 2HD ARG 107 5.773 9.865 -21.051 872 HE ARG 107 HE ARG 107 4.791 8.287 -19.556 873 1HH1 ARG 107 1HH1 ARG 107 5.570 6.952 -22.697 874 2HH1 ARG 107 2HH1 ARG 107 5.578 5.319 -22.130 875 1HH2 ARG 107 1HH2 ARG 107 4.803 6.136 -18.826 876 2HH2 ARG 107 2HH2 ARG 107 5.142 4.855 -19.941 877 HA PRO 108 HA PRO 108 1.250 15.268 -19.579 878 1HB PRO 108 1HB PRO 108 2.920 15.755 -17.168 879 2HB PRO 108 2HB PRO 108 1.197 16.049 -17.424 880 1HG PRO 108 1HG PRO 108 2.042 13.983 -15.957 881 2HG PRO 108 2HG PRO 108 0.622 13.852 -17.010 882 1HD PRO 108 1HD PRO 108 3.369 12.762 -17.397 883 2HD PRO 108 2HD PRO 108 1.800 12.111 -17.905 884 H ASP 109 H ASP 109 1.875 17.262 -20.300 885 HA ASP 109 HA ASP 109 4.623 17.509 -21.185 886 1HB ASP 109 1HB ASP 109 2.685 18.099 -22.657 887 2HB ASP 109 2HB ASP 109 2.324 19.438 -21.571 888 H THR 110 H THR 110 3.917 17.692 -18.304 889 HA THR 110 HA THR 110 4.906 20.404 -17.777 890 HB THR 110 HB THR 110 3.871 19.521 -15.375 891 HG1 THR 110 HG1 THR 110 2.130 18.734 -17.473 892 1HG2 THR 110 1HG2 THR 110 1.884 20.913 -16.955 893 2HG2 THR 110 2HG2 THR 110 3.486 21.643 -17.080 894 3HG2 THR 110 3HG2 THR 110 2.743 21.420 -15.500 895 H ARG 111 H ARG 111 5.919 20.429 -15.446 896 HA ARG 111 HA ARG 111 8.134 18.563 -15.601 897 1HB ARG 111 1HB ARG 111 7.600 21.146 -14.216 898 2HB ARG 111 2HB ARG 111 8.810 20.075 -13.521 899 1HG ARG 111 1HG ARG 111 10.174 21.235 -14.890 900 2HG ARG 111 2HG ARG 111 9.620 20.042 -16.067 901 1HD ARG 111 1HD ARG 111 7.726 21.728 -16.543 902 2HD ARG 111 2HD ARG 111 8.764 22.892 -15.721 903 HE ARG 111 HE ARG 111 9.100 21.866 -18.356 904 1HH1 ARG 111 1HH1 ARG 111 10.847 23.013 -15.561 905 2HH1 ARG 111 2HH1 ARG 111 12.231 23.509 -16.475 906 1HH2 ARG 111 1HH2 ARG 111 10.920 22.516 -19.559 907 2HH2 ARG 111 2HH2 ARG 111 12.273 23.227 -18.745 908 H ILE 112 H ILE 112 7.867 16.685 -14.703 909 HA ILE 112 HA ILE 112 6.458 16.494 -12.122 910 HB ILE 112 HB ILE 112 7.001 14.158 -13.940 911 1HG1 ILE 112 1HG1 ILE 112 4.253 15.057 -14.013 912 2HG1 ILE 112 2HG1 ILE 112 5.325 16.340 -14.564 913 1HG2 ILE 112 1HG2 ILE 112 4.688 14.400 -12.082 914 2HG2 ILE 112 2HG2 ILE 112 6.287 14.088 -11.412 915 3HG2 ILE 112 3HG2 ILE 112 5.589 12.969 -12.582 916 1HD1 ILE 112 1HD1 ILE 112 4.746 13.698 -15.771 917 2HD1 ILE 112 2HD1 ILE 112 6.359 14.377 -15.988 918 3HD1 ILE 112 3HD1 ILE 112 4.943 15.278 -16.531 919 H ILE 113 H ILE 113 7.397 15.387 -10.422 920 HA ILE 113 HA ILE 113 10.120 14.362 -10.804 921 HB ILE 113 HB ILE 113 10.832 15.507 -8.694 922 1HG1 ILE 113 1HG1 ILE 113 8.653 17.507 -9.058 923 2HG1 ILE 113 2HG1 ILE 113 8.246 16.010 -8.225 924 1HG2 ILE 113 1HG2 ILE 113 10.018 17.380 -10.910 925 2HG2 ILE 113 2HG2 ILE 113 11.433 16.328 -10.946 926 3HG2 ILE 113 3HG2 ILE 113 11.324 17.619 -9.750 927 1HD1 ILE 113 1HD1 ILE 113 9.367 16.595 -6.378 928 2HD1 ILE 113 2HD1 ILE 113 9.217 18.228 -7.025 929 3HD1 ILE 113 3HD1 ILE 113 10.699 17.309 -7.285 930 H ARG 114 H ARG 114 10.577 12.579 -9.581 931 HA ARG 114 HA ARG 114 8.746 11.929 -7.389 932 1HB ARG 114 1HB ARG 114 8.622 9.583 -8.082 933 2HB ARG 114 2HB ARG 114 7.926 10.653 -9.278 934 1HG ARG 114 1HG ARG 114 10.708 9.541 -9.478 935 2HG ARG 114 2HG ARG 114 9.289 8.760 -10.173 936 1HD ARG 114 1HD ARG 114 9.140 10.239 -11.868 937 2HD ARG 114 2HD ARG 114 9.635 11.602 -10.870 938 HE ARG 114 HE ARG 114 11.870 10.012 -11.182 939 1HH1 ARG 114 1HH1 ARG 114 9.751 11.878 -13.240 940 2HH1 ARG 114 2HH1 ARG 114 10.954 12.113 -14.464 941 1HH2 ARG 114 1HH2 ARG 114 13.436 10.318 -12.782 942 2HH2 ARG 114 2HH2 ARG 114 13.046 11.224 -14.206 943 H GLU 115 H GLU 115 9.681 11.162 -5.619 944 HA GLU 115 HA GLU 115 12.480 10.275 -5.809 945 1HB GLU 115 1HB GLU 115 11.856 11.544 -3.267 946 2HB GLU 115 2HB GLU 115 13.189 11.843 -4.372 947 1HG GLU 115 1HG GLU 115 12.098 13.542 -5.456 948 2HG GLU 115 2HG GLU 115 10.500 12.917 -5.060 949 H GLY 116 H GLY 116 13.051 8.538 -4.583 950 1HA GLY 116 1HA GLY 116 12.759 7.076 -2.699 951 2HA GLY 116 2HA GLY 116 11.046 7.467 -2.713 952 H ARG 117 H ARG 117 12.576 6.815 -5.747 953 HA ARG 117 HA ARG 117 12.291 5.150 -7.274 954 1HB ARG 117 1HB ARG 117 12.363 3.535 -4.729 955 2HB ARG 117 2HB ARG 117 12.283 2.792 -6.320 956 1HG ARG 117 1HG ARG 117 14.534 2.754 -5.958 957 2HG ARG 117 2HG ARG 117 14.376 4.307 -6.780 958 1HD ARG 117 1HD ARG 117 14.912 5.485 -4.933 959 2HD ARG 117 2HD ARG 117 14.040 4.391 -3.859 960 HE ARG 117 HE ARG 117 16.232 2.972 -4.667 961 1HH1 ARG 117 1HH1 ARG 117 15.718 6.044 -3.092 962 2HH1 ARG 117 2HH1 ARG 117 17.209 5.986 -2.214 963 1HH2 ARG 117 1HH2 ARG 117 18.195 2.894 -3.511 964 2HH2 ARG 117 2HH2 ARG 117 18.615 4.199 -2.452 965 H ILE 118 H ILE 118 10.093 6.367 -7.329 966 HA ILE 118 HA ILE 118 7.884 6.207 -7.853 967 HB ILE 118 HB ILE 118 8.126 3.238 -7.371 968 1HG1 ILE 118 1HG1 ILE 118 8.590 4.826 -9.906 969 2HG1 ILE 118 2HG1 ILE 118 9.817 3.960 -8.987 970 1HG2 ILE 118 1HG2 ILE 118 5.964 4.961 -8.144 971 2HG2 ILE 118 2HG2 ILE 118 5.951 3.229 -7.813 972 3HG2 ILE 118 3HG2 ILE 118 6.321 3.814 -9.435 973 1HD1 ILE 118 1HD1 ILE 118 7.782 2.948 -10.862 974 2HD1 ILE 118 2HD1 ILE 118 8.128 1.946 -9.452 975 3HD1 ILE 118 3HD1 ILE 118 9.427 2.393 -10.556 976 H SER 119 H SER 119 8.231 7.156 -5.462 977 HA SER 119 HA SER 119 6.157 5.855 -3.845 978 1HB SER 119 1HB SER 119 8.779 5.684 -3.124 979 2HB SER 119 2HB SER 119 8.297 7.162 -2.292 980 HG SER 119 HG SER 119 7.861 5.459 -0.937 981 H LEU 120 H LEU 120 8.006 8.775 -4.559 982 HA LEU 120 HA LEU 120 5.694 10.365 -3.663 983 1HB LEU 120 1HB LEU 120 8.618 10.817 -3.177 984 2HB LEU 120 2HB LEU 120 7.496 12.160 -3.206 985 HG LEU 120 HG LEU 120 7.050 9.808 -1.395 986 1HD1 LEU 120 1HD1 LEU 120 9.143 10.422 -0.634 987 2HD1 LEU 120 2HD1 LEU 120 8.079 11.427 0.350 988 3HD1 LEU 120 3HD1 LEU 120 8.909 12.121 -1.043 989 1HD2 LEU 120 1HD2 LEU 120 5.235 11.481 -1.872 990 2HD2 LEU 120 2HD2 LEU 120 6.251 12.695 -1.093 991 3HD2 LEU 120 3HD2 LEU 120 5.672 11.306 -0.172 992 H LEU 121 H LEU 121 5.485 12.463 -4.741 993 HA LEU 121 HA LEU 121 7.000 13.233 -6.963 994 1HB LEU 121 1HB LEU 121 6.098 11.151 -7.932 995 2HB LEU 121 2HB LEU 121 4.470 11.732 -7.653 996 HG LEU 121 HG LEU 121 6.054 13.584 -9.266 997 1HD1 LEU 121 1HD1 LEU 121 6.820 12.281 -10.901 998 2HD1 LEU 121 2HD1 LEU 121 5.313 11.369 -10.976 999 3HD1 LEU 121 3HD1 LEU 121 6.556 10.916 -9.819 1000 1HD2 LEU 121 1HD2 LEU 121 3.349 12.397 -9.187 1001 2HD2 LEU 121 2HD2 LEU 121 3.940 12.930 -10.763 1002 3HD2 LEU 121 3HD2 LEU 121 3.850 14.072 -9.423 1003 H LYS 122 H LYS 122 6.073 15.069 -8.107 1004 HA LYS 122 HA LYS 122 3.911 16.363 -6.579 1005 1HB LYS 122 1HB LYS 122 6.485 17.256 -6.870 1006 2HB LYS 122 2HB LYS 122 5.652 18.121 -8.156 1007 1HG LYS 122 1HG LYS 122 3.919 18.579 -6.198 1008 2HG LYS 122 2HG LYS 122 5.367 18.347 -5.218 1009 1HD LYS 122 1HD LYS 122 6.495 20.130 -6.306 1010 2HD LYS 122 2HD LYS 122 5.266 20.227 -7.569 1011 1HE LYS 122 1HE LYS 122 3.967 20.538 -5.065 1012 2HE LYS 122 2HE LYS 122 5.377 21.594 -5.070 1013 1HZ LYS 122 1HZ LYS 122 2.918 21.846 -6.505 1014 2HZ LYS 122 2HZ LYS 122 4.258 21.952 -7.530 1015 3HZ LYS 122 3HZ LYS 122 4.120 23.003 -6.216 1016 H CYS 123 H CYS 123 2.299 17.505 -7.703 1017 HA CYS 123 HA CYS 123 2.371 17.382 -10.623 1018 1HB CYS 123 1HB CYS 123 0.276 16.124 -8.874 1019 2HB CYS 123 2HB CYS 123 -0.109 16.655 -10.504 1020 H GLU 124 H GLU 124 2.851 19.658 -9.477 1021 HA GLU 124 HA GLU 124 0.842 21.306 -8.541 1022 1HB GLU 124 1HB GLU 124 3.358 21.748 -8.857 1023 2HB GLU 124 2HB GLU 124 2.931 22.256 -10.479 1024 1HG GLU 124 1HG GLU 124 1.155 23.664 -8.969 1025 2HG GLU 124 2HG GLU 124 2.582 23.630 -7.932 1026 H ALA 125 H ALA 125 1.458 20.199 -11.779 1027 HA ALA 125 HA ALA 125 -0.199 22.148 -13.065 1028 1HB ALA 125 1HB ALA 125 0.077 20.400 -14.995 1029 2HB ALA 125 2HB ALA 125 1.312 19.735 -13.926 1030 3HB ALA 125 3HB ALA 125 1.428 21.405 -14.478 1031 H CYS 126 H CYS 126 -0.566 18.628 -13.362 1032 HA CYS 126 HA CYS 126 -3.394 18.895 -13.685 1033 1HB CYS 126 1HB CYS 126 -3.399 16.457 -13.863 1034 2HB CYS 126 2HB CYS 126 -2.110 17.146 -14.843 1035 H GLY 127 H GLY 127 -3.203 20.115 -11.445 1036 1HA GLY 127 1HA GLY 127 -4.574 19.936 -9.501 1037 2HA GLY 127 2HA GLY 127 -4.215 18.217 -9.447 1038 H ALA 128 H ALA 128 -3.029 17.714 -7.751 1039 HA ALA 128 HA ALA 128 -0.603 19.188 -7.175 1040 1HB ALA 128 1HB ALA 128 -1.410 20.386 -5.490 1041 2HB ALA 128 2HB ALA 128 -1.774 18.887 -4.635 1042 3HB ALA 128 3HB ALA 128 -2.996 19.636 -5.665 1043 H LYS 129 H LYS 129 0.862 18.025 -5.847 1044 HA LYS 129 HA LYS 129 0.100 15.365 -4.969 1045 1HB LYS 129 1HB LYS 129 1.212 15.654 -7.484 1046 2HB LYS 129 2HB LYS 129 2.586 15.237 -6.483 1047 1HG LYS 129 1HG LYS 129 1.986 13.121 -6.789 1048 2HG LYS 129 2HG LYS 129 0.672 13.449 -5.658 1049 1HD LYS 129 1HD LYS 129 -0.516 14.335 -7.848 1050 2HD LYS 129 2HD LYS 129 0.625 13.237 -8.624 1051 1HE LYS 129 1HE LYS 129 -1.105 11.795 -8.290 1052 2HE LYS 129 2HE LYS 129 -0.248 11.581 -6.764 1053 1HZ LYS 129 1HZ LYS 129 -2.806 12.874 -7.294 1054 2HZ LYS 129 2HZ LYS 129 -1.833 13.581 -6.105 1055 3HZ LYS 129 3HZ LYS 129 -2.308 11.964 -5.956 1056 H ALA 130 H ALA 130 1.613 14.390 -3.555 1057 HA ALA 130 HA ALA 130 3.079 16.320 -1.989 1058 1HB ALA 130 1HB ALA 130 2.658 14.933 -0.300 1059 2HB ALA 130 2HB ALA 130 3.343 13.554 -1.155 1060 3HB ALA 130 3HB ALA 130 1.665 14.018 -1.429 1061 HA PRO 131 HA PRO 131 6.856 15.229 -4.250 1062 1HB PRO 131 1HB PRO 131 8.407 17.173 -3.154 1063 2HB PRO 131 2HB PRO 131 7.289 17.465 -4.489 1064 1HG PRO 131 1HG PRO 131 6.952 18.029 -1.576 1065 2HG PRO 131 2HG PRO 131 6.470 19.007 -2.972 1066 1HD PRO 131 1HD PRO 131 4.730 17.462 -1.562 1067 2HD PRO 131 2HD PRO 131 4.524 17.831 -3.283 1068 H LEU 132 H LEU 132 7.167 16.270 -0.847 1069 HA LEU 132 HA LEU 132 7.971 13.824 0.200 1070 1HB LEU 132 1HB LEU 132 9.931 14.078 -1.274 1071 2HB LEU 132 2HB LEU 132 10.317 15.598 -0.493 1072 HG LEU 132 HG LEU 132 10.092 13.466 1.456 1073 1HD1 LEU 132 1HD1 LEU 132 10.792 11.910 -0.160 1074 2HD1 LEU 132 2HD1 LEU 132 12.257 12.363 0.713 1075 3HD1 LEU 132 3HD1 LEU 132 11.933 13.045 -0.880 1076 1HD2 LEU 132 1HD2 LEU 132 12.233 15.404 0.614 1077 2HD2 LEU 132 2HD2 LEU 132 12.442 14.250 1.931 1078 3HD2 LEU 132 3HD2 LEU 132 11.185 15.483 2.030 1079 H LYS 133 H LYS 133 7.947 17.288 0.324 1080 HA LYS 133 HA LYS 133 7.886 17.139 3.259 1081 1HB LYS 133 1HB LYS 133 9.366 19.090 1.511 1082 2HB LYS 133 2HB LYS 133 8.904 19.506 3.156 1083 1HG LYS 133 1HG LYS 133 10.093 17.189 3.666 1084 2HG LYS 133 2HG LYS 133 10.949 17.602 2.179 1085 1HD LYS 133 1HD LYS 133 12.189 19.119 3.235 1086 2HD LYS 133 2HD LYS 133 10.759 19.895 3.916 1087 1HE LYS 133 1HE LYS 133 11.840 17.348 5.069 1088 2HE LYS 133 2HE LYS 133 12.516 18.910 5.525 1089 1HZ LYS 133 1HZ LYS 133 10.207 17.673 6.504 1090 2HZ LYS 133 2HZ LYS 133 9.725 19.075 5.691 1091 3HZ LYS 133 3HZ LYS 133 10.856 19.172 6.944 1092 H ASN 134 H ASN 134 5.619 17.025 1.637 1093 HA ASN 134 HA ASN 134 4.447 19.616 1.314 1094 1HB ASN 134 1HB ASN 134 2.365 18.373 0.850 1095 2HB ASN 134 2HB ASN 134 3.721 17.741 -0.077 1096 1HD2 ASN 134 1HD2 ASN 134 1.090 16.705 1.236 1097 2HD2 ASN 134 2HD2 ASN 134 1.585 15.194 1.912 1098 H VAL 135 H VAL 135 3.237 20.774 2.705 1099 HA VAL 135 HA VAL 135 3.152 19.931 5.455 1100 HB VAL 135 HB VAL 135 3.617 22.274 4.868 1101 1HG1 VAL 135 1HG1 VAL 135 0.996 23.247 4.384 1102 2HG1 VAL 135 2HG1 VAL 135 1.328 21.972 3.213 1103 3HG1 VAL 135 3HG1 VAL 135 2.417 23.350 3.347 1104 1HG2 VAL 135 1HG2 VAL 135 2.103 21.333 6.936 1105 2HG2 VAL 135 2HG2 VAL 135 1.088 22.625 6.295 1106 3HG2 VAL 135 3HG2 VAL 135 2.740 22.973 6.805 Start of MODEL 12 1 H MET 1 H MET 1 5.688 -10.696 -13.768 2 HA MET 1 HA MET 1 7.057 -12.621 -12.174 3 1HB MET 1 1HB MET 1 6.323 -11.695 -10.028 4 2HB MET 1 2HB MET 1 7.471 -10.620 -10.815 5 1HG MET 1 1HG MET 1 4.670 -10.050 -11.433 6 2HG MET 1 2HG MET 1 5.095 -9.864 -9.732 7 1HE MET 1 1HE MET 1 4.616 -7.423 -12.636 8 2HE MET 1 2HE MET 1 4.919 -6.298 -11.311 9 3HE MET 1 3HE MET 1 3.909 -7.720 -11.048 10 H ASP 2 H ASP 2 5.300 -13.582 -10.656 11 HA ASP 2 HA ASP 2 2.861 -13.850 -12.266 12 1HB ASP 2 1HB ASP 2 4.540 -15.768 -11.185 13 2HB ASP 2 2HB ASP 2 3.182 -15.746 -10.065 14 H ASP 3 H ASP 3 0.849 -14.379 -10.947 15 HA ASP 3 HA ASP 3 0.533 -12.286 -8.948 16 1HB ASP 3 1HB ASP 3 -1.486 -14.094 -10.295 17 2HB ASP 3 2HB ASP 3 -1.894 -12.836 -9.131 18 H TYR 4 H TYR 4 0.082 -15.790 -9.247 19 HA TYR 4 HA TYR 4 -0.674 -16.118 -6.504 20 1HB TYR 4 1HB TYR 4 -0.639 -17.735 -8.847 21 2HB TYR 4 2HB TYR 4 0.284 -18.573 -7.603 22 HD1 TYR 4 HD1 TYR 4 -2.868 -16.560 -7.725 23 HD2 TYR 4 HD2 TYR 4 -0.936 -20.117 -6.417 24 HE1 TYR 4 HE1 TYR 4 -4.965 -17.307 -6.681 25 HE2 TYR 4 HE2 TYR 4 -3.028 -20.877 -5.372 26 HH TYR 4 HH TYR 4 -6.043 -19.260 -5.904 27 H GLU 5 H GLU 5 0.937 -15.266 -5.222 28 HA GLU 5 HA GLU 5 3.678 -16.099 -5.537 29 1HB GLU 5 1HB GLU 5 2.369 -13.961 -4.290 30 2HB GLU 5 2HB GLU 5 3.086 -14.888 -2.982 31 1HG GLU 5 1HG GLU 5 4.496 -13.682 -5.342 32 2HG GLU 5 2HG GLU 5 4.636 -13.217 -3.651 33 H LYS 6 H LYS 6 4.118 -18.153 -5.078 34 HA LYS 6 HA LYS 6 3.008 -19.295 -2.602 35 1HB LYS 6 1HB LYS 6 3.653 -21.519 -3.716 36 2HB LYS 6 2HB LYS 6 2.246 -20.667 -4.336 37 1HG LYS 6 1HG LYS 6 3.950 -19.655 -6.027 38 2HG LYS 6 2HG LYS 6 4.928 -21.052 -5.580 39 1HD LYS 6 1HD LYS 6 2.251 -21.918 -6.052 40 2HD LYS 6 2HD LYS 6 2.769 -20.919 -7.411 41 1HE LYS 6 1HE LYS 6 4.512 -22.340 -7.959 42 2HE LYS 6 2HE LYS 6 4.578 -23.049 -6.347 43 1HZ LYS 6 1HZ LYS 6 3.195 -23.975 -8.606 44 2HZ LYS 6 2HZ LYS 6 2.056 -23.591 -7.417 45 3HZ LYS 6 3HZ LYS 6 3.299 -24.686 -7.074 46 H LEU 7 H LEU 7 4.358 -20.386 -1.180 47 HA LEU 7 HA LEU 7 7.018 -19.413 -1.017 48 1HB LEU 7 1HB LEU 7 7.192 -21.086 0.879 49 2HB LEU 7 2HB LEU 7 5.963 -19.847 1.033 50 HG LEU 7 HG LEU 7 4.908 -22.241 -0.231 51 1HD1 LEU 7 1HD1 LEU 7 6.010 -22.526 2.561 52 2HD1 LEU 7 2HD1 LEU 7 6.624 -23.346 1.125 53 3HD1 LEU 7 3HD1 LEU 7 4.999 -23.696 1.714 54 1HD2 LEU 7 1HD2 LEU 7 3.201 -21.031 0.587 55 2HD2 LEU 7 2HD2 LEU 7 4.198 -20.270 1.826 56 3HD2 LEU 7 3HD2 LEU 7 3.546 -21.887 2.090 57 H LEU 8 H LEU 8 8.774 -20.145 -1.991 58 HA LEU 8 HA LEU 8 8.738 -22.853 -3.130 59 1HB LEU 8 1HB LEU 8 10.539 -20.522 -3.796 60 2HB LEU 8 2HB LEU 8 10.520 -22.073 -4.612 61 HG LEU 8 HG LEU 8 7.908 -21.260 -4.863 62 1HD1 LEU 8 1HD1 LEU 8 9.110 -18.986 -4.006 63 2HD1 LEU 8 2HD1 LEU 8 7.681 -19.035 -5.039 64 3HD1 LEU 8 3HD1 LEU 8 9.279 -18.824 -5.754 65 1HD2 LEU 8 1HD2 LEU 8 8.359 -21.154 -7.140 66 2HD2 LEU 8 2HD2 LEU 8 9.639 -22.201 -6.525 67 3HD2 LEU 8 3HD2 LEU 8 9.981 -20.509 -6.889 68 H GLU 9 H GLU 9 10.527 -20.683 -1.041 69 HA GLU 9 HA GLU 9 12.246 -21.002 0.406 70 1HB GLU 9 1HB GLU 9 10.746 -23.539 0.410 71 2HB GLU 9 2HB GLU 9 12.383 -23.646 1.040 72 1HG GLU 9 1HG GLU 9 11.076 -23.214 2.909 73 2HG GLU 9 2HG GLU 9 11.769 -21.646 2.498 74 H ARG 10 H ARG 10 13.123 -20.780 -2.117 75 HA ARG 10 HA ARG 10 15.023 -22.959 -2.583 76 1HB ARG 10 1HB ARG 10 13.462 -21.633 -4.352 77 2HB ARG 10 2HB ARG 10 14.928 -20.669 -4.453 78 1HG ARG 10 1HG ARG 10 16.151 -22.879 -4.807 79 2HG ARG 10 2HG ARG 10 14.554 -23.574 -5.089 80 1HD ARG 10 1HD ARG 10 14.186 -22.236 -6.982 81 2HD ARG 10 2HD ARG 10 15.492 -21.132 -6.557 82 HE ARG 10 HE ARG 10 17.012 -22.587 -7.499 83 1HH1 ARG 10 1HH1 ARG 10 13.872 -24.112 -7.333 84 2HH1 ARG 10 2HH1 ARG 10 14.324 -25.431 -8.359 85 1HH2 ARG 10 1HH2 ARG 10 17.601 -24.321 -8.844 86 2HH2 ARG 10 2HH2 ARG 10 16.440 -25.550 -9.216 87 H ALA 11 H ALA 11 16.440 -22.465 -0.864 88 HA ALA 11 HA ALA 11 18.295 -21.561 0.072 89 1HB ALA 11 1HB ALA 11 19.242 -19.781 -1.918 90 2HB ALA 11 2HB ALA 11 18.601 -21.210 -2.726 91 3HB ALA 11 3HB ALA 11 19.851 -21.381 -1.494 92 H ILE 12 H ILE 12 15.662 -20.142 0.122 93 HA ILE 12 HA ILE 12 16.420 -17.351 0.398 94 HB ILE 12 HB ILE 12 14.223 -17.924 -0.567 95 1HG1 ILE 12 1HG1 ILE 12 12.827 -16.460 0.935 96 2HG1 ILE 12 2HG1 ILE 12 14.164 -16.463 2.079 97 1HG2 ILE 12 1HG2 ILE 12 13.513 -18.949 2.174 98 2HG2 ILE 12 2HG2 ILE 12 13.864 -19.969 0.782 99 3HG2 ILE 12 3HG2 ILE 12 12.468 -18.894 0.755 100 1HD1 ILE 12 1HD1 ILE 12 14.006 -14.465 0.573 101 2HD1 ILE 12 2HD1 ILE 12 14.445 -15.534 -0.760 102 3HD1 ILE 12 3HD1 ILE 12 15.564 -15.293 0.582 103 H ASP 13 H ASP 13 16.191 -20.164 2.320 104 HA ASP 13 HA ASP 13 17.187 -18.848 4.631 105 1HB ASP 13 1HB ASP 13 14.635 -18.359 4.590 106 2HB ASP 13 2HB ASP 13 14.468 -20.042 5.078 107 H GLN 14 H GLN 14 15.911 -21.684 3.055 108 HA GLN 14 HA GLN 14 16.652 -23.551 5.091 109 1HB GLN 14 1HB GLN 14 15.146 -23.606 2.729 110 2HB GLN 14 2HB GLN 14 16.490 -24.700 2.438 111 1HG GLN 14 1HG GLN 14 15.408 -25.165 5.049 112 2HG GLN 14 2HG GLN 14 14.122 -25.207 3.843 113 1HE2 GLN 14 1HE2 GLN 14 14.982 -27.426 5.337 114 2HE2 GLN 14 2HE2 GLN 14 15.663 -28.579 4.246 115 H LEU 15 H LEU 15 18.147 -22.357 2.126 116 HA LEU 15 HA LEU 15 20.543 -23.964 2.703 117 1HB LEU 15 1HB LEU 15 19.412 -22.770 0.199 118 2HB LEU 15 2HB LEU 15 21.113 -23.159 0.284 119 HG LEU 15 HG LEU 15 18.895 -25.147 0.750 120 1HD1 LEU 15 1HD1 LEU 15 20.623 -25.069 -1.684 121 2HD1 LEU 15 2HD1 LEU 15 19.155 -24.096 -1.599 122 3HD1 LEU 15 3HD1 LEU 15 19.061 -25.851 -1.444 123 1HD2 LEU 15 1HD2 LEU 15 21.531 -26.101 -0.051 124 2HD2 LEU 15 2HD2 LEU 15 20.460 -26.665 1.233 125 3HD2 LEU 15 3HD2 LEU 15 21.524 -25.288 1.514 126 HA PRO 16 HA PRO 16 23.304 -20.654 3.668 127 1HB PRO 16 1HB PRO 16 24.836 -20.369 1.316 128 2HB PRO 16 2HB PRO 16 25.228 -21.371 2.716 129 1HG PRO 16 1HG PRO 16 23.923 -22.130 0.144 130 2HG PRO 16 2HG PRO 16 25.069 -23.051 1.137 131 1HD PRO 16 1HD PRO 16 22.493 -23.674 1.146 132 2HD PRO 16 2HD PRO 16 23.410 -23.683 2.665 133 HA PRO 17 HA PRO 17 21.491 -16.932 2.192 134 1HB PRO 17 1HB PRO 17 23.563 -15.158 2.552 135 2HB PRO 17 2HB PRO 17 22.507 -15.737 3.844 136 1HG PRO 17 1HG PRO 17 25.238 -16.681 3.066 137 2HG PRO 17 2HG PRO 17 24.562 -16.419 4.685 138 1HD PRO 17 1HD PRO 17 24.772 -18.878 3.630 139 2HD PRO 17 2HD PRO 17 23.399 -18.424 4.660 140 H GLU 18 H GLU 18 24.714 -15.923 1.255 141 HA GLU 18 HA GLU 18 25.523 -15.157 -0.723 142 1HB GLU 18 1HB GLU 18 24.703 -17.939 -1.095 143 2HB GLU 18 2HB GLU 18 24.853 -17.042 -2.601 144 1HG GLU 18 1HG GLU 18 26.991 -17.688 -2.454 145 2HG GLU 18 2HG GLU 18 27.123 -16.284 -1.395 146 H VAL 19 H VAL 19 22.900 -16.806 -2.424 147 HA VAL 19 HA VAL 19 22.157 -14.263 -3.619 148 HB VAL 19 HB VAL 19 22.500 -16.290 -5.022 149 1HG1 VAL 19 1HG1 VAL 19 19.906 -17.258 -3.834 150 2HG1 VAL 19 2HG1 VAL 19 21.497 -17.908 -3.438 151 3HG1 VAL 19 3HG1 VAL 19 20.869 -18.052 -5.080 152 1HG2 VAL 19 1HG2 VAL 19 19.778 -15.001 -5.105 153 2HG2 VAL 19 2HG2 VAL 19 20.453 -15.981 -6.401 154 3HG2 VAL 19 3HG2 VAL 19 21.239 -14.474 -5.936 155 H PHE 20 H PHE 20 21.470 -15.020 -0.803 156 HA PHE 20 HA PHE 20 18.646 -15.410 -0.700 157 1HB PHE 20 1HB PHE 20 18.865 -15.260 1.644 158 2HB PHE 20 2HB PHE 20 20.349 -16.021 1.092 159 HD1 PHE 20 HD1 PHE 20 22.009 -13.795 0.245 160 HD2 PHE 20 HD2 PHE 20 19.342 -14.076 3.551 161 HE1 PHE 20 HE1 PHE 20 23.312 -12.088 1.434 162 HE2 PHE 20 HE2 PHE 20 20.642 -12.366 4.746 163 HZ PHE 20 HZ PHE 20 22.630 -11.369 3.689 164 H GLU 21 H GLU 21 17.031 -13.960 -0.537 165 HA GLU 21 HA GLU 21 17.680 -11.128 -0.199 166 1HB GLU 21 1HB GLU 21 17.195 -12.153 -2.702 167 2HB GLU 21 2HB GLU 21 15.598 -11.602 -2.213 168 1HG GLU 21 1HG GLU 21 16.339 -9.377 -1.947 169 2HG GLU 21 2HG GLU 21 18.033 -9.854 -2.044 170 H THR 22 H THR 22 15.276 -9.971 -0.419 171 HA THR 22 HA THR 22 13.891 -10.971 1.901 172 HB THR 22 HB THR 22 14.212 -8.567 1.592 173 HG1 THR 22 HG1 THR 22 11.513 -8.531 1.296 174 1HG2 THR 22 1HG2 THR 22 13.336 -9.064 -1.059 175 2HG2 THR 22 2HG2 THR 22 13.939 -7.564 -0.352 176 3HG2 THR 22 3HG2 THR 22 12.215 -7.930 -0.303 177 H LYS 23 H LYS 23 11.295 -10.608 1.607 178 HA LYS 23 HA LYS 23 10.486 -12.804 -0.043 179 1HB LYS 23 1HB LYS 23 8.711 -10.851 1.423 180 2HB LYS 23 2HB LYS 23 8.288 -12.470 0.885 181 1HG LYS 23 1HG LYS 23 10.587 -12.586 2.591 182 2HG LYS 23 2HG LYS 23 9.293 -11.687 3.382 183 1HD LYS 23 1HD LYS 23 7.809 -13.498 3.268 184 2HD LYS 23 2HD LYS 23 8.777 -14.327 2.048 185 1HE LYS 23 1HE LYS 23 9.421 -13.950 4.966 186 2HE LYS 23 2HE LYS 23 9.080 -15.462 4.129 187 1HZ LYS 23 1HZ LYS 23 11.544 -14.007 4.342 188 2HZ LYS 23 2HZ LYS 23 11.180 -14.443 2.749 189 3HZ LYS 23 3HZ LYS 23 11.280 -15.631 3.949 190 H ARG 24 H ARG 24 9.521 -12.787 -2.005 191 HA ARG 24 HA ARG 24 9.375 -10.241 -3.397 192 1HB ARG 24 1HB ARG 24 9.278 -13.115 -4.241 193 2HB ARG 24 2HB ARG 24 8.727 -11.857 -5.338 194 1HG ARG 24 1HG ARG 24 11.251 -11.075 -4.288 195 2HG ARG 24 2HG ARG 24 11.371 -12.745 -4.844 196 1HD ARG 24 1HD ARG 24 10.096 -11.797 -6.937 197 2HD ARG 24 2HD ARG 24 10.768 -10.264 -6.385 198 HE ARG 24 HE ARG 24 12.968 -11.675 -6.426 199 1HH1 ARG 24 1HH1 ARG 24 10.366 -11.741 -8.765 200 2HH1 ARG 24 2HH1 ARG 24 11.398 -12.201 -10.076 201 1HH2 ARG 24 1HH2 ARG 24 14.317 -12.269 -8.161 202 2HH2 ARG 24 2HH2 ARG 24 13.634 -12.499 -9.736 203 H PHE 25 H PHE 25 7.339 -11.740 -1.394 204 HA PHE 25 HA PHE 25 4.901 -11.588 -2.940 205 1HB PHE 25 1HB PHE 25 5.405 -13.244 -1.031 206 2HB PHE 25 2HB PHE 25 5.080 -11.901 0.054 207 HD1 PHE 25 HD1 PHE 25 2.767 -10.596 -1.197 208 HD2 PHE 25 HD2 PHE 25 3.680 -14.732 -0.772 209 HE1 PHE 25 HE1 PHE 25 0.372 -11.131 -1.285 210 HE2 PHE 25 HE2 PHE 25 1.284 -15.273 -0.862 211 HZ PHE 25 HZ PHE 25 -0.374 -13.472 -1.119 212 H GLU 26 H GLU 26 4.841 -9.413 -3.551 213 HA GLU 26 HA GLU 26 3.702 -7.676 -1.543 214 1HB GLU 26 1HB GLU 26 5.259 -5.804 -2.214 215 2HB GLU 26 2HB GLU 26 5.969 -7.066 -1.218 216 1HG GLU 26 1HG GLU 26 6.883 -8.095 -3.290 217 2HG GLU 26 2HG GLU 26 6.291 -6.696 -4.186 218 H VAL 27 H VAL 27 1.819 -7.501 -2.640 219 HA VAL 27 HA VAL 27 1.841 -5.939 -5.094 220 HB VAL 27 HB VAL 27 0.306 -8.539 -5.001 221 1HG1 VAL 27 1HG1 VAL 27 0.224 -7.959 -7.532 222 2HG1 VAL 27 2HG1 VAL 27 0.592 -6.323 -6.985 223 3HG1 VAL 27 3HG1 VAL 27 -0.865 -7.135 -6.416 224 1HG2 VAL 27 1HG2 VAL 27 2.433 -9.362 -5.296 225 2HG2 VAL 27 2HG2 VAL 27 3.004 -7.903 -6.103 226 3HG2 VAL 27 3HG2 VAL 27 1.969 -9.038 -6.965 227 HA PRO 28 HA PRO 28 -1.346 -4.248 -2.296 228 1HB PRO 28 1HB PRO 28 -1.525 -2.469 -4.691 229 2HB PRO 28 2HB PRO 28 -1.493 -2.042 -2.975 230 1HG PRO 28 1HG PRO 28 0.680 -1.712 -4.455 231 2HG PRO 28 2HG PRO 28 0.807 -2.357 -2.809 232 1HD PRO 28 1HD PRO 28 0.992 -3.792 -5.419 233 2HD PRO 28 2HD PRO 28 1.899 -4.059 -3.916 234 H LYS 29 H LYS 29 -3.665 -4.025 -2.484 235 HA LYS 29 HA LYS 29 -5.047 -4.643 -4.873 236 1HB LYS 29 1HB LYS 29 -4.054 -6.887 -4.189 237 2HB LYS 29 2HB LYS 29 -5.150 -6.849 -2.817 238 1HG LYS 29 1HG LYS 29 -6.371 -8.070 -4.308 239 2HG LYS 29 2HG LYS 29 -6.961 -6.445 -4.661 240 1HD LYS 29 1HD LYS 29 -4.609 -7.534 -6.151 241 2HD LYS 29 2HD LYS 29 -6.241 -8.022 -6.611 242 1HE LYS 29 1HE LYS 29 -6.594 -6.093 -7.660 243 2HE LYS 29 2HE LYS 29 -6.110 -5.169 -6.241 244 1HZ LYS 29 1HZ LYS 29 -3.734 -5.931 -7.100 245 2HZ LYS 29 2HZ LYS 29 -4.483 -4.517 -7.649 246 3HZ LYS 29 3HZ LYS 29 -4.551 -5.927 -8.582 247 H ALA 30 H ALA 30 -5.901 -5.761 -1.604 248 HA ALA 30 HA ALA 30 -8.322 -4.195 -1.707 249 1HB ALA 30 1HB ALA 30 -9.058 -5.434 0.092 250 2HB ALA 30 2HB ALA 30 -7.432 -5.671 0.733 251 3HB ALA 30 3HB ALA 30 -7.956 -6.566 -0.693 252 H TYR 31 H TYR 31 -8.604 -3.583 1.030 253 HA TYR 31 HA TYR 31 -6.449 -1.765 1.724 254 1HB TYR 31 1HB TYR 31 -8.208 0.098 2.010 255 2HB TYR 31 2HB TYR 31 -7.620 -0.246 0.392 256 HD1 TYR 31 HD1 TYR 31 -9.973 -2.609 1.860 257 HD2 TYR 31 HD2 TYR 31 -9.615 0.924 -0.490 258 HE1 TYR 31 HE1 TYR 31 -12.286 -2.890 1.099 259 HE2 TYR 31 HE2 TYR 31 -11.934 0.645 -1.257 260 HH TYR 31 HH TYR 31 -13.984 -0.439 -0.551 261 H SER 32 H SER 32 -7.675 -0.316 3.726 262 HA SER 32 HA SER 32 -7.892 -2.297 5.776 263 1HB SER 32 1HB SER 32 -8.421 -0.207 7.209 264 2HB SER 32 2HB SER 32 -6.818 -0.340 6.486 265 HG SER 32 HG SER 32 -7.319 1.199 5.047 266 H VAL 33 H VAL 33 -9.678 -2.267 7.403 267 HA VAL 33 HA VAL 33 -12.285 -1.762 6.133 268 HB VAL 33 HB VAL 33 -12.424 -3.958 8.024 269 1HG1 VAL 33 1HG1 VAL 33 -13.306 -4.998 5.750 270 2HG1 VAL 33 2HG1 VAL 33 -13.328 -3.299 5.280 271 3HG1 VAL 33 3HG1 VAL 33 -14.254 -3.837 6.681 272 1HG2 VAL 33 1HG2 VAL 33 -10.052 -4.184 6.911 273 2HG2 VAL 33 2HG2 VAL 33 -10.991 -4.763 5.537 274 3HG2 VAL 33 3HG2 VAL 33 -11.102 -5.587 7.090 275 H ILE 34 H ILE 34 -13.387 -0.311 7.256 276 HA ILE 34 HA ILE 34 -12.701 0.492 9.881 277 HB ILE 34 HB ILE 34 -13.694 2.061 8.339 278 1HG1 ILE 34 1HG1 ILE 34 -14.159 2.079 10.906 279 2HG1 ILE 34 2HG1 ILE 34 -15.030 3.195 9.863 280 1HG2 ILE 34 1HG2 ILE 34 -15.213 0.126 7.382 281 2HG2 ILE 34 2HG2 ILE 34 -15.667 1.821 7.228 282 3HG2 ILE 34 3HG2 ILE 34 -16.394 0.824 8.485 283 1HD1 ILE 34 1HD1 ILE 34 -16.151 1.571 11.735 284 2HD1 ILE 34 2HD1 ILE 34 -16.392 0.645 10.254 285 3HD1 ILE 34 3HD1 ILE 34 -17.003 2.295 10.372 286 H GLN 35 H GLN 35 -13.529 -0.043 11.830 287 HA GLN 35 HA GLN 35 -15.973 -1.596 12.041 288 1HB GLN 35 1HB GLN 35 -13.248 -2.685 12.679 289 2HB GLN 35 2HB GLN 35 -14.650 -3.233 13.586 290 1HG GLN 35 1HG GLN 35 -14.518 -3.342 10.590 291 2HG GLN 35 2HG GLN 35 -13.938 -4.648 11.622 292 1HE2 GLN 35 1HE2 GLN 35 -15.409 -6.175 11.102 293 2HE2 GLN 35 2HE2 GLN 35 -17.102 -6.038 11.418 294 H GLY 36 H GLY 36 -16.771 0.187 13.201 295 1HA GLY 36 1HA GLY 36 -17.295 1.292 15.149 296 2HA GLY 36 2HA GLY 36 -16.301 0.120 15.999 297 H ASN 37 H ASN 37 -13.904 0.459 15.748 298 HA ASN 37 HA ASN 37 -12.948 3.098 15.175 299 1HB ASN 37 1HB ASN 37 -14.075 2.920 17.638 300 2HB ASN 37 2HB ASN 37 -12.425 2.432 18.012 301 1HD2 ASN 37 1HD2 ASN 37 -14.497 5.005 17.630 302 2HD2 ASN 37 2HD2 ASN 37 -13.332 6.275 17.513 303 H ARG 38 H ARG 38 -12.425 0.286 14.522 304 HA ARG 38 HA ARG 38 -9.567 0.241 15.187 305 1HB ARG 38 1HB ARG 38 -11.094 -2.335 15.009 306 2HB ARG 38 2HB ARG 38 -9.581 -2.003 15.827 307 1HG ARG 38 1HG ARG 38 -10.744 -1.952 17.714 308 2HG ARG 38 2HG ARG 38 -11.396 -0.410 17.165 309 1HD ARG 38 1HD ARG 38 -13.396 -1.311 16.560 310 2HD ARG 38 2HD ARG 38 -12.698 -2.879 16.161 311 HE ARG 38 HE ARG 38 -12.967 -3.537 18.355 312 1HH1 ARG 38 1HH1 ARG 38 -13.653 -0.119 18.060 313 2HH1 ARG 38 2HH1 ARG 38 -14.358 -0.001 19.637 314 1HH2 ARG 38 1HH2 ARG 38 -13.881 -3.375 20.428 315 2HH2 ARG 38 2HH2 ARG 38 -14.487 -1.851 20.983 316 H THR 39 H THR 39 -8.221 -0.761 13.598 317 HA THR 39 HA THR 39 -9.505 -0.903 10.958 318 HB THR 39 HB THR 39 -7.048 0.283 11.866 319 HG1 THR 39 HG1 THR 39 -7.922 0.235 9.199 320 1HG2 THR 39 1HG2 THR 39 -5.514 -0.387 10.153 321 2HG2 THR 39 2HG2 THR 39 -6.677 -1.538 9.499 322 3HG2 THR 39 3HG2 THR 39 -5.968 -1.806 11.091 323 H PHE 40 H PHE 40 -9.918 -2.812 10.200 324 HA PHE 40 HA PHE 40 -8.582 -5.175 11.206 325 1HB PHE 40 1HB PHE 40 -11.115 -4.862 10.593 326 2HB PHE 40 2HB PHE 40 -10.564 -5.175 8.955 327 HD1 PHE 40 HD1 PHE 40 -12.086 -6.675 11.590 328 HD2 PHE 40 HD2 PHE 40 -8.787 -7.295 8.979 329 HE1 PHE 40 HE1 PHE 40 -12.238 -9.098 11.983 330 HE2 PHE 40 HE2 PHE 40 -8.929 -9.709 9.366 331 HZ PHE 40 HZ PHE 40 -10.653 -10.618 10.870 332 H ILE 41 H ILE 41 -6.534 -4.048 10.174 333 HA ILE 41 HA ILE 41 -6.224 -4.208 7.371 334 HB ILE 41 HB ILE 41 -4.766 -2.776 8.733 335 1HG1 ILE 41 1HG1 ILE 41 -2.577 -3.514 7.717 336 2HG1 ILE 41 2HG1 ILE 41 -3.417 -4.955 7.154 337 1HG2 ILE 41 1HG2 ILE 41 -4.542 -4.873 10.434 338 2HG2 ILE 41 2HG2 ILE 41 -3.489 -3.468 10.433 339 3HG2 ILE 41 3HG2 ILE 41 -2.998 -4.940 9.599 340 1HD1 ILE 41 1HD1 ILE 41 -3.524 -3.590 5.329 341 2HD1 ILE 41 2HD1 ILE 41 -3.728 -2.127 6.291 342 3HD1 ILE 41 3HD1 ILE 41 -5.068 -3.260 6.109 343 H GLN 42 H GLN 42 -6.511 -6.093 6.367 344 HA GLN 42 HA GLN 42 -5.659 -8.577 7.602 345 1HB GLN 42 1HB GLN 42 -7.077 -7.998 5.003 346 2HB GLN 42 2HB GLN 42 -6.730 -9.611 5.610 347 1HG GLN 42 1HG GLN 42 -8.015 -8.883 7.702 348 2HG GLN 42 2HG GLN 42 -8.614 -7.562 6.703 349 1HE2 GLN 42 1HE2 GLN 42 -8.592 -9.236 4.278 350 2HE2 GLN 42 2HE2 GLN 42 -9.964 -10.275 4.421 351 H ASN 43 H ASN 43 -5.013 -6.775 4.624 352 HA ASN 43 HA ASN 43 -2.605 -8.408 4.221 353 1HB ASN 43 1HB ASN 43 -4.039 -6.623 2.256 354 2HB ASN 43 2HB ASN 43 -2.705 -7.715 1.891 355 1HD2 ASN 43 1HD2 ASN 43 -3.113 -9.835 1.548 356 2HD2 ASN 43 2HD2 ASN 43 -4.693 -10.532 1.556 357 H PHE 44 H PHE 44 -2.094 -6.808 6.145 358 HA PHE 44 HA PHE 44 -1.545 -4.152 5.862 359 1HB PHE 44 1HB PHE 44 0.408 -4.583 7.462 360 2HB PHE 44 2HB PHE 44 -1.195 -5.065 8.000 361 HD1 PHE 44 HD1 PHE 44 -1.829 -7.510 7.884 362 HD2 PHE 44 HD2 PHE 44 2.162 -6.141 7.299 363 HE1 PHE 44 HE1 PHE 44 -0.988 -9.777 8.333 364 HE2 PHE 44 HE2 PHE 44 3.005 -8.408 7.747 365 HZ PHE 44 HZ PHE 44 1.431 -10.229 8.266 366 H ARG 45 H ARG 45 0.245 -6.842 4.532 367 HA ARG 45 HA ARG 45 2.599 -5.470 3.800 368 1HB ARG 45 1HB ARG 45 1.751 -8.058 3.670 369 2HB ARG 45 2HB ARG 45 1.663 -7.591 1.977 370 1HG ARG 45 1HG ARG 45 3.794 -8.523 2.289 371 2HG ARG 45 2HG ARG 45 4.036 -6.777 2.206 372 1HD ARG 45 1HD ARG 45 3.551 -7.746 4.912 373 2HD ARG 45 2HD ARG 45 4.988 -8.448 4.171 374 HE ARG 45 HE ARG 45 4.750 -5.838 5.175 375 1HH1 ARG 45 1HH1 ARG 45 6.045 -7.542 2.415 376 2HH1 ARG 45 2HH1 ARG 45 7.274 -6.363 2.108 377 1HH2 ARG 45 1HH2 ARG 45 6.367 -4.288 4.770 378 2HH2 ARG 45 2HH2 ARG 45 7.457 -4.516 3.444 379 H GLU 46 H GLU 46 -0.334 -6.245 1.973 380 HA GLU 46 HA GLU 46 0.401 -4.841 -0.378 381 1HB GLU 46 1HB GLU 46 -1.316 -6.044 -1.158 382 2HB GLU 46 2HB GLU 46 -1.678 -6.573 0.473 383 1HG GLU 46 1HG GLU 46 -2.918 -4.184 0.477 384 2HG GLU 46 2HG GLU 46 -3.027 -4.590 -1.219 385 H VAL 47 H VAL 47 -1.984 -4.118 2.142 386 HA VAL 47 HA VAL 47 -2.754 -1.602 1.293 387 HB VAL 47 HB VAL 47 -2.514 -2.626 4.126 388 1HG1 VAL 47 1HG1 VAL 47 -4.558 -0.922 4.255 389 2HG1 VAL 47 2HG1 VAL 47 -3.611 -0.117 3.004 390 3HG1 VAL 47 3HG1 VAL 47 -2.893 -0.442 4.583 391 1HG2 VAL 47 1HG2 VAL 47 -5.132 -2.461 2.809 392 2HG2 VAL 47 2HG2 VAL 47 -4.468 -3.712 3.853 393 3HG2 VAL 47 3HG2 VAL 47 -4.033 -3.669 2.147 394 H ALA 48 H ALA 48 0.107 -2.612 3.027 395 HA ALA 48 HA ALA 48 0.884 -0.041 3.898 396 1HB ALA 48 1HB ALA 48 2.248 -2.668 3.662 397 2HB ALA 48 2HB ALA 48 1.979 -1.654 5.080 398 3HB ALA 48 3HB ALA 48 3.222 -1.220 3.909 399 H ASP 49 H ASP 49 2.087 -2.034 1.200 400 HA ASP 49 HA ASP 49 3.884 -0.268 0.116 401 1HB ASP 49 1HB ASP 49 3.027 -2.679 -0.627 402 2HB ASP 49 2HB ASP 49 2.142 -1.715 -1.803 403 H ALA 50 H ALA 50 0.535 -0.564 -1.168 404 HA ALA 50 HA ALA 50 0.615 1.667 -2.782 405 1HB ALA 50 1HB ALA 50 -1.787 1.648 -2.774 406 2HB ALA 50 2HB ALA 50 -1.807 0.716 -1.281 407 3HB ALA 50 3HB ALA 50 -1.189 -0.009 -2.759 408 H LEU 51 H LEU 51 -0.579 1.641 0.610 409 HA LEU 51 HA LEU 51 -1.076 4.410 0.667 410 1HB LEU 51 1HB LEU 51 -2.229 3.257 2.310 411 2HB LEU 51 2HB LEU 51 -0.849 2.265 2.732 412 HG LEU 51 HG LEU 51 0.161 4.153 3.885 413 1HD1 LEU 51 1HD1 LEU 51 -2.332 5.730 3.545 414 2HD1 LEU 51 2HD1 LEU 51 -1.074 5.770 2.310 415 3HD1 LEU 51 3HD1 LEU 51 -0.701 6.263 3.957 416 1HD2 LEU 51 1HD2 LEU 51 -2.326 2.900 4.639 417 2HD2 LEU 51 2HD2 LEU 51 -2.170 4.500 5.364 418 3HD2 LEU 51 3HD2 LEU 51 -0.917 3.286 5.625 419 H ASN 52 H ASN 52 1.814 2.666 0.718 420 HA ASN 52 HA ASN 52 3.486 4.861 0.628 421 1HB ASN 52 1HB ASN 52 2.622 4.596 3.223 422 2HB ASN 52 2HB ASN 52 4.138 3.699 3.241 423 1HD2 ASN 52 1HD2 ASN 52 5.648 5.082 1.465 424 2HD2 ASN 52 2HD2 ASN 52 5.935 6.682 2.050 425 H ARG 53 H ARG 53 4.809 3.880 -0.766 426 HA ARG 53 HA ARG 53 5.406 1.225 -1.029 427 1HB ARG 53 1HB ARG 53 6.052 2.920 -2.674 428 2HB ARG 53 2HB ARG 53 7.257 3.556 -1.563 429 1HG ARG 53 1HG ARG 53 8.756 2.012 -2.136 430 2HG ARG 53 2HG ARG 53 7.572 0.706 -2.053 431 1HD ARG 53 1HD ARG 53 6.759 1.993 -4.293 432 2HD ARG 53 2HD ARG 53 8.494 2.287 -4.353 433 HE ARG 53 HE ARG 53 7.148 -0.216 -4.760 434 1HH1 ARG 53 1HH1 ARG 53 10.156 1.293 -3.832 435 2HH1 ARG 53 2HH1 ARG 53 11.124 -0.069 -4.286 436 1HH2 ARG 53 1HH2 ARG 53 8.423 -2.009 -5.358 437 2HH2 ARG 53 2HH2 ARG 53 10.142 -1.941 -5.153 438 H ASP 54 H ASP 54 7.137 3.612 0.934 439 HA ASP 54 HA ASP 54 8.990 1.665 1.959 440 1HB ASP 54 1HB ASP 54 8.563 4.579 2.218 441 2HB ASP 54 2HB ASP 54 9.266 3.792 3.627 442 HA PRO 55 HA PRO 55 6.283 0.273 5.204 443 1HB PRO 55 1HB PRO 55 8.107 -1.068 6.692 444 2HB PRO 55 2HB PRO 55 7.476 -1.693 5.164 445 1HG PRO 55 1HG PRO 55 10.065 -0.298 5.717 446 2HG PRO 55 2HG PRO 55 9.750 -1.708 4.689 447 1HD PRO 55 1HD PRO 55 10.059 0.806 3.704 448 2HD PRO 55 2HD PRO 55 9.034 -0.415 2.926 449 H GLN 56 H GLN 56 9.396 1.750 5.999 450 HA GLN 56 HA GLN 56 8.893 2.330 8.690 451 1HB GLN 56 1HB GLN 56 10.716 3.513 6.622 452 2HB GLN 56 2HB GLN 56 10.621 4.205 8.234 453 1HG GLN 56 1HG GLN 56 11.209 1.305 7.751 454 2HG GLN 56 2HG GLN 56 12.468 2.537 7.823 455 1HE2 GLN 56 1HE2 GLN 56 11.193 0.199 9.564 456 2HE2 GLN 56 2HE2 GLN 56 11.324 0.850 11.159 457 H HIS 57 H HIS 57 8.192 4.150 5.757 458 HA HIS 57 HA HIS 57 7.356 6.515 7.081 459 1HB HIS 57 1HB HIS 57 7.792 5.762 4.432 460 2HB HIS 57 2HB HIS 57 6.072 6.117 4.506 461 HD2 HIS 57 HD2 HIS 57 8.982 7.974 3.480 462 HE1 HIS 57 HE1 HIS 57 6.756 10.858 5.655 463 HE2 HIS 57 HE2 HIS 57 8.564 10.484 3.940 464 H LEU 58 H LEU 58 5.429 4.070 5.385 465 HA LEU 58 HA LEU 58 2.912 4.891 6.048 466 1HB LEU 58 1HB LEU 58 3.636 2.846 4.707 467 2HB LEU 58 2HB LEU 58 3.735 2.009 6.242 468 HG LEU 58 HG LEU 58 1.181 3.333 5.977 469 1HD1 LEU 58 1HD1 LEU 58 0.316 2.000 4.138 470 2HD1 LEU 58 2HD1 LEU 58 1.922 1.348 3.857 471 3HD1 LEU 58 3HD1 LEU 58 1.614 3.052 3.586 472 1HD2 LEU 58 1HD2 LEU 58 0.452 0.889 6.229 473 2HD2 LEU 58 2HD2 LEU 58 1.375 1.605 7.550 474 3HD2 LEU 58 3HD2 LEU 58 2.170 0.528 6.405 475 H LEU 59 H LEU 59 5.020 2.812 7.964 476 HA LEU 59 HA LEU 59 3.370 2.274 10.099 477 1HB LEU 59 1HB LEU 59 5.802 1.526 9.529 478 2HB LEU 59 2HB LEU 59 6.262 2.870 10.559 479 HG LEU 59 HG LEU 59 4.432 0.651 11.461 480 1HD1 LEU 59 1HD1 LEU 59 6.734 -0.125 10.792 481 2HD1 LEU 59 2HD1 LEU 59 6.277 -0.430 12.467 482 3HD1 LEU 59 3HD1 LEU 59 7.363 0.904 12.079 483 1HD2 LEU 59 1HD2 LEU 59 5.430 1.554 13.701 484 2HD2 LEU 59 2HD2 LEU 59 4.086 2.392 12.925 485 3HD2 LEU 59 3HD2 LEU 59 5.729 3.008 12.749 486 H LYS 60 H LYS 60 5.573 5.024 9.705 487 HA LYS 60 HA LYS 60 5.086 6.258 12.151 488 1HB LYS 60 1HB LYS 60 6.268 6.986 9.595 489 2HB LYS 60 2HB LYS 60 5.461 8.348 10.360 490 1HG LYS 60 1HG LYS 60 6.972 7.000 12.346 491 2HG LYS 60 2HG LYS 60 8.004 7.240 10.936 492 1HD LYS 60 1HD LYS 60 8.100 9.461 11.244 493 2HD LYS 60 2HD LYS 60 6.380 9.574 11.626 494 1HE LYS 60 1HE LYS 60 7.054 10.005 13.710 495 2HE LYS 60 2HE LYS 60 7.381 8.277 13.817 496 1HZ LYS 60 1HZ LYS 60 9.622 9.254 12.658 497 2HZ LYS 60 2HZ LYS 60 9.447 8.912 14.305 498 3HZ LYS 60 3HZ LYS 60 9.213 10.489 13.741 499 H PHE 61 H PHE 61 3.341 6.553 9.067 500 HA PHE 61 HA PHE 61 1.603 8.613 9.797 501 1HB PHE 61 1HB PHE 61 1.869 6.795 7.620 502 2HB PHE 61 2HB PHE 61 0.186 6.777 8.137 503 HD1 PHE 61 HD1 PHE 61 2.665 9.550 8.104 504 HD2 PHE 61 HD2 PHE 61 -0.985 7.995 6.564 505 HE1 PHE 61 HE1 PHE 61 2.271 11.667 6.912 506 HE2 PHE 61 HE2 PHE 61 -1.384 10.108 5.368 507 HZ PHE 61 HZ PHE 61 0.244 11.948 5.542 508 H LEU 62 H LEU 62 1.369 5.125 10.294 509 HA LEU 62 HA LEU 62 -1.228 5.020 11.316 510 1HB LEU 62 1HB LEU 62 1.191 3.321 11.440 511 2HB LEU 62 2HB LEU 62 0.023 3.062 12.718 512 HG LEU 62 HG LEU 62 -1.623 3.005 10.574 513 1HD1 LEU 62 1HD1 LEU 62 -0.607 2.616 8.643 514 2HD1 LEU 62 2HD1 LEU 62 0.310 1.284 9.342 515 3HD1 LEU 62 3HD1 LEU 62 0.938 2.928 9.431 516 1HD2 LEU 62 1HD2 LEU 62 -0.091 0.548 11.351 517 2HD2 LEU 62 2HD2 LEU 62 -1.800 0.713 10.946 518 3HD2 LEU 62 3HD2 LEU 62 -1.194 1.336 12.480 519 H LEU 63 H LEU 63 1.799 4.957 13.256 520 HA LEU 63 HA LEU 63 0.601 5.395 15.722 521 1HB LEU 63 1HB LEU 63 2.829 6.252 16.454 522 2HB LEU 63 2HB LEU 63 2.862 4.690 15.660 523 HG LEU 63 HG LEU 63 3.392 6.186 13.532 524 1HD1 LEU 63 1HD1 LEU 63 3.502 8.061 15.672 525 2HD1 LEU 63 2HD1 LEU 63 3.835 8.318 13.961 526 3HD1 LEU 63 3HD1 LEU 63 5.134 7.830 15.046 527 1HD2 LEU 63 1HD2 LEU 63 4.961 4.779 15.523 528 2HD2 LEU 63 2HD2 LEU 63 5.889 6.044 14.720 529 3HD2 LEU 63 3HD2 LEU 63 5.108 4.784 13.766 530 H ARG 64 H ARG 64 0.977 7.619 13.150 531 HA ARG 64 HA ARG 64 0.986 10.008 14.738 532 1HB ARG 64 1HB ARG 64 0.411 9.546 11.812 533 2HB ARG 64 2HB ARG 64 0.378 11.137 12.555 534 1HG ARG 64 1HG ARG 64 2.803 9.480 12.938 535 2HG ARG 64 2HG ARG 64 2.531 10.202 11.353 536 1HD ARG 64 1HD ARG 64 2.907 12.302 12.106 537 2HD ARG 64 2HD ARG 64 2.156 11.987 13.671 538 HE ARG 64 HE ARG 64 4.518 10.557 13.650 539 1HH1 ARG 64 1HH1 ARG 64 3.590 13.910 13.366 540 2HH1 ARG 64 2HH1 ARG 64 5.039 14.507 14.102 541 1HH2 ARG 64 1HH2 ARG 64 6.420 11.342 14.637 542 2HH2 ARG 64 2HH2 ARG 64 6.647 13.047 14.824 543 H GLU 65 H GLU 65 -1.505 8.157 13.031 544 HA GLU 65 HA GLU 65 -3.569 9.947 14.068 545 1HB GLU 65 1HB GLU 65 -3.349 8.761 11.654 546 2HB GLU 65 2HB GLU 65 -4.341 7.568 12.482 547 1HG GLU 65 1HG GLU 65 -5.820 9.046 11.388 548 2HG GLU 65 2HG GLU 65 -5.890 9.440 13.103 549 H LEU 66 H LEU 66 -3.369 6.401 13.752 550 HA LEU 66 HA LEU 66 -5.144 5.926 15.890 551 1HB LEU 66 1HB LEU 66 -4.008 3.577 15.842 552 2HB LEU 66 2HB LEU 66 -5.031 4.092 14.524 553 HG LEU 66 HG LEU 66 -2.492 4.887 13.744 554 1HD1 LEU 66 1HD1 LEU 66 -0.951 3.328 14.284 555 2HD1 LEU 66 2HD1 LEU 66 -2.145 2.041 14.433 556 3HD1 LEU 66 3HD1 LEU 66 -1.939 3.208 15.738 557 1HD2 LEU 66 1HD2 LEU 66 -3.237 3.897 11.908 558 2HD2 LEU 66 2HD2 LEU 66 -4.615 3.304 12.829 559 3HD2 LEU 66 3HD2 LEU 66 -3.164 2.315 12.680 560 H GLY 67 H GLY 67 -4.331 7.306 17.552 561 1HA GLY 67 1HA GLY 67 -1.755 6.707 18.733 562 2HA GLY 67 2HA GLY 67 -2.922 7.888 19.310 563 H THR 68 H THR 68 -3.224 4.394 18.745 564 HA THR 68 HA THR 68 -3.844 4.045 21.599 565 HB THR 68 HB THR 68 -5.624 2.595 21.116 566 HG1 THR 68 HG1 THR 68 -4.931 1.266 19.567 567 1HG2 THR 68 1HG2 THR 68 -7.066 3.737 19.446 568 2HG2 THR 68 2HG2 THR 68 -5.696 4.767 19.037 569 3HG2 THR 68 3HG2 THR 68 -6.378 4.812 20.663 570 H ALA 69 H ALA 69 -3.665 1.665 22.223 571 HA ALA 69 HA ALA 69 -1.168 0.737 22.262 572 1HB ALA 69 1HB ALA 69 -3.517 -0.280 23.075 573 2HB ALA 69 2HB ALA 69 -1.994 -1.165 23.140 574 3HB ALA 69 3HB ALA 69 -3.111 -1.429 21.801 575 H GLY 70 H GLY 70 -3.467 -0.195 19.697 576 1HA GLY 70 1HA GLY 70 -3.103 -0.883 17.536 577 2HA GLY 70 2HA GLY 70 -1.506 -0.158 17.664 578 H ASN 71 H ASN 71 -3.213 -3.032 17.348 579 HA ASN 71 HA ASN 71 -0.798 -4.564 17.328 580 1HB ASN 71 1HB ASN 71 -1.812 -4.349 19.817 581 2HB ASN 71 2HB ASN 71 -2.717 -5.748 19.247 582 1HD2 ASN 71 1HD2 ASN 71 -1.792 -7.650 19.463 583 2HD2 ASN 71 2HD2 ASN 71 -0.107 -7.939 19.705 584 H LEU 72 H LEU 72 -1.242 -6.903 16.874 585 HA LEU 72 HA LEU 72 -3.291 -7.070 14.843 586 1HB LEU 72 1HB LEU 72 -0.842 -8.509 15.547 587 2HB LEU 72 2HB LEU 72 -2.140 -9.574 15.036 588 HG LEU 72 HG LEU 72 -2.134 -7.516 13.150 589 1HD1 LEU 72 1HD1 LEU 72 0.008 -7.055 12.493 590 2HD1 LEU 72 2HD1 LEU 72 0.678 -8.489 13.272 591 3HD1 LEU 72 3HD1 LEU 72 0.205 -7.095 14.244 592 1HD2 LEU 72 1HD2 LEU 72 -1.067 -10.326 13.119 593 2HD2 LEU 72 2HD2 LEU 72 -1.175 -9.321 11.676 594 3HD2 LEU 72 3HD2 LEU 72 -2.637 -9.751 12.561 595 H GLU 73 H GLU 73 -5.338 -7.487 15.491 596 HA GLU 73 HA GLU 73 -5.740 -9.414 17.677 597 1HB GLU 73 1HB GLU 73 -6.774 -6.956 17.531 598 2HB GLU 73 2HB GLU 73 -7.988 -7.791 16.582 599 1HG GLU 73 1HG GLU 73 -8.401 -9.309 18.446 600 2HG GLU 73 2HG GLU 73 -7.200 -8.439 19.402 601 H GLY 74 H GLY 74 -7.421 -11.023 17.410 602 1HA GLY 74 1HA GLY 74 -8.465 -12.713 16.260 603 2HA GLY 74 2HA GLY 74 -8.802 -11.515 15.019 604 H GLY 75 H GLY 75 -8.528 -13.503 13.655 605 1HA GLY 75 1HA GLY 75 -6.085 -14.824 13.328 606 2HA GLY 75 2HA GLY 75 -7.320 -14.664 12.090 607 H ARG 76 H ARG 76 -7.321 -11.976 11.585 608 HA ARG 76 HA ARG 76 -4.766 -11.679 10.222 609 1HB ARG 76 1HB ARG 76 -7.127 -9.815 9.967 610 2HB ARG 76 2HB ARG 76 -5.848 -10.127 8.801 611 1HG ARG 76 1HG ARG 76 -7.282 -12.556 9.418 612 2HG ARG 76 2HG ARG 76 -8.376 -11.295 8.861 613 1HD ARG 76 1HD ARG 76 -7.132 -11.008 6.844 614 2HD ARG 76 2HD ARG 76 -5.852 -12.071 7.420 615 HE ARG 76 HE ARG 76 -8.517 -12.884 6.507 616 1HH1 ARG 76 1HH1 ARG 76 -5.317 -13.789 7.601 617 2HH1 ARG 76 2HH1 ARG 76 -5.484 -15.436 7.096 618 1HH2 ARG 76 1HH2 ARG 76 -8.727 -15.047 5.857 619 2HH2 ARG 76 2HH2 ARG 76 -7.416 -16.150 6.109 620 H ALA 77 H ALA 77 -4.861 -8.789 10.000 621 HA ALA 77 HA ALA 77 -3.816 -8.186 12.661 622 1HB ALA 77 1HB ALA 77 -2.192 -7.738 11.019 623 2HB ALA 77 2HB ALA 77 -2.822 -6.165 11.496 624 3HB ALA 77 3HB ALA 77 -3.344 -6.899 9.988 625 H ILE 78 H ILE 78 -5.767 -7.820 13.722 626 HA ILE 78 HA ILE 78 -7.360 -5.544 12.801 627 HB ILE 78 HB ILE 78 -7.898 -7.500 15.028 628 1HG1 ILE 78 1HG1 ILE 78 -9.470 -7.326 12.499 629 2HG1 ILE 78 2HG1 ILE 78 -7.958 -8.226 12.518 630 1HG2 ILE 78 1HG2 ILE 78 -8.910 -5.248 15.343 631 2HG2 ILE 78 2HG2 ILE 78 -10.093 -6.547 15.185 632 3HG2 ILE 78 3HG2 ILE 78 -9.769 -5.478 13.820 633 1HD1 ILE 78 1HD1 ILE 78 -10.507 -8.785 13.967 634 2HD1 ILE 78 2HD1 ILE 78 -8.978 -9.428 14.563 635 3HD1 ILE 78 3HD1 ILE 78 -9.543 -9.848 12.948 636 H LEU 79 H LEU 79 -5.961 -3.828 13.371 637 HA LEU 79 HA LEU 79 -5.207 -3.593 16.186 638 1HB LEU 79 1HB LEU 79 -3.706 -1.877 15.560 639 2HB LEU 79 2HB LEU 79 -3.542 -3.156 14.376 640 HG LEU 79 HG LEU 79 -5.431 -1.413 13.266 641 1HD1 LEU 79 1HD1 LEU 79 -4.025 0.048 15.179 642 2HD1 LEU 79 2HD1 LEU 79 -4.979 0.690 13.844 643 3HD1 LEU 79 3HD1 LEU 79 -3.246 0.437 13.645 644 1HD2 LEU 79 1HD2 LEU 79 -2.528 -1.237 12.595 645 2HD2 LEU 79 2HD2 LEU 79 -3.925 -1.307 11.525 646 3HD2 LEU 79 3HD2 LEU 79 -3.379 -2.759 12.359 647 H GLN 80 H GLN 80 -5.223 -0.918 16.674 648 HA GLN 80 HA GLN 80 -7.973 -0.034 16.148 649 1HB GLN 80 1HB GLN 80 -7.660 -1.285 18.397 650 2HB GLN 80 2HB GLN 80 -6.811 0.167 18.912 651 1HG GLN 80 1HG GLN 80 -8.821 1.493 18.372 652 2HG GLN 80 2HG GLN 80 -9.660 -0.001 17.971 653 1HE2 GLN 80 1HE2 GLN 80 -11.189 0.630 19.599 654 2HE2 GLN 80 2HE2 GLN 80 -10.852 0.318 21.264 655 H GLY 81 H GLY 81 -8.374 2.219 16.590 656 1HA GLY 81 1HA GLY 81 -6.875 4.184 17.523 657 2HA GLY 81 2HA GLY 81 -6.003 3.814 16.059 658 H LYS 82 H LYS 82 -6.539 4.917 14.299 659 HA LYS 82 HA LYS 82 -9.267 5.816 13.894 660 1HB LYS 82 1HB LYS 82 -7.954 7.509 15.316 661 2HB LYS 82 2HB LYS 82 -7.054 7.851 13.845 662 1HG LYS 82 1HG LYS 82 -8.771 8.955 12.886 663 2HG LYS 82 2HG LYS 82 -9.998 7.928 13.634 664 1HD LYS 82 1HD LYS 82 -8.387 9.764 15.350 665 2HD LYS 82 2HD LYS 82 -9.709 10.425 14.385 666 1HE LYS 82 1HE LYS 82 -11.166 8.620 15.399 667 2HE LYS 82 2HE LYS 82 -9.845 8.315 16.525 668 1HZ LYS 82 1HZ LYS 82 -11.329 9.797 17.578 669 2HZ LYS 82 2HZ LYS 82 -11.421 10.806 16.223 670 3HZ LYS 82 3HZ LYS 82 -9.991 10.726 17.120 671 H PHE 83 H PHE 83 -7.608 3.970 12.463 672 HA PHE 83 HA PHE 83 -7.115 5.455 9.963 673 1HB PHE 83 1HB PHE 83 -5.726 3.227 11.272 674 2HB PHE 83 2HB PHE 83 -6.043 2.951 9.565 675 HD1 PHE 83 HD1 PHE 83 -5.563 6.371 10.740 676 HD2 PHE 83 HD2 PHE 83 -3.649 2.935 9.123 677 HE1 PHE 83 HE1 PHE 83 -3.614 7.744 10.133 678 HE2 PHE 83 HE2 PHE 83 -1.697 4.300 8.516 679 HZ PHE 83 HZ PHE 83 -1.677 6.707 9.025 680 H THR 84 H THR 84 -9.690 4.972 10.667 681 HA THR 84 HA THR 84 -10.665 2.547 9.461 682 HB THR 84 HB THR 84 -12.829 3.303 10.082 683 HG1 THR 84 HG1 THR 84 -13.379 5.335 10.213 684 1HG2 THR 84 1HG2 THR 84 -11.524 4.677 12.309 685 2HG2 THR 84 2HG2 THR 84 -10.912 3.059 11.965 686 3HG2 THR 84 3HG2 THR 84 -12.626 3.300 12.305 687 H HIS 85 H HIS 85 -9.603 2.880 7.417 688 HA HIS 85 HA HIS 85 -9.532 3.442 5.205 689 1HB HIS 85 1HB HIS 85 -12.313 3.235 5.974 690 2HB HIS 85 2HB HIS 85 -12.128 4.428 4.697 691 HD2 HIS 85 HD2 HIS 85 -9.642 1.602 4.246 692 HE1 HIS 85 HE1 HIS 85 -13.005 0.657 1.844 693 HE2 HIS 85 HE2 HIS 85 -10.709 -0.058 2.594 694 H PHE 86 H PHE 86 -8.793 5.446 7.094 695 HA PHE 86 HA PHE 86 -9.797 7.928 5.945 696 1HB PHE 86 1HB PHE 86 -8.180 7.314 8.402 697 2HB PHE 86 2HB PHE 86 -8.303 8.953 7.769 698 HD1 PHE 86 HD1 PHE 86 -11.025 9.228 6.922 699 HD2 PHE 86 HD2 PHE 86 -9.466 7.160 10.294 700 HE1 PHE 86 HE1 PHE 86 -13.171 9.522 8.092 701 HE2 PHE 86 HE2 PHE 86 -11.603 7.450 11.472 702 HZ PHE 86 HZ PHE 86 -13.461 8.632 10.371 703 H LEU 87 H LEU 87 -6.562 7.473 7.164 704 HA LEU 87 HA LEU 87 -5.409 8.852 4.958 705 1HB LEU 87 1HB LEU 87 -4.075 7.316 7.193 706 2HB LEU 87 2HB LEU 87 -3.281 8.434 6.101 707 HG LEU 87 HG LEU 87 -4.943 10.190 7.029 708 1HD1 LEU 87 1HD1 LEU 87 -5.242 9.441 9.582 709 2HD1 LEU 87 2HD1 LEU 87 -5.435 7.881 8.785 710 3HD1 LEU 87 3HD1 LEU 87 -6.486 9.227 8.352 711 1HD2 LEU 87 1HD2 LEU 87 -3.402 10.853 8.665 712 2HD2 LEU 87 2HD2 LEU 87 -2.450 9.974 7.471 713 3HD2 LEU 87 3HD2 LEU 87 -2.898 9.197 8.987 714 H ILE 88 H ILE 88 -5.775 5.495 5.880 715 HA ILE 88 HA ILE 88 -3.894 4.467 4.015 716 HB ILE 88 HB ILE 88 -6.311 3.034 5.132 717 1HG1 ILE 88 1HG1 ILE 88 -3.587 3.565 6.337 718 2HG1 ILE 88 2HG1 ILE 88 -5.171 3.759 7.071 719 1HG2 ILE 88 1HG2 ILE 88 -4.121 2.288 3.387 720 2HG2 ILE 88 2HG2 ILE 88 -5.617 1.433 3.752 721 3HG2 ILE 88 3HG2 ILE 88 -4.218 1.248 4.805 722 1HD1 ILE 88 1HD1 ILE 88 -5.367 1.511 7.556 723 2HD1 ILE 88 2HD1 ILE 88 -3.648 1.806 7.801 724 3HD1 ILE 88 3HD1 ILE 88 -4.203 1.034 6.322 725 H ASN 89 H ASN 89 -7.468 4.360 3.978 726 HA ASN 89 HA ASN 89 -7.809 3.463 1.398 727 1HB ASN 89 1HB ASN 89 -9.535 3.877 3.282 728 2HB ASN 89 2HB ASN 89 -9.689 5.480 2.572 729 1HD2 ASN 89 1HD2 ASN 89 -11.881 4.914 2.144 730 2HD2 ASN 89 2HD2 ASN 89 -12.278 3.953 0.765 731 H GLU 90 H GLU 90 -7.488 6.859 2.458 732 HA GLU 90 HA GLU 90 -8.011 7.964 -0.082 733 1HB GLU 90 1HB GLU 90 -7.080 10.040 0.785 734 2HB GLU 90 2HB GLU 90 -8.126 9.289 1.982 735 1HG GLU 90 1HG GLU 90 -6.489 9.483 3.444 736 2HG GLU 90 2HG GLU 90 -5.568 8.311 2.511 737 H ARG 91 H ARG 91 -4.984 6.928 1.436 738 HA ARG 91 HA ARG 91 -3.353 7.900 -0.703 739 1HB ARG 91 1HB ARG 91 -2.947 6.678 1.853 740 2HB ARG 91 2HB ARG 91 -2.021 5.805 0.646 741 1HG ARG 91 1HG ARG 91 -1.885 8.785 0.764 742 2HG ARG 91 2HG ARG 91 -0.941 7.799 1.882 743 1HD ARG 91 1HD ARG 91 0.504 7.162 0.285 744 2HD ARG 91 2HD ARG 91 -0.770 6.934 -0.909 745 HE ARG 91 HE ARG 91 -0.615 9.227 -1.479 746 1HH1 ARG 91 1HH1 ARG 91 1.844 8.228 0.808 747 2HH1 ARG 91 2HH1 ARG 91 2.858 9.594 0.491 748 1HH2 ARG 91 1HH2 ARG 91 0.718 11.014 -1.880 749 2HH2 ARG 91 2HH2 ARG 91 2.220 11.175 -1.031 750 H ILE 92 H ILE 92 -4.596 4.694 0.214 751 HA ILE 92 HA ILE 92 -3.382 3.172 -1.768 752 HB ILE 92 HB ILE 92 -6.221 2.741 -0.822 753 1HG1 ILE 92 1HG1 ILE 92 -4.657 3.011 1.097 754 2HG1 ILE 92 2HG1 ILE 92 -5.366 1.408 0.994 755 1HG2 ILE 92 1HG2 ILE 92 -5.907 0.470 -1.403 756 2HG2 ILE 92 2HG2 ILE 92 -4.179 0.705 -1.670 757 3HG2 ILE 92 3HG2 ILE 92 -5.350 1.432 -2.769 758 1HD1 ILE 92 1HD1 ILE 92 -2.598 2.249 0.809 759 2HD1 ILE 92 2HD1 ILE 92 -3.088 1.108 -0.432 760 3HD1 ILE 92 3HD1 ILE 92 -3.290 0.698 1.264 761 H GLU 93 H GLU 93 -6.632 4.610 -1.807 762 HA GLU 93 HA GLU 93 -7.299 4.013 -4.442 763 1HB GLU 93 1HB GLU 93 -8.861 4.840 -2.661 764 2HB GLU 93 2HB GLU 93 -8.206 6.452 -2.905 765 1HG GLU 93 1HG GLU 93 -9.660 6.794 -4.528 766 2HG GLU 93 2HG GLU 93 -8.949 5.466 -5.441 767 H ASP 94 H ASP 94 -5.412 6.670 -3.133 768 HA ASP 94 HA ASP 94 -5.440 8.333 -5.397 769 1HB ASP 94 1HB ASP 94 -4.362 8.516 -2.898 770 2HB ASP 94 2HB ASP 94 -2.918 8.282 -3.876 771 H TYR 95 H TYR 95 -3.340 5.644 -4.499 772 HA TYR 95 HA TYR 95 -1.740 5.940 -6.891 773 1HB TYR 95 1HB TYR 95 -1.529 4.485 -4.361 774 2HB TYR 95 2HB TYR 95 -0.998 3.544 -5.750 775 HD1 TYR 95 HD1 TYR 95 0.399 5.134 -3.238 776 HD2 TYR 95 HD2 TYR 95 0.231 5.563 -7.468 777 HE1 TYR 95 HE1 TYR 95 2.561 6.307 -3.199 778 HE2 TYR 95 HE2 TYR 95 2.392 6.736 -7.440 779 HH TYR 95 HH TYR 95 3.669 8.195 -5.250 780 H VAL 96 H VAL 96 -3.680 3.260 -5.496 781 HA VAL 96 HA VAL 96 -3.623 1.648 -7.759 782 HB VAL 96 HB VAL 96 -5.495 0.423 -6.855 783 1HG1 VAL 96 1HG1 VAL 96 -3.287 1.311 -5.120 784 2HG1 VAL 96 2HG1 VAL 96 -3.760 -0.313 -5.617 785 3HG1 VAL 96 3HG1 VAL 96 -4.620 0.493 -4.307 786 1HG2 VAL 96 1HG2 VAL 96 -7.137 1.272 -5.598 787 2HG2 VAL 96 2HG2 VAL 96 -6.471 2.855 -5.958 788 3HG2 VAL 96 3HG2 VAL 96 -6.005 2.025 -4.484 789 H ASN 97 H ASN 97 -5.983 4.161 -6.875 790 HA ASN 97 HA ASN 97 -7.062 3.948 -9.597 791 1HB ASN 97 1HB ASN 97 -8.362 4.216 -7.021 792 2HB ASN 97 2HB ASN 97 -8.825 5.529 -8.100 793 1HD2 ASN 97 1HD2 ASN 97 -8.768 4.279 -10.543 794 2HD2 ASN 97 2HD2 ASN 97 -9.992 3.060 -10.594 795 H LYS 98 H LYS 98 -4.771 5.276 -9.593 796 HA LYS 98 HA LYS 98 -5.163 8.096 -9.071 797 1HB LYS 98 1HB LYS 98 -2.912 8.405 -9.695 798 2HB LYS 98 2HB LYS 98 -2.949 6.858 -8.865 799 1HG LYS 98 1HG LYS 98 -3.361 6.282 -11.580 800 2HG LYS 98 2HG LYS 98 -2.061 7.472 -11.515 801 1HD LYS 98 1HD LYS 98 -0.998 6.023 -9.735 802 2HD LYS 98 2HD LYS 98 -2.193 4.797 -10.155 803 1HE LYS 98 1HE LYS 98 -1.251 5.396 -12.601 804 2HE LYS 98 2HE LYS 98 0.187 5.705 -11.629 805 1HZ LYS 98 1HZ LYS 98 0.478 3.539 -11.245 806 2HZ LYS 98 2HZ LYS 98 -0.576 3.283 -12.542 807 3HZ LYS 98 3HZ LYS 98 -1.165 3.253 -10.957 808 H PHE 99 H PHE 99 -6.303 6.145 -11.434 809 HA PHE 99 HA PHE 99 -5.735 7.572 -13.802 810 1HB PHE 99 1HB PHE 99 -6.582 5.245 -13.756 811 2HB PHE 99 2HB PHE 99 -8.133 5.839 -13.176 812 HD1 PHE 99 HD1 PHE 99 -9.773 6.539 -14.676 813 HD2 PHE 99 HD2 PHE 99 -5.763 6.054 -16.014 814 HE1 PHE 99 HE1 PHE 99 -10.514 6.862 -17.000 815 HE2 PHE 99 HE2 PHE 99 -6.495 6.377 -18.340 816 HZ PHE 99 HZ PHE 99 -8.873 6.784 -18.835 817 H VAL 100 H VAL 100 -8.661 7.550 -11.762 818 HA VAL 100 HA VAL 100 -9.678 9.898 -13.132 819 HB VAL 100 HB VAL 100 -11.273 8.163 -12.583 820 1HG1 VAL 100 1HG1 VAL 100 -11.656 8.267 -9.844 821 2HG1 VAL 100 2HG1 VAL 100 -9.903 8.210 -10.029 822 3HG1 VAL 100 3HG1 VAL 100 -10.907 6.953 -10.751 823 1HG2 VAL 100 1HG2 VAL 100 -12.967 9.487 -11.483 824 2HG2 VAL 100 2HG2 VAL 100 -12.011 10.527 -12.538 825 3HG2 VAL 100 3HG2 VAL 100 -11.738 10.549 -10.796 826 H ILE 101 H ILE 101 -8.095 9.096 -10.136 827 HA ILE 101 HA ILE 101 -8.766 11.543 -8.798 828 HB ILE 101 HB ILE 101 -6.474 9.706 -8.120 829 1HG1 ILE 101 1HG1 ILE 101 -8.599 8.441 -8.371 830 2HG1 ILE 101 2HG1 ILE 101 -7.998 8.447 -6.716 831 1HG2 ILE 101 1HG2 ILE 101 -7.993 10.967 -5.971 832 2HG2 ILE 101 2HG2 ILE 101 -7.202 12.121 -7.045 833 3HG2 ILE 101 3HG2 ILE 101 -6.250 10.879 -6.232 834 1HD1 ILE 101 1HD1 ILE 101 -10.314 9.954 -7.873 835 2HD1 ILE 101 2HD1 ILE 101 -9.598 10.374 -6.315 836 3HD1 ILE 101 3HD1 ILE 101 -10.306 8.778 -6.560 837 H CYS 102 H CYS 102 -5.691 10.272 -10.101 838 HA CYS 102 HA CYS 102 -4.532 12.927 -10.042 839 1HB CYS 102 1HB CYS 102 -3.289 10.772 -9.486 840 2HB CYS 102 2HB CYS 102 -3.277 10.452 -11.217 841 H HIS 103 H HIS 103 -6.596 11.466 -12.111 842 HA HIS 103 HA HIS 103 -7.270 11.884 -14.237 843 1HB HIS 103 1HB HIS 103 -5.541 14.244 -13.650 844 2HB HIS 103 2HB HIS 103 -6.037 13.978 -15.317 845 HD2 HIS 103 HD2 HIS 103 -7.800 14.550 -11.830 846 HE1 HIS 103 HE1 HIS 103 -10.381 15.809 -14.954 847 HE2 HIS 103 HE2 HIS 103 -10.085 15.586 -12.461 848 H GLU 104 H GLU 104 -5.566 9.837 -14.072 849 HA GLU 104 HA GLU 104 -3.927 8.607 -15.096 850 1HB GLU 104 1HB GLU 104 -5.872 8.871 -16.765 851 2HB GLU 104 2HB GLU 104 -4.813 9.986 -17.617 852 1HG GLU 104 1HG GLU 104 -3.140 7.913 -17.350 853 2HG GLU 104 2HG GLU 104 -4.677 7.051 -17.371 854 H CYS 105 H CYS 105 -2.243 9.929 -14.048 855 HA CYS 105 HA CYS 105 -0.973 12.042 -15.464 856 1HB CYS 105 1HB CYS 105 -0.882 11.176 -12.898 857 2HB CYS 105 2HB CYS 105 0.625 10.504 -13.503 858 H ASN 106 H ASN 106 -1.063 10.541 -17.504 859 HA ASN 106 HA ASN 106 0.980 8.567 -17.733 860 1HB ASN 106 1HB ASN 106 -1.196 8.737 -19.072 861 2HB ASN 106 2HB ASN 106 -0.396 9.982 -20.021 862 1HD2 ASN 106 1HD2 ASN 106 0.887 9.380 -21.648 863 2HD2 ASN 106 2HD2 ASN 106 1.350 7.755 -21.998 864 H ARG 107 H ARG 107 1.044 10.792 -20.378 865 HA ARG 107 HA ARG 107 3.726 11.648 -19.549 866 1HB ARG 107 1HB ARG 107 2.639 11.760 -22.355 867 2HB ARG 107 2HB ARG 107 4.316 11.819 -21.833 868 1HG ARG 107 1HG ARG 107 3.302 9.383 -20.888 869 2HG ARG 107 2HG ARG 107 2.711 9.556 -22.542 870 1HD ARG 107 1HD ARG 107 4.709 8.706 -23.105 871 2HD ARG 107 2HD ARG 107 5.292 10.346 -22.819 872 HE ARG 107 HE ARG 107 5.510 9.283 -20.386 873 1HH1 ARG 107 1HH1 ARG 107 6.471 8.053 -23.504 874 2HH1 ARG 107 2HH1 ARG 107 7.789 7.126 -22.872 875 1HH2 ARG 107 1HH2 ARG 107 7.242 8.069 -19.551 876 2HH2 ARG 107 2HH2 ARG 107 8.228 7.135 -20.626 877 HA PRO 108 HA PRO 108 0.792 15.432 -19.509 878 1HB PRO 108 1HB PRO 108 2.489 16.012 -17.153 879 2HB PRO 108 2HB PRO 108 0.747 16.197 -17.353 880 1HG PRO 108 1HG PRO 108 1.824 14.208 -15.891 881 2HG PRO 108 2HG PRO 108 0.315 14.013 -16.800 882 1HD PRO 108 1HD PRO 108 3.024 12.950 -17.383 883 2HD PRO 108 2HD PRO 108 1.429 12.307 -17.804 884 H ASP 109 H ASP 109 1.419 17.524 -20.104 885 HA ASP 109 HA ASP 109 4.134 17.730 -21.133 886 1HB ASP 109 1HB ASP 109 1.578 19.231 -21.585 887 2HB ASP 109 2HB ASP 109 3.113 19.968 -22.036 888 H THR 110 H THR 110 3.637 17.900 -18.250 889 HA THR 110 HA THR 110 4.652 20.616 -17.754 890 HB THR 110 HB THR 110 3.301 19.076 -15.583 891 HG1 THR 110 HG1 THR 110 1.643 20.765 -16.968 892 1HG2 THR 110 1HG2 THR 110 4.101 21.828 -16.092 893 2HG2 THR 110 2HG2 THR 110 3.807 20.991 -14.569 894 3HG2 THR 110 3HG2 THR 110 2.456 21.668 -15.476 895 H ARG 111 H ARG 111 5.765 20.604 -15.448 896 HA ARG 111 HA ARG 111 7.927 18.691 -15.693 897 1HB ARG 111 1HB ARG 111 7.476 21.175 -14.063 898 2HB ARG 111 2HB ARG 111 8.832 20.106 -13.730 899 1HG ARG 111 1HG ARG 111 8.832 20.597 -16.506 900 2HG ARG 111 2HG ARG 111 8.591 22.149 -15.702 901 1HD ARG 111 1HD ARG 111 10.978 21.604 -16.061 902 2HD ARG 111 2HD ARG 111 10.564 21.814 -14.360 903 HE ARG 111 HE ARG 111 11.210 19.661 -14.008 904 1HH1 ARG 111 1HH1 ARG 111 10.462 20.031 -17.396 905 2HH1 ARG 111 2HH1 ARG 111 10.925 18.414 -17.804 906 1HH2 ARG 111 1HH2 ARG 111 11.821 17.532 -14.541 907 2HH2 ARG 111 2HH2 ARG 111 11.697 16.994 -16.183 908 H ILE 112 H ILE 112 7.515 16.748 -14.843 909 HA ILE 112 HA ILE 112 6.374 16.593 -12.128 910 HB ILE 112 HB ILE 112 6.465 14.392 -14.197 911 1HG1 ILE 112 1HG1 ILE 112 3.805 15.097 -13.735 912 2HG1 ILE 112 2HG1 ILE 112 4.646 16.636 -13.889 913 1HG2 ILE 112 1HG2 ILE 112 5.032 14.607 -11.554 914 2HG2 ILE 112 2HG2 ILE 112 6.411 13.571 -11.919 915 3HG2 ILE 112 3HG2 ILE 112 4.858 13.280 -12.703 916 1HD1 ILE 112 1HD1 ILE 112 5.583 15.854 -16.035 917 2HD1 ILE 112 2HD1 ILE 112 3.825 15.960 -16.028 918 3HD1 ILE 112 3HD1 ILE 112 4.612 14.390 -15.885 919 H ILE 113 H ILE 113 7.490 15.529 -10.540 920 HA ILE 113 HA ILE 113 9.961 14.113 -11.272 921 HB ILE 113 HB ILE 113 9.902 16.105 -9.009 922 1HG1 ILE 113 1HG1 ILE 113 11.695 17.002 -10.980 923 2HG1 ILE 113 2HG1 ILE 113 10.215 16.605 -11.842 924 1HG2 ILE 113 1HG2 ILE 113 11.510 14.409 -8.638 925 2HG2 ILE 113 2HG2 ILE 113 12.392 15.826 -9.207 926 3HG2 ILE 113 3HG2 ILE 113 12.075 14.485 -10.308 927 1HD1 ILE 113 1HD1 ILE 113 10.815 18.864 -10.183 928 2HD1 ILE 113 2HD1 ILE 113 9.395 18.011 -9.580 929 3HD1 ILE 113 3HD1 ILE 113 9.435 18.587 -11.246 930 H ARG 114 H ARG 114 10.425 12.377 -10.000 931 HA ARG 114 HA ARG 114 8.699 11.930 -7.652 932 1HB ARG 114 1HB ARG 114 8.246 10.544 -9.807 933 2HB ARG 114 2HB ARG 114 9.706 9.676 -9.351 934 1HG ARG 114 1HG ARG 114 8.426 9.564 -7.028 935 2HG ARG 114 2HG ARG 114 7.035 9.660 -8.112 936 1HD ARG 114 1HD ARG 114 9.224 7.609 -8.043 937 2HD ARG 114 2HD ARG 114 7.498 7.368 -7.822 938 HE ARG 114 HE ARG 114 8.639 8.179 -10.412 939 1HH1 ARG 114 1HH1 ARG 114 6.560 6.101 -8.508 940 2HH1 ARG 114 2HH1 ARG 114 5.967 5.235 -9.882 941 1HH2 ARG 114 1HH2 ARG 114 7.856 7.023 -12.211 942 2HH2 ARG 114 2HH2 ARG 114 6.703 5.752 -11.980 943 H GLU 115 H GLU 115 9.759 11.602 -5.818 944 HA GLU 115 HA GLU 115 12.507 10.562 -5.956 945 1HB GLU 115 1HB GLU 115 13.162 12.028 -4.140 946 2HB GLU 115 2HB GLU 115 12.516 12.984 -5.466 947 1HG GLU 115 1HG GLU 115 10.680 13.633 -4.289 948 2HG GLU 115 2HG GLU 115 10.654 12.167 -3.314 949 H GLY 116 H GLY 116 13.114 9.093 -4.401 950 1HA GLY 116 1HA GLY 116 12.841 7.949 -2.328 951 2HA GLY 116 2HA GLY 116 11.152 8.430 -2.320 952 H ARG 117 H ARG 117 12.301 7.243 -5.324 953 HA ARG 117 HA ARG 117 11.784 5.382 -6.525 954 1HB ARG 117 1HB ARG 117 13.080 4.540 -4.190 955 2HB ARG 117 2HB ARG 117 11.712 3.451 -4.363 956 1HG ARG 117 1HG ARG 117 13.010 2.281 -5.737 957 2HG ARG 117 2HG ARG 117 12.721 3.566 -6.912 958 1HD ARG 117 1HD ARG 117 15.052 3.290 -5.023 959 2HD ARG 117 2HD ARG 117 15.079 3.208 -6.784 960 HE ARG 117 HE ARG 117 15.173 5.560 -5.182 961 1HH1 ARG 117 1HH1 ARG 117 14.021 4.310 -8.227 962 2HH1 ARG 117 2HH1 ARG 117 14.039 5.855 -9.011 963 1HH2 ARG 117 1HH2 ARG 117 15.199 7.591 -6.210 964 2HH2 ARG 117 2HH2 ARG 117 14.708 7.717 -7.866 965 H ILE 118 H ILE 118 9.609 6.414 -6.656 966 HA ILE 118 HA ILE 118 7.346 6.208 -6.751 967 HB ILE 118 HB ILE 118 7.570 3.421 -5.645 968 1HG1 ILE 118 1HG1 ILE 118 8.131 4.340 -8.470 969 2HG1 ILE 118 2HG1 ILE 118 9.290 3.614 -7.361 970 1HG2 ILE 118 1HG2 ILE 118 5.391 4.830 -6.357 971 2HG2 ILE 118 2HG2 ILE 118 5.505 3.077 -6.494 972 3HG2 ILE 118 3HG2 ILE 118 5.801 4.092 -7.905 973 1HD1 ILE 118 1HD1 ILE 118 7.136 2.357 -8.955 974 2HD1 ILE 118 2HD1 ILE 118 7.521 1.649 -7.386 975 3HD1 ILE 118 3HD1 ILE 118 8.775 1.801 -8.616 976 H SER 119 H SER 119 7.910 7.698 -4.773 977 HA SER 119 HA SER 119 6.122 6.825 -2.630 978 1HB SER 119 1HB SER 119 9.021 7.377 -2.328 979 2HB SER 119 2HB SER 119 7.961 8.044 -1.087 980 HG SER 119 HG SER 119 8.860 5.620 -1.189 981 H LEU 120 H LEU 120 8.080 9.465 -3.956 982 HA LEU 120 HA LEU 120 5.928 11.327 -3.190 983 1HB LEU 120 1HB LEU 120 8.906 11.703 -3.083 984 2HB LEU 120 2HB LEU 120 7.804 13.060 -3.118 985 HG LEU 120 HG LEU 120 8.374 12.763 -0.857 986 1HD1 LEU 120 1HD1 LEU 120 6.306 12.343 0.206 987 2HD1 LEU 120 2HD1 LEU 120 5.767 11.288 -1.100 988 3HD1 LEU 120 3HD1 LEU 120 5.930 13.021 -1.377 989 1HD2 LEU 120 1HD2 LEU 120 8.454 9.951 -1.576 990 2HD2 LEU 120 2HD2 LEU 120 7.637 10.233 -0.040 991 3HD2 LEU 120 3HD2 LEU 120 9.282 10.815 -0.282 992 H LEU 121 H LEU 121 5.596 13.135 -4.639 993 HA LEU 121 HA LEU 121 7.038 13.450 -7.049 994 1HB LEU 121 1HB LEU 121 5.906 11.278 -7.522 995 2HB LEU 121 2HB LEU 121 4.361 12.084 -7.349 996 HG LEU 121 HG LEU 121 6.266 13.186 -9.354 997 1HD1 LEU 121 1HD1 LEU 121 4.809 11.385 -10.822 998 2HD1 LEU 121 2HD1 LEU 121 5.279 10.449 -9.403 999 3HD1 LEU 121 3HD1 LEU 121 6.512 11.231 -10.393 1000 1HD2 LEU 121 1HD2 LEU 121 4.427 14.393 -9.632 1001 2HD2 LEU 121 2HD2 LEU 121 3.425 13.259 -8.739 1002 3HD2 LEU 121 3HD2 LEU 121 3.762 12.984 -10.446 1003 H LYS 122 H LYS 122 6.160 15.149 -8.431 1004 HA LYS 122 HA LYS 122 4.236 16.862 -6.994 1005 1HB LYS 122 1HB LYS 122 6.632 17.474 -8.679 1006 2HB LYS 122 2HB LYS 122 5.342 18.661 -8.528 1007 1HG LYS 122 1HG LYS 122 5.712 18.984 -6.284 1008 2HG LYS 122 2HG LYS 122 6.500 17.416 -6.090 1009 1HD LYS 122 1HD LYS 122 7.709 19.622 -7.740 1010 2HD LYS 122 2HD LYS 122 7.990 19.486 -6.004 1011 1HE LYS 122 1HE LYS 122 8.473 17.170 -7.847 1012 2HE LYS 122 2HE LYS 122 9.695 18.417 -7.610 1013 1HZ LYS 122 1HZ LYS 122 8.619 16.494 -5.650 1014 2HZ LYS 122 2HZ LYS 122 9.348 17.929 -5.135 1015 3HZ LYS 122 3HZ LYS 122 10.231 16.813 -6.049 1016 H CYS 123 H CYS 123 2.432 17.614 -7.997 1017 HA CYS 123 HA CYS 123 2.165 17.157 -10.885 1018 1HB CYS 123 1HB CYS 123 0.191 16.353 -8.751 1019 2HB CYS 123 2HB CYS 123 -0.257 16.536 -10.439 1020 H GLU 124 H GLU 124 2.825 19.592 -9.821 1021 HA GLU 124 HA GLU 124 0.846 21.333 -9.043 1022 1HB GLU 124 1HB GLU 124 2.188 23.104 -10.192 1023 2HB GLU 124 2HB GLU 124 3.136 22.051 -9.150 1024 1HG GLU 124 1HG GLU 124 4.171 21.000 -10.924 1025 2HG GLU 124 2HG GLU 124 2.903 21.449 -12.063 1026 H ALA 125 H ALA 125 1.406 19.914 -12.165 1027 HA ALA 125 HA ALA 125 -0.233 21.678 -13.678 1028 1HB ALA 125 1HB ALA 125 0.179 20.282 -15.482 1029 2HB ALA 125 2HB ALA 125 0.316 18.847 -14.470 1030 3HB ALA 125 3HB ALA 125 1.600 20.049 -14.469 1031 H CYS 126 H CYS 126 -0.846 18.200 -13.216 1032 HA CYS 126 HA CYS 126 -3.676 18.637 -13.438 1033 1HB CYS 126 1HB CYS 126 -3.879 16.224 -13.248 1034 2HB CYS 126 2HB CYS 126 -2.586 16.624 -14.372 1035 H GLY 127 H GLY 127 -3.131 20.166 -11.396 1036 1HA GLY 127 1HA GLY 127 -4.332 20.420 -9.357 1037 2HA GLY 127 2HA GLY 127 -4.219 18.683 -9.111 1038 H ALA 128 H ALA 128 -2.855 18.072 -7.585 1039 HA ALA 128 HA ALA 128 -0.288 19.372 -7.290 1040 1HB ALA 128 1HB ALA 128 -2.405 19.526 -5.162 1041 2HB ALA 128 2HB ALA 128 -1.428 20.825 -5.847 1042 3HB ALA 128 3HB ALA 128 -0.687 19.635 -4.779 1043 H LYS 129 H LYS 129 1.193 18.174 -6.012 1044 HA LYS 129 HA LYS 129 0.347 15.523 -5.132 1045 1HB LYS 129 1HB LYS 129 1.359 15.685 -7.594 1046 2HB LYS 129 2HB LYS 129 2.867 15.629 -6.707 1047 1HG LYS 129 1HG LYS 129 2.422 13.405 -7.214 1048 2HG LYS 129 2HG LYS 129 1.891 13.573 -5.541 1049 1HD LYS 129 1HD LYS 129 -0.310 14.255 -7.170 1050 2HD LYS 129 2HD LYS 129 0.386 12.781 -7.846 1051 1HE LYS 129 1HE LYS 129 -0.857 11.741 -6.297 1052 2HE LYS 129 2HE LYS 129 0.427 12.220 -5.188 1053 1HZ LYS 129 1HZ LYS 129 -2.292 13.066 -5.275 1054 2HZ LYS 129 2HZ LYS 129 -1.243 14.392 -5.315 1055 3HZ LYS 129 3HZ LYS 129 -1.144 13.274 -4.050 1056 H ALA 130 H ALA 130 1.870 14.504 -3.690 1057 HA ALA 130 HA ALA 130 3.148 16.437 -1.990 1058 1HB ALA 130 1HB ALA 130 3.552 14.566 -0.503 1059 2HB ALA 130 2HB ALA 130 3.091 13.435 -1.774 1060 3HB ALA 130 3HB ALA 130 1.889 14.530 -1.092 1061 HA PRO 131 HA PRO 131 7.013 15.885 -4.315 1062 1HB PRO 131 1HB PRO 131 8.224 18.074 -3.272 1063 2HB PRO 131 2HB PRO 131 7.080 18.159 -4.599 1064 1HG PRO 131 1HG PRO 131 6.658 18.737 -1.713 1065 2HG PRO 131 2HG PRO 131 6.025 19.584 -3.133 1066 1HD PRO 131 1HD PRO 131 4.561 17.819 -1.666 1067 2HD PRO 131 2HD PRO 131 4.301 18.115 -3.393 1068 H LEU 132 H LEU 132 7.156 17.116 -0.982 1069 HA LEU 132 HA LEU 132 8.655 14.839 -0.082 1070 1HB LEU 132 1HB LEU 132 10.512 16.423 0.793 1071 2HB LEU 132 2HB LEU 132 10.582 15.859 -0.865 1072 HG LEU 132 HG LEU 132 9.195 18.438 -0.450 1073 1HD1 LEU 132 1HD1 LEU 132 10.851 19.598 0.470 1074 2HD1 LEU 132 2HD1 LEU 132 12.032 18.907 -0.642 1075 3HD1 LEU 132 3HD1 LEU 132 11.633 18.064 0.854 1076 1HD2 LEU 132 1HD2 LEU 132 9.864 18.847 -2.578 1077 2HD2 LEU 132 2HD2 LEU 132 9.936 17.086 -2.618 1078 3HD2 LEU 132 3HD2 LEU 132 11.408 18.023 -2.372 1079 H LYS 133 H LYS 133 9.504 15.498 2.297 1080 HA LYS 133 HA LYS 133 7.533 17.206 3.605 1081 1HB LYS 133 1HB LYS 133 6.935 14.608 3.456 1082 2HB LYS 133 2HB LYS 133 7.993 14.545 4.859 1083 1HG LYS 133 1HG LYS 133 6.162 15.003 6.041 1084 2HG LYS 133 2HG LYS 133 6.355 16.656 5.456 1085 1HD LYS 133 1HD LYS 133 4.684 16.447 3.899 1086 2HD LYS 133 2HD LYS 133 4.885 14.698 3.759 1087 1HE LYS 133 1HE LYS 133 3.604 14.267 5.617 1088 2HE LYS 133 2HE LYS 133 3.955 15.830 6.352 1089 1HZ LYS 133 1HZ LYS 133 2.143 16.703 5.447 1090 2HZ LYS 133 2HZ LYS 133 1.676 15.142 5.000 1091 3HZ LYS 133 3HZ LYS 133 2.518 16.116 3.905 1092 H ASN 134 H ASN 134 8.107 16.711 6.217 1093 HA ASN 134 HA ASN 134 9.594 17.141 7.880 1094 1HB ASN 134 1HB ASN 134 10.826 15.222 6.411 1095 2HB ASN 134 2HB ASN 134 12.001 16.525 6.270 1096 1HD2 ASN 134 1HD2 ASN 134 13.519 16.482 7.742 1097 2HD2 ASN 134 2HD2 ASN 134 13.368 15.878 9.354 1098 H VAL 135 H VAL 135 9.648 19.269 8.247 1099 HA VAL 135 HA VAL 135 10.437 21.410 8.275 1100 HB VAL 135 HB VAL 135 12.447 20.589 6.177 1101 1HG1 VAL 135 1HG1 VAL 135 12.836 22.725 8.228 1102 2HG1 VAL 135 2HG1 VAL 135 11.906 23.065 6.768 1103 3HG1 VAL 135 3HG1 VAL 135 13.585 22.541 6.642 1104 1HG2 VAL 135 1HG2 VAL 135 12.288 19.390 8.580 1105 2HG2 VAL 135 2HG2 VAL 135 13.272 20.792 9.001 1106 3HG2 VAL 135 3HG2 VAL 135 13.808 19.685 7.737 Start of MODEL 13 1 H MET 1 H MET 1 -9.669 2.785 -22.379 2 HA MET 1 HA MET 1 -10.149 0.150 -21.186 3 1HB MET 1 1HB MET 1 -10.946 1.619 -23.692 4 2HB MET 1 2HB MET 1 -11.117 -0.124 -23.548 5 1HG MET 1 1HG MET 1 -12.357 0.617 -21.301 6 2HG MET 1 2HG MET 1 -12.658 2.050 -22.284 7 1HE MET 1 1HE MET 1 -14.626 -1.608 -21.780 8 2HE MET 1 2HE MET 1 -15.708 -0.216 -21.826 9 3HE MET 1 3HE MET 1 -14.244 -0.162 -20.845 10 H ASP 2 H ASP 2 -7.424 1.105 -21.488 11 HA ASP 2 HA ASP 2 -6.288 0.227 -23.920 12 1HB ASP 2 1HB ASP 2 -4.919 0.343 -21.227 13 2HB ASP 2 2HB ASP 2 -4.154 0.407 -22.811 14 H ASP 3 H ASP 3 -4.651 -1.594 -24.004 15 HA ASP 3 HA ASP 3 -5.972 -4.042 -23.526 16 1HB ASP 3 1HB ASP 3 -3.115 -3.427 -24.298 17 2HB ASP 3 2HB ASP 3 -3.770 -5.059 -24.224 18 H TYR 4 H TYR 4 -4.298 -5.865 -22.537 19 HA TYR 4 HA TYR 4 -4.378 -5.348 -19.722 20 1HB TYR 4 1HB TYR 4 -3.822 -7.671 -21.469 21 2HB TYR 4 2HB TYR 4 -3.036 -7.692 -19.893 22 HD1 TYR 4 HD1 TYR 4 -4.162 -8.922 -18.313 23 HD2 TYR 4 HD2 TYR 4 -6.419 -6.760 -21.199 24 HE1 TYR 4 HE1 TYR 4 -6.243 -9.727 -17.281 25 HE2 TYR 4 HE2 TYR 4 -8.507 -7.559 -20.175 26 HH TYR 4 HH TYR 4 -8.549 -10.042 -17.782 27 H GLU 5 H GLU 5 -2.792 -4.719 -18.395 28 HA GLU 5 HA GLU 5 -0.292 -3.862 -19.507 29 1HB GLU 5 1HB GLU 5 -1.386 -3.864 -16.696 30 2HB GLU 5 2HB GLU 5 0.217 -3.262 -17.097 31 1HG GLU 5 1HG GLU 5 -1.568 -2.025 -18.881 32 2HG GLU 5 2HG GLU 5 -2.310 -1.945 -17.284 33 H LYS 6 H LYS 6 1.344 -5.171 -19.875 34 HA LYS 6 HA LYS 6 1.541 -7.767 -18.692 35 1HB LYS 6 1HB LYS 6 3.613 -7.958 -20.003 36 2HB LYS 6 2HB LYS 6 2.272 -7.381 -20.984 37 1HG LYS 6 1HG LYS 6 3.171 -5.033 -20.492 38 2HG LYS 6 2HG LYS 6 4.638 -5.855 -19.964 39 1HD LYS 6 1HD LYS 6 4.817 -6.932 -22.160 40 2HD LYS 6 2HD LYS 6 3.351 -6.099 -22.683 41 1HE LYS 6 1HE LYS 6 4.456 -3.945 -22.356 42 2HE LYS 6 2HE LYS 6 5.916 -4.770 -21.813 43 1HZ LYS 6 1HZ LYS 6 6.540 -4.739 -23.930 44 2HZ LYS 6 2HZ LYS 6 5.012 -4.254 -24.469 45 3HZ LYS 6 3HZ LYS 6 5.346 -5.897 -24.241 46 H LEU 7 H LEU 7 3.504 -8.543 -17.578 47 HA LEU 7 HA LEU 7 4.212 -6.716 -15.448 48 1HB LEU 7 1HB LEU 7 3.602 -9.178 -15.165 49 2HB LEU 7 2HB LEU 7 5.198 -9.538 -15.797 50 HG LEU 7 HG LEU 7 6.029 -7.982 -13.873 51 1HD1 LEU 7 1HD1 LEU 7 4.410 -8.440 -11.873 52 2HD1 LEU 7 2HD1 LEU 7 3.189 -8.516 -13.144 53 3HD1 LEU 7 3HD1 LEU 7 4.151 -7.053 -12.933 54 1HD2 LEU 7 1HD2 LEU 7 5.541 -10.777 -14.109 55 2HD2 LEU 7 2HD2 LEU 7 5.238 -10.295 -12.440 56 3HD2 LEU 7 3HD2 LEU 7 6.796 -9.949 -13.190 57 H LEU 8 H LEU 8 5.381 -6.918 -18.433 58 HA LEU 8 HA LEU 8 8.174 -7.260 -18.044 59 1HB LEU 8 1HB LEU 8 6.483 -6.112 -20.229 60 2HB LEU 8 2HB LEU 8 8.217 -5.865 -20.259 61 HG LEU 8 HG LEU 8 8.173 -8.524 -19.893 62 1HD1 LEU 8 1HD1 LEU 8 5.480 -7.856 -20.554 63 2HD1 LEU 8 2HD1 LEU 8 6.186 -9.439 -20.236 64 3HD1 LEU 8 3HD1 LEU 8 6.185 -8.787 -21.874 65 1HD2 LEU 8 1HD2 LEU 8 8.202 -8.592 -22.497 66 2HD2 LEU 8 2HD2 LEU 8 9.468 -7.728 -21.627 67 3HD2 LEU 8 3HD2 LEU 8 8.133 -6.836 -22.357 68 H GLU 9 H GLU 9 8.235 -5.921 -16.060 69 HA GLU 9 HA GLU 9 8.048 -3.073 -16.321 70 1HB GLU 9 1HB GLU 9 8.993 -3.088 -14.008 71 2HB GLU 9 2HB GLU 9 7.547 -4.065 -14.191 72 1HG GLU 9 1HG GLU 9 8.606 -5.848 -13.441 73 2HG GLU 9 2HG GLU 9 9.840 -5.686 -14.689 74 H ARG 10 H ARG 10 9.542 -3.273 -18.288 75 HA ARG 10 HA ARG 10 12.371 -3.374 -17.574 76 1HB ARG 10 1HB ARG 10 12.710 -3.137 -20.062 77 2HB ARG 10 2HB ARG 10 11.868 -4.594 -19.555 78 1HG ARG 10 1HG ARG 10 9.722 -3.495 -20.126 79 2HG ARG 10 2HG ARG 10 10.635 -2.117 -20.744 80 1HD ARG 10 1HD ARG 10 11.112 -4.910 -21.730 81 2HD ARG 10 2HD ARG 10 9.855 -3.888 -22.421 82 HE ARG 10 HE ARG 10 11.688 -2.283 -22.938 83 1HH1 ARG 10 1HH1 ARG 10 12.407 -5.684 -22.540 84 2HH1 ARG 10 2HH1 ARG 10 13.828 -5.620 -23.523 85 1HH2 ARG 10 1HH2 ARG 10 13.557 -2.212 -24.229 86 2HH2 ARG 10 2HH2 ARG 10 14.481 -3.656 -24.480 87 H ALA 11 H ALA 11 13.552 -1.613 -17.240 88 HA ALA 11 HA ALA 11 14.183 0.566 -17.084 89 1HB ALA 11 1HB ALA 11 12.501 1.257 -19.458 90 2HB ALA 11 2HB ALA 11 13.920 0.227 -19.648 91 3HB ALA 11 3HB ALA 11 14.095 1.857 -18.998 92 H ILE 12 H ILE 12 12.246 -0.050 -15.370 93 HA ILE 12 HA ILE 12 10.220 2.062 -15.569 94 HB ILE 12 HB ILE 12 9.283 0.862 -13.469 95 1HG1 ILE 12 1HG1 ILE 12 9.919 -1.742 -14.140 96 2HG1 ILE 12 2HG1 ILE 12 11.466 -0.928 -14.245 97 1HG2 ILE 12 1HG2 ILE 12 9.117 0.009 -16.315 98 2HG2 ILE 12 2HG2 ILE 12 7.905 0.779 -15.290 99 3HG2 ILE 12 3HG2 ILE 12 8.272 -0.934 -15.087 100 1HD1 ILE 12 1HD1 ILE 12 11.381 -1.673 -12.059 101 2HD1 ILE 12 2HD1 ILE 12 9.676 -1.260 -11.881 102 3HD1 ILE 12 3HD1 ILE 12 10.892 0.015 -11.930 103 H ASP 13 H ASP 13 13.103 1.207 -13.941 104 HA ASP 13 HA ASP 13 12.619 2.916 -11.654 105 1HB ASP 13 1HB ASP 13 14.826 1.106 -12.534 106 2HB ASP 13 2HB ASP 13 15.205 2.386 -11.386 107 H GLN 14 H GLN 14 15.416 2.847 -13.845 108 HA GLN 14 HA GLN 14 15.677 5.723 -13.593 109 1HB GLN 14 1HB GLN 14 17.535 3.808 -13.658 110 2HB GLN 14 2HB GLN 14 17.473 4.162 -15.377 111 1HG GLN 14 1HG GLN 14 19.064 5.649 -14.807 112 2HG GLN 14 2HG GLN 14 17.657 6.653 -14.457 113 1HE2 GLN 14 1HE2 GLN 14 17.706 7.637 -12.578 114 2HE2 GLN 14 2HE2 GLN 14 18.542 7.102 -11.163 115 H LEU 15 H LEU 15 16.022 3.657 -16.486 116 HA LEU 15 HA LEU 15 15.325 3.922 -18.634 117 1HB LEU 15 1HB LEU 15 13.095 3.815 -17.687 118 2HB LEU 15 2HB LEU 15 13.143 5.524 -17.306 119 HG LEU 15 HG LEU 15 13.627 5.250 -20.099 120 1HD1 LEU 15 1HD1 LEU 15 11.392 4.267 -20.713 121 2HD1 LEU 15 2HD1 LEU 15 11.305 3.642 -19.068 122 3HD1 LEU 15 3HD1 LEU 15 12.602 3.118 -20.141 123 1HD2 LEU 15 1HD2 LEU 15 12.421 7.017 -18.518 124 2HD2 LEU 15 2HD2 LEU 15 10.994 6.143 -19.076 125 3HD2 LEU 15 3HD2 LEU 15 12.076 6.901 -20.245 126 HA PRO 16 HA PRO 16 17.552 7.520 -19.985 127 1HB PRO 16 1HB PRO 16 16.389 7.609 -22.535 128 2HB PRO 16 2HB PRO 16 17.862 6.745 -22.091 129 1HG PRO 16 1HG PRO 16 15.077 5.725 -22.381 130 2HG PRO 16 2HG PRO 16 16.614 4.930 -22.768 131 1HD PRO 16 1HD PRO 16 15.230 4.267 -20.581 132 2HD PRO 16 2HD PRO 16 17.005 4.333 -20.557 133 HA PRO 17 HA PRO 17 14.553 10.708 -19.054 134 1HB PRO 17 1HB PRO 17 16.170 12.831 -19.766 135 2HB PRO 17 2HB PRO 17 16.220 12.017 -18.202 136 1HG PRO 17 1HG PRO 17 17.973 11.636 -20.593 137 2HG PRO 17 2HG PRO 17 18.416 11.701 -18.878 138 1HD PRO 17 1HD PRO 17 18.241 9.371 -20.187 139 2HD PRO 17 2HD PRO 17 17.734 9.518 -18.491 140 H GLU 18 H GLU 18 14.575 13.155 -20.503 141 HA GLU 18 HA GLU 18 13.785 14.142 -22.392 142 1HB GLU 18 1HB GLU 18 15.108 11.721 -23.555 143 2HB GLU 18 2HB GLU 18 14.077 12.711 -24.579 144 1HG GLU 18 1HG GLU 18 15.728 14.137 -24.892 145 2HG GLU 18 2HG GLU 18 15.819 14.438 -23.158 146 H VAL 19 H VAL 19 13.137 10.761 -23.269 147 HA VAL 19 HA VAL 19 10.301 11.437 -23.490 148 HB VAL 19 HB VAL 19 11.229 8.707 -24.203 149 1HG1 VAL 19 1HG1 VAL 19 9.662 10.298 -26.095 150 2HG1 VAL 19 2HG1 VAL 19 8.914 10.123 -24.507 151 3HG1 VAL 19 3HG1 VAL 19 9.356 8.690 -25.436 152 1HG2 VAL 19 1HG2 VAL 19 11.814 11.053 -26.006 153 2HG2 VAL 19 2HG2 VAL 19 12.150 9.351 -26.321 154 3HG2 VAL 19 3HG2 VAL 19 13.033 10.204 -25.058 155 H PHE 20 H PHE 20 9.001 11.030 -21.865 156 HA PHE 20 HA PHE 20 9.809 9.076 -19.844 157 1HB PHE 20 1HB PHE 20 7.543 10.294 -18.857 158 2HB PHE 20 2HB PHE 20 9.198 10.763 -18.495 159 HD1 PHE 20 HD1 PHE 20 10.272 12.559 -19.971 160 HD2 PHE 20 HD2 PHE 20 6.099 11.761 -19.903 161 HE1 PHE 20 HE1 PHE 20 9.836 14.783 -20.932 162 HE2 PHE 20 HE2 PHE 20 5.649 13.985 -20.859 163 HZ PHE 20 HZ PHE 20 7.521 15.498 -21.377 164 H GLU 21 H GLU 21 7.536 8.239 -18.711 165 HA GLU 21 HA GLU 21 5.470 7.469 -20.479 166 1HB GLU 21 1HB GLU 21 7.199 6.131 -21.533 167 2HB GLU 21 2HB GLU 21 7.643 5.425 -19.987 168 1HG GLU 21 1HG GLU 21 6.369 3.838 -21.231 169 2HG GLU 21 2HG GLU 21 5.403 4.388 -19.864 170 H THR 22 H THR 22 3.974 5.886 -19.494 171 HA THR 22 HA THR 22 3.780 6.317 -16.670 172 HB THR 22 HB THR 22 1.800 6.233 -18.197 173 HG1 THR 22 HG1 THR 22 0.762 5.786 -16.449 174 1HG2 THR 22 1HG2 THR 22 2.235 4.395 -19.628 175 2HG2 THR 22 2HG2 THR 22 0.844 3.966 -18.634 176 3HG2 THR 22 3HG2 THR 22 2.434 3.298 -18.263 177 H LYS 23 H LYS 23 3.178 4.368 -15.238 178 HA LYS 23 HA LYS 23 5.323 2.401 -15.549 179 1HB LYS 23 1HB LYS 23 3.591 3.002 -13.143 180 2HB LYS 23 2HB LYS 23 4.973 1.915 -13.175 181 1HG LYS 23 1HG LYS 23 6.029 3.723 -12.349 182 2HG LYS 23 2HG LYS 23 6.162 4.140 -14.058 183 1HD LYS 23 1HD LYS 23 3.785 5.232 -13.571 184 2HD LYS 23 2HD LYS 23 4.448 5.315 -11.939 185 1HE LYS 23 1HE LYS 23 5.727 7.049 -12.488 186 2HE LYS 23 2HE LYS 23 6.413 6.172 -13.855 187 1HZ LYS 23 1HZ LYS 23 4.507 6.839 -15.182 188 2HZ LYS 23 2HZ LYS 23 5.316 8.192 -14.576 189 3HZ LYS 23 3HZ LYS 23 3.862 7.692 -13.874 190 H ARG 24 H ARG 24 4.925 0.148 -15.221 191 HA ARG 24 HA ARG 24 2.316 -0.664 -16.226 192 1HB ARG 24 1HB ARG 24 5.016 -1.694 -16.373 193 2HB ARG 24 2HB ARG 24 3.906 -2.947 -15.838 194 1HG ARG 24 1HG ARG 24 4.086 -3.053 -18.215 195 2HG ARG 24 2HG ARG 24 2.479 -2.454 -17.807 196 1HD ARG 24 1HD ARG 24 2.826 -0.599 -18.975 197 2HD ARG 24 2HD ARG 24 4.290 -0.249 -18.063 198 HE ARG 24 HE ARG 24 5.469 -1.700 -19.686 199 1HH1 ARG 24 1HH1 ARG 24 2.407 -0.273 -20.605 200 2HH1 ARG 24 2HH1 ARG 24 2.749 -0.346 -22.298 201 1HH2 ARG 24 1HH2 ARG 24 5.903 -1.790 -21.914 202 2HH2 ARG 24 2HH2 ARG 24 4.726 -1.204 -23.042 203 H PHE 25 H PHE 25 2.323 0.317 -13.580 204 HA PHE 25 HA PHE 25 2.206 -1.985 -11.815 205 1HB PHE 25 1HB PHE 25 1.772 0.972 -11.384 206 2HB PHE 25 2HB PHE 25 1.517 -0.225 -10.117 207 HD1 PHE 25 HD1 PHE 25 3.741 2.114 -11.204 208 HD2 PHE 25 HD2 PHE 25 3.633 -1.987 -10.072 209 HE1 PHE 25 HE1 PHE 25 6.134 2.210 -10.641 210 HE2 PHE 25 HE2 PHE 25 6.025 -1.899 -9.505 211 HZ PHE 25 HZ PHE 25 7.279 0.202 -9.790 212 H GLU 26 H GLU 26 0.445 -3.192 -11.649 213 HA GLU 26 HA GLU 26 -2.181 -1.935 -11.659 214 1HB GLU 26 1HB GLU 26 -1.374 -2.841 -14.025 215 2HB GLU 26 2HB GLU 26 -1.917 -4.372 -13.352 216 1HG GLU 26 1HG GLU 26 -3.884 -2.341 -12.881 217 2HG GLU 26 2HG GLU 26 -3.461 -2.396 -14.591 218 H VAL 27 H VAL 27 -2.663 -2.531 -9.612 219 HA VAL 27 HA VAL 27 -3.162 -5.349 -9.146 220 HB VAL 27 HB VAL 27 -1.390 -3.796 -7.251 221 1HG1 VAL 27 1HG1 VAL 27 -1.952 -6.740 -7.149 222 2HG1 VAL 27 2HG1 VAL 27 -3.010 -5.582 -6.348 223 3HG1 VAL 27 3HG1 VAL 27 -1.312 -5.688 -5.889 224 1HG2 VAL 27 1HG2 VAL 27 0.346 -5.445 -7.922 225 2HG2 VAL 27 2HG2 VAL 27 -0.135 -4.355 -9.221 226 3HG2 VAL 27 3HG2 VAL 27 -0.740 -6.010 -9.190 227 HA PRO 28 HA PRO 28 -6.233 -2.126 -7.469 228 1HB PRO 28 1HB PRO 28 -8.033 -4.090 -8.786 229 2HB PRO 28 2HB PRO 28 -8.117 -2.325 -8.763 230 1HG PRO 28 1HG PRO 28 -7.292 -3.606 -10.942 231 2HG PRO 28 2HG PRO 28 -6.517 -2.095 -10.430 232 1HD PRO 28 1HD PRO 28 -5.553 -4.912 -10.149 233 2HD PRO 28 2HD PRO 28 -4.639 -3.437 -10.519 234 H LYS 29 H LYS 29 -8.479 -2.973 -6.397 235 HA LYS 29 HA LYS 29 -9.451 -4.136 -4.697 236 1HB LYS 29 1HB LYS 29 -7.881 -6.130 -6.085 237 2HB LYS 29 2HB LYS 29 -7.908 -6.460 -4.360 238 1HG LYS 29 1HG LYS 29 -10.542 -5.824 -5.026 239 2HG LYS 29 2HG LYS 29 -9.958 -6.850 -6.337 240 1HD LYS 29 1HD LYS 29 -9.213 -7.773 -3.656 241 2HD LYS 29 2HD LYS 29 -10.950 -7.752 -3.960 242 1HE LYS 29 1HE LYS 29 -10.839 -9.462 -5.410 243 2HE LYS 29 2HE LYS 29 -9.361 -8.856 -6.157 244 1HZ LYS 29 1HZ LYS 29 -9.263 -10.055 -3.471 245 2HZ LYS 29 2HZ LYS 29 -8.042 -9.945 -4.635 246 3HZ LYS 29 3HZ LYS 29 -9.303 -11.054 -4.836 247 H ALA 30 H ALA 30 -8.510 -2.370 -3.431 248 HA ALA 30 HA ALA 30 -6.877 -3.418 -1.279 249 1HB ALA 30 1HB ALA 30 -5.077 -1.937 -1.450 250 2HB ALA 30 2HB ALA 30 -5.917 -0.909 -2.610 251 3HB ALA 30 3HB ALA 30 -5.333 -2.496 -3.103 252 H TYR 31 H TYR 31 -7.835 -2.788 0.529 253 HA TYR 31 HA TYR 31 -8.348 -0.148 1.257 254 1HB TYR 31 1HB TYR 31 -10.765 -0.001 1.169 255 2HB TYR 31 2HB TYR 31 -10.145 -0.308 -0.448 256 HD1 TYR 31 HD1 TYR 31 -12.683 -1.138 1.731 257 HD2 TYR 31 HD2 TYR 31 -9.926 -2.982 -0.934 258 HE1 TYR 31 HE1 TYR 31 -14.183 -3.077 1.529 259 HE2 TYR 31 HE2 TYR 31 -11.418 -4.925 -1.143 260 HH TYR 31 HH TYR 31 -13.209 -6.000 -0.073 261 H SER 32 H SER 32 -8.150 -0.209 3.395 262 HA SER 32 HA SER 32 -8.304 -2.612 4.889 263 1HB SER 32 1HB SER 32 -8.415 -0.642 6.792 264 2HB SER 32 2HB SER 32 -6.929 -1.235 6.052 265 HG SER 32 HG SER 32 -8.382 1.106 5.501 266 H VAL 33 H VAL 33 -9.666 -2.495 7.087 267 HA VAL 33 HA VAL 33 -12.395 -1.625 6.437 268 HB VAL 33 HB VAL 33 -12.399 -4.068 8.013 269 1HG1 VAL 33 1HG1 VAL 33 -14.102 -4.719 6.397 270 2HG1 VAL 33 2HG1 VAL 33 -13.671 -3.345 5.379 271 3HG1 VAL 33 3HG1 VAL 33 -14.369 -3.075 6.976 272 1HG2 VAL 33 1HG2 VAL 33 -10.550 -4.082 5.848 273 2HG2 VAL 33 2HG2 VAL 33 -11.937 -5.063 5.392 274 3HG2 VAL 33 3HG2 VAL 33 -11.057 -5.416 6.871 275 H ILE 34 H ILE 34 -13.602 -0.874 8.128 276 HA ILE 34 HA ILE 34 -12.147 -0.421 10.636 277 HB ILE 34 HB ILE 34 -14.753 0.903 10.066 278 1HG1 ILE 34 1HG1 ILE 34 -12.989 2.691 8.996 279 2HG1 ILE 34 2HG1 ILE 34 -12.331 1.166 8.413 280 1HG2 ILE 34 1HG2 ILE 34 -13.232 1.143 12.154 281 2HG2 ILE 34 2HG2 ILE 34 -13.975 2.575 11.450 282 3HG2 ILE 34 3HG2 ILE 34 -12.283 2.204 11.119 283 1HD1 ILE 34 1HD1 ILE 34 -14.149 2.488 7.062 284 2HD1 ILE 34 2HD1 ILE 34 -15.246 1.636 8.137 285 3HD1 ILE 34 3HD1 ILE 34 -14.140 0.732 7.105 286 H GLN 35 H GLN 35 -13.296 -0.540 12.671 287 HA GLN 35 HA GLN 35 -15.812 -1.909 12.824 288 1HB GLN 35 1HB GLN 35 -13.277 -3.381 13.089 289 2HB GLN 35 2HB GLN 35 -14.415 -3.645 14.403 290 1HG GLN 35 1HG GLN 35 -16.113 -4.351 12.835 291 2HG GLN 35 2HG GLN 35 -15.038 -4.005 11.482 292 1HE2 GLN 35 1HE2 GLN 35 -15.657 -6.113 14.187 293 2HE2 GLN 35 2HE2 GLN 35 -14.639 -7.407 13.666 294 H GLY 36 H GLY 36 -16.448 -0.145 14.077 295 1HA GLY 36 1HA GLY 36 -16.877 0.883 16.095 296 2HA GLY 36 2HA GLY 36 -15.900 -0.357 16.868 297 H ASN 37 H ASN 37 -13.593 -0.064 16.929 298 HA ASN 37 HA ASN 37 -12.606 2.620 16.348 299 1HB ASN 37 1HB ASN 37 -13.505 2.163 18.851 300 2HB ASN 37 2HB ASN 37 -11.853 1.577 19.021 301 1HD2 ASN 37 1HD2 ASN 37 -10.604 3.347 17.231 302 2HD2 ASN 37 2HD2 ASN 37 -10.651 4.930 17.920 303 H ARG 38 H ARG 38 -12.192 -0.266 15.499 304 HA ARG 38 HA ARG 38 -9.270 -0.221 15.730 305 1HB ARG 38 1HB ARG 38 -9.277 -2.702 15.897 306 2HB ARG 38 2HB ARG 38 -10.004 -1.911 17.284 307 1HG ARG 38 1HG ARG 38 -12.040 -2.451 15.369 308 2HG ARG 38 2HG ARG 38 -11.093 -3.917 15.625 309 1HD ARG 38 1HD ARG 38 -12.647 -2.306 17.626 310 2HD ARG 38 2HD ARG 38 -12.802 -4.012 17.226 311 HE ARG 38 HE ARG 38 -10.450 -2.919 18.631 312 1HH1 ARG 38 1HH1 ARG 38 -12.957 -5.338 18.310 313 2HH1 ARG 38 2HH1 ARG 38 -12.368 -6.290 19.626 314 1HH2 ARG 38 1HH2 ARG 38 -9.689 -4.173 20.359 315 2HH2 ARG 38 2HH2 ARG 38 -10.517 -5.633 20.789 316 H THR 39 H THR 39 -8.131 -1.065 13.939 317 HA THR 39 HA THR 39 -9.787 -1.255 11.521 318 HB THR 39 HB THR 39 -7.574 0.356 12.058 319 HG1 THR 39 HG1 THR 39 -8.321 -0.228 9.420 320 1HG2 THR 39 1HG2 THR 39 -6.631 -2.043 10.669 321 2HG2 THR 39 2HG2 THR 39 -5.731 -0.767 11.472 322 3HG2 THR 39 3HG2 THR 39 -6.308 -0.538 9.829 323 H PHE 40 H PHE 40 -9.922 -3.077 10.458 324 HA PHE 40 HA PHE 40 -8.320 -5.352 11.332 325 1HB PHE 40 1HB PHE 40 -10.689 -5.718 11.293 326 2HB PHE 40 2HB PHE 40 -10.819 -5.093 9.655 327 HD1 PHE 40 HD1 PHE 40 -10.517 -6.494 7.797 328 HD2 PHE 40 HD2 PHE 40 -9.583 -7.910 11.687 329 HE1 PHE 40 HE1 PHE 40 -10.355 -8.780 6.914 330 HE2 PHE 40 HE2 PHE 40 -9.405 -10.202 10.817 331 HZ PHE 40 HZ PHE 40 -9.798 -10.636 8.428 332 H ILE 41 H ILE 41 -6.344 -4.735 10.304 333 HA ILE 41 HA ILE 41 -6.280 -4.417 7.434 334 HB ILE 41 HB ILE 41 -4.248 -3.543 7.678 335 1HG1 ILE 41 1HG1 ILE 41 -3.570 -6.048 9.204 336 2HG1 ILE 41 2HG1 ILE 41 -3.042 -5.565 7.602 337 1HG2 ILE 41 1HG2 ILE 41 -5.033 -3.824 10.542 338 2HG2 ILE 41 2HG2 ILE 41 -4.959 -2.390 9.530 339 3HG2 ILE 41 3HG2 ILE 41 -3.477 -3.131 10.117 340 1HD1 ILE 41 1HD1 ILE 41 -1.529 -3.974 8.492 341 2HD1 ILE 41 2HD1 ILE 41 -1.301 -5.472 9.394 342 3HD1 ILE 41 3HD1 ILE 41 -2.205 -4.140 10.112 343 H GLN 42 H GLN 42 -5.911 -5.926 5.941 344 HA GLN 42 HA GLN 42 -5.158 -8.615 6.872 345 1HB GLN 42 1HB GLN 42 -6.652 -9.532 5.114 346 2HB GLN 42 2HB GLN 42 -7.510 -8.645 6.365 347 1HG GLN 42 1HG GLN 42 -7.991 -6.867 4.953 348 2HG GLN 42 2HG GLN 42 -6.719 -7.300 3.814 349 1HE2 GLN 42 1HE2 GLN 42 -7.115 -9.833 3.215 350 2HE2 GLN 42 2HE2 GLN 42 -8.677 -10.093 2.525 351 H ASN 43 H ASN 43 -5.156 -6.343 4.154 352 HA ASN 43 HA ASN 43 -3.051 -7.945 2.886 353 1HB ASN 43 1HB ASN 43 -4.454 -5.583 1.651 354 2HB ASN 43 2HB ASN 43 -3.547 -6.847 0.839 355 1HD2 ASN 43 1HD2 ASN 43 -6.372 -5.798 0.677 356 2HD2 ASN 43 2HD2 ASN 43 -7.354 -7.217 0.761 357 H PHE 44 H PHE 44 -2.284 -6.637 5.164 358 HA PHE 44 HA PHE 44 -1.351 -4.077 5.099 359 1HB PHE 44 1HB PHE 44 0.575 -4.917 6.517 360 2HB PHE 44 2HB PHE 44 -1.033 -5.358 7.077 361 HD1 PHE 44 HD1 PHE 44 1.679 -6.701 4.894 362 HD2 PHE 44 HD2 PHE 44 -1.387 -7.532 7.726 363 HE1 PHE 44 HE1 PHE 44 2.334 -9.073 4.900 364 HE2 PHE 44 HE2 PHE 44 -0.736 -9.905 7.739 365 HZ PHE 44 HZ PHE 44 1.125 -10.678 6.325 366 H ARG 45 H ARG 45 -0.141 -6.780 3.282 367 HA ARG 45 HA ARG 45 2.344 -5.557 2.578 368 1HB ARG 45 1HB ARG 45 1.643 -8.069 2.479 369 2HB ARG 45 2HB ARG 45 1.043 -7.650 0.878 370 1HG ARG 45 1HG ARG 45 3.760 -6.711 1.436 371 2HG ARG 45 2HG ARG 45 3.573 -8.467 1.428 372 1HD ARG 45 1HD ARG 45 2.163 -7.229 -0.774 373 2HD ARG 45 2HD ARG 45 3.871 -6.806 -0.781 374 HE ARG 45 HE ARG 45 2.782 -9.535 -0.908 375 1HH1 ARG 45 1HH1 ARG 45 5.429 -7.295 -1.365 376 2HH1 ARG 45 2HH1 ARG 45 6.435 -8.461 -2.151 377 1HH2 ARG 45 1HH2 ARG 45 4.115 -11.061 -1.933 378 2HH2 ARG 45 2HH2 ARG 45 5.693 -10.595 -2.473 379 H GLU 46 H GLU 46 -0.700 -6.065 0.800 380 HA GLU 46 HA GLU 46 0.159 -4.404 -1.376 381 1HB GLU 46 1HB GLU 46 -1.441 -6.363 -1.547 382 2HB GLU 46 2HB GLU 46 -2.646 -5.316 -0.823 383 1HG GLU 46 1HG GLU 46 -1.471 -3.901 -2.971 384 2HG GLU 46 2HG GLU 46 -1.864 -5.520 -3.543 385 H VAL 47 H VAL 47 -2.203 -4.086 1.264 386 HA VAL 47 HA VAL 47 -3.131 -1.544 0.585 387 HB VAL 47 HB VAL 47 -2.850 -2.425 3.452 388 1HG1 VAL 47 1HG1 VAL 47 -4.669 -1.026 3.866 389 2HG1 VAL 47 2HG1 VAL 47 -5.143 -0.984 2.169 390 3HG1 VAL 47 3HG1 VAL 47 -3.701 -0.121 2.703 391 1HG2 VAL 47 1HG2 VAL 47 -5.396 -3.141 2.427 392 2HG2 VAL 47 2HG2 VAL 47 -4.156 -4.190 3.111 393 3HG2 VAL 47 3HG2 VAL 47 -4.170 -3.853 1.379 394 H ALA 48 H ALA 48 -0.276 -2.534 2.415 395 HA ALA 48 HA ALA 48 0.340 0.087 3.312 396 1HB ALA 48 1HB ALA 48 1.217 -1.934 4.417 397 2HB ALA 48 2HB ALA 48 2.473 -0.773 4.003 398 3HB ALA 48 3HB ALA 48 2.252 -2.217 3.018 399 H ASP 49 H ASP 49 1.666 -1.893 0.652 400 HA ASP 49 HA ASP 49 3.536 -0.119 -0.316 401 1HB ASP 49 1HB ASP 49 2.870 -2.477 -1.183 402 2HB ASP 49 2HB ASP 49 1.758 -1.606 -2.234 403 H ALA 50 H ALA 50 0.236 -0.345 -1.713 404 HA ALA 50 HA ALA 50 0.354 1.973 -3.190 405 1HB ALA 50 1HB ALA 50 -1.677 1.334 -3.791 406 2HB ALA 50 2HB ALA 50 -2.308 1.656 -2.181 407 3HB ALA 50 3HB ALA 50 -1.610 0.083 -2.552 408 H LEU 51 H LEU 51 -0.836 1.693 0.181 409 HA LEU 51 HA LEU 51 -1.464 4.426 0.437 410 1HB LEU 51 1HB LEU 51 -2.503 3.174 2.058 411 2HB LEU 51 2HB LEU 51 -1.109 2.150 2.318 412 HG LEU 51 HG LEU 51 -0.013 3.986 3.541 413 1HD1 LEU 51 1HD1 LEU 51 -2.250 5.619 4.097 414 2HD1 LEU 51 2HD1 LEU 51 -2.054 5.502 2.354 415 3HD1 LEU 51 3HD1 LEU 51 -0.715 6.061 3.349 416 1HD2 LEU 51 1HD2 LEU 51 -0.917 3.206 5.430 417 2HD2 LEU 51 2HD2 LEU 51 -2.085 2.356 4.436 418 3HD2 LEU 51 3HD2 LEU 51 -2.462 3.956 5.071 419 H ASN 52 H ASN 52 1.497 2.724 0.464 420 HA ASN 52 HA ASN 52 3.134 4.969 0.411 421 1HB ASN 52 1HB ASN 52 2.267 4.841 2.917 422 2HB ASN 52 2HB ASN 52 3.546 3.641 3.056 423 1HD2 ASN 52 1HD2 ASN 52 2.766 6.927 2.961 424 2HD2 ASN 52 2HD2 ASN 52 4.373 7.561 3.000 425 H ARG 53 H ARG 53 4.567 4.072 -0.959 426 HA ARG 53 HA ARG 53 5.185 1.435 -1.322 427 1HB ARG 53 1HB ARG 53 5.925 3.475 -2.697 428 2HB ARG 53 2HB ARG 53 7.292 3.569 -1.595 429 1HG ARG 53 1HG ARG 53 8.049 2.382 -3.474 430 2HG ARG 53 2HG ARG 53 7.800 1.176 -2.212 431 1HD ARG 53 1HD ARG 53 5.455 0.902 -3.258 432 2HD ARG 53 2HD ARG 53 6.151 1.721 -4.656 433 HE ARG 53 HE ARG 53 6.507 -0.983 -3.962 434 1HH1 ARG 53 1HH1 ARG 53 8.304 1.753 -5.177 435 2HH1 ARG 53 2HH1 ARG 53 9.488 0.778 -5.975 436 1HH2 ARG 53 1HH2 ARG 53 8.059 -2.266 -5.032 437 2HH2 ARG 53 2HH2 ARG 53 9.346 -1.500 -5.901 438 H ASP 54 H ASP 54 6.700 3.695 0.930 439 HA ASP 54 HA ASP 54 8.609 1.774 1.885 440 1HB ASP 54 1HB ASP 54 9.023 4.232 1.911 441 2HB ASP 54 2HB ASP 54 7.767 4.399 3.134 442 HA PRO 55 HA PRO 55 5.738 -0.178 4.696 443 1HB PRO 55 1HB PRO 55 7.508 -1.760 5.996 444 2HB PRO 55 2HB PRO 55 6.955 -2.102 4.353 445 1HG PRO 55 1HG PRO 55 9.499 -0.819 5.267 446 2HG PRO 55 2HG PRO 55 9.249 -2.029 3.996 447 1HD PRO 55 1HD PRO 55 9.569 0.623 3.479 448 2HD PRO 55 2HD PRO 55 8.603 -0.455 2.451 449 H GLN 56 H GLN 56 8.871 0.931 5.986 450 HA GLN 56 HA GLN 56 8.130 1.123 8.665 451 1HB GLN 56 1HB GLN 56 10.098 2.922 7.259 452 2HB GLN 56 2HB GLN 56 10.080 2.482 8.958 453 1HG GLN 56 1HG GLN 56 11.284 0.664 8.584 454 2HG GLN 56 2HG GLN 56 10.205 0.138 7.292 455 1HE2 GLN 56 1HE2 GLN 56 10.613 0.848 5.160 456 2HE2 GLN 56 2HE2 GLN 56 12.186 1.374 4.682 457 H HIS 57 H HIS 57 7.532 3.262 5.980 458 HA HIS 57 HA HIS 57 6.888 5.571 7.504 459 1HB HIS 57 1HB HIS 57 7.363 5.286 4.929 460 2HB HIS 57 2HB HIS 57 5.624 5.025 4.843 461 HD2 HIS 57 HD2 HIS 57 5.636 7.539 7.433 462 HE1 HIS 57 HE1 HIS 57 6.118 9.833 3.895 463 HE2 HIS 57 HE2 HIS 57 5.633 9.897 6.368 464 H LEU 58 H LEU 58 4.779 3.359 5.715 465 HA LEU 58 HA LEU 58 2.326 4.155 6.559 466 1HB LEU 58 1HB LEU 58 3.310 1.976 5.219 467 2HB LEU 58 2HB LEU 58 2.612 1.242 6.651 468 HG LEU 58 HG LEU 58 0.749 3.131 5.669 469 1HD1 LEU 58 1HD1 LEU 58 0.346 1.936 3.440 470 2HD1 LEU 58 2HD1 LEU 58 2.029 1.440 3.567 471 3HD1 LEU 58 3HD1 LEU 58 1.613 3.144 3.520 472 1HD2 LEU 58 1HD2 LEU 58 -0.291 0.690 5.057 473 2HD2 LEU 58 2HD2 LEU 58 -0.350 1.443 6.650 474 3HD2 LEU 58 3HD2 LEU 58 0.913 0.270 6.276 475 H LEU 59 H LEU 59 4.529 2.013 8.289 476 HA LEU 59 HA LEU 59 2.837 1.365 10.405 477 1HB LEU 59 1HB LEU 59 5.704 1.209 9.837 478 2HB LEU 59 2HB LEU 59 5.319 1.323 11.546 479 HG LEU 59 HG LEU 59 3.592 -0.612 10.322 480 1HD1 LEU 59 1HD1 LEU 59 5.751 -2.185 10.029 481 2HD1 LEU 59 2HD1 LEU 59 6.398 -0.657 9.432 482 3HD1 LEU 59 3HD1 LEU 59 4.956 -1.353 8.694 483 1HD2 LEU 59 1HD2 LEU 59 5.584 -0.469 12.521 484 2HD2 LEU 59 2HD2 LEU 59 5.068 -2.060 11.962 485 3HD2 LEU 59 3HD2 LEU 59 3.876 -0.908 12.565 486 H LYS 60 H LYS 60 5.249 3.944 10.125 487 HA LYS 60 HA LYS 60 4.853 5.050 12.676 488 1HB LYS 60 1HB LYS 60 6.543 5.531 10.572 489 2HB LYS 60 2HB LYS 60 5.526 6.964 10.554 490 1HG LYS 60 1HG LYS 60 6.505 7.807 12.362 491 2HG LYS 60 2HG LYS 60 6.416 6.272 13.227 492 1HD LYS 60 1HD LYS 60 8.461 6.910 11.105 493 2HD LYS 60 2HD LYS 60 8.741 7.091 12.839 494 1HE LYS 60 1HE LYS 60 7.957 4.510 11.491 495 2HE LYS 60 2HE LYS 60 9.612 4.963 11.892 496 1HZ LYS 60 1HZ LYS 60 7.609 5.022 14.028 497 2HZ LYS 60 2HZ LYS 60 9.258 4.660 14.107 498 3HZ LYS 60 3HZ LYS 60 8.169 3.514 13.507 499 H PHE 61 H PHE 61 3.179 5.465 9.637 500 HA PHE 61 HA PHE 61 1.735 7.789 10.331 501 1HB PHE 61 1HB PHE 61 1.998 6.166 8.069 502 2HB PHE 61 2HB PHE 61 0.296 6.087 8.487 503 HD1 PHE 61 HD1 PHE 61 -0.441 8.658 9.399 504 HD2 PHE 61 HD2 PHE 61 2.361 7.649 6.358 505 HE1 PHE 61 HE1 PHE 61 -0.792 10.856 8.351 506 HE2 PHE 61 HE2 PHE 61 2.014 9.846 5.304 507 HZ PHE 61 HZ PHE 61 0.437 11.453 6.302 508 H LEU 62 H LEU 62 0.885 4.322 10.542 509 HA LEU 62 HA LEU 62 -1.721 4.676 11.487 510 1HB LEU 62 1HB LEU 62 -1.722 2.409 12.074 511 2HB LEU 62 2HB LEU 62 -0.622 2.517 10.718 512 HG LEU 62 HG LEU 62 1.073 2.755 12.882 513 1HD1 LEU 62 1HD1 LEU 62 -0.452 2.190 14.556 514 2HD1 LEU 62 2HD1 LEU 62 0.436 0.705 14.229 515 3HD1 LEU 62 3HD1 LEU 62 -1.187 0.920 13.577 516 1HD2 LEU 62 1HD2 LEU 62 2.032 0.885 12.042 517 2HD2 LEU 62 2HD2 LEU 62 0.952 1.251 10.696 518 3HD2 LEU 62 3HD2 LEU 62 0.496 0.033 11.886 519 H LEU 63 H LEU 63 1.344 4.487 13.261 520 HA LEU 63 HA LEU 63 0.152 4.654 15.842 521 1HB LEU 63 1HB LEU 63 2.372 3.696 15.467 522 2HB LEU 63 2HB LEU 63 2.968 5.259 14.943 523 HG LEU 63 HG LEU 63 2.578 6.163 17.197 524 1HD1 LEU 63 1HD1 LEU 63 1.822 3.333 17.909 525 2HD1 LEU 63 2HD1 LEU 63 0.716 4.703 17.828 526 3HD1 LEU 63 3HD1 LEU 63 2.002 4.678 19.034 527 1HD2 LEU 63 1HD2 LEU 63 4.165 3.635 17.477 528 2HD2 LEU 63 2HD2 LEU 63 4.479 5.225 18.171 529 3HD2 LEU 63 3HD2 LEU 63 4.714 4.956 16.444 530 H ARG 64 H ARG 64 0.997 6.977 13.447 531 HA ARG 64 HA ARG 64 1.157 9.219 15.236 532 1HB ARG 64 1HB ARG 64 1.355 8.794 12.335 533 2HB ARG 64 2HB ARG 64 0.642 10.335 12.788 534 1HG ARG 64 1HG ARG 64 3.354 9.285 13.559 535 2HG ARG 64 2HG ARG 64 2.992 10.629 12.479 536 1HD ARG 64 1HD ARG 64 2.641 12.067 14.177 537 2HD ARG 64 2HD ARG 64 1.867 10.856 15.192 538 HE ARG 64 HE ARG 64 4.268 10.003 15.478 539 1HH1 ARG 64 1HH1 ARG 64 3.383 13.371 15.153 540 2HH1 ARG 64 2HH1 ARG 64 4.791 13.942 15.979 541 1HH2 ARG 64 1HH2 ARG 64 6.111 10.760 16.561 542 2HH2 ARG 64 2HH2 ARG 64 6.339 12.463 16.778 543 H GLU 65 H GLU 65 -1.353 7.666 13.370 544 HA GLU 65 HA GLU 65 -3.249 9.770 14.106 545 1HB GLU 65 1HB GLU 65 -3.196 9.092 11.751 546 2HB GLU 65 2HB GLU 65 -3.567 7.436 12.212 547 1HG GLU 65 1HG GLU 65 -5.636 8.166 11.616 548 2HG GLU 65 2HG GLU 65 -5.646 8.549 13.335 549 H LEU 66 H LEU 66 -2.548 6.367 14.646 550 HA LEU 66 HA LEU 66 -4.944 5.559 15.829 551 1HB LEU 66 1HB LEU 66 -2.137 4.642 15.904 552 2HB LEU 66 2HB LEU 66 -3.117 4.160 17.267 553 HG LEU 66 HG LEU 66 -4.601 2.918 15.902 554 1HD1 LEU 66 1HD1 LEU 66 -4.625 4.645 14.048 555 2HD1 LEU 66 2HD1 LEU 66 -4.702 2.955 13.556 556 3HD1 LEU 66 3HD1 LEU 66 -3.188 3.843 13.422 557 1HD2 LEU 66 1HD2 LEU 66 -3.095 1.299 15.930 558 2HD2 LEU 66 2HD2 LEU 66 -1.779 2.464 15.840 559 3HD2 LEU 66 3HD2 LEU 66 -2.524 1.858 14.361 560 H GLY 67 H GLY 67 -5.953 6.561 17.466 561 1HA GLY 67 1HA GLY 67 -4.386 7.962 19.489 562 2HA GLY 67 2HA GLY 67 -6.134 8.020 19.307 563 H THR 68 H THR 68 -5.160 4.838 19.125 564 HA THR 68 HA THR 68 -5.618 4.435 22.005 565 HB THR 68 HB THR 68 -7.082 2.733 21.630 566 HG1 THR 68 HG1 THR 68 -5.273 1.739 20.124 567 1HG2 THR 68 1HG2 THR 68 -8.623 3.153 19.973 568 2HG2 THR 68 2HG2 THR 68 -7.401 3.706 18.837 569 3HG2 THR 68 3HG2 THR 68 -7.853 4.723 20.199 570 H ALA 69 H ALA 69 -4.806 2.235 22.745 571 HA ALA 69 HA ALA 69 -2.156 2.030 22.891 572 1HB ALA 69 1HB ALA 69 -3.699 -0.503 22.470 573 2HB ALA 69 2HB ALA 69 -3.978 0.511 23.887 574 3HB ALA 69 3HB ALA 69 -2.380 -0.177 23.597 575 H GLY 70 H GLY 70 -3.957 0.174 20.416 576 1HA GLY 70 1HA GLY 70 -3.354 -0.193 18.191 577 2HA GLY 70 2HA GLY 70 -1.838 0.645 18.491 578 H ASN 71 H ASN 71 -3.313 -2.363 18.043 579 HA ASN 71 HA ASN 71 -0.795 -3.723 18.247 580 1HB ASN 71 1HB ASN 71 -1.561 -5.420 19.894 581 2HB ASN 71 2HB ASN 71 -1.391 -3.813 20.594 582 1HD2 ASN 71 1HD2 ASN 71 -3.464 -6.431 20.017 583 2HD2 ASN 71 2HD2 ASN 71 -4.911 -5.738 20.657 584 H LEU 72 H LEU 72 -1.045 -6.086 17.715 585 HA LEU 72 HA LEU 72 -3.005 -6.332 15.573 586 1HB LEU 72 1HB LEU 72 -0.948 -8.412 16.212 587 2HB LEU 72 2HB LEU 72 -1.666 -8.013 14.667 588 HG LEU 72 HG LEU 72 0.531 -7.264 14.472 589 1HD1 LEU 72 1HD1 LEU 72 0.417 -4.752 14.601 590 2HD1 LEU 72 2HD1 LEU 72 -1.196 -4.944 15.285 591 3HD1 LEU 72 3HD1 LEU 72 -0.853 -5.536 13.661 592 1HD2 LEU 72 1HD2 LEU 72 0.651 -5.610 16.905 593 2HD2 LEU 72 2HD2 LEU 72 1.891 -6.598 16.138 594 3HD2 LEU 72 3HD2 LEU 72 0.665 -7.355 17.155 595 H GLU 73 H GLU 73 -4.943 -7.126 16.117 596 HA GLU 73 HA GLU 73 -5.103 -9.204 18.191 597 1HB GLU 73 1HB GLU 73 -6.439 -7.337 18.792 598 2HB GLU 73 2HB GLU 73 -7.090 -7.178 17.177 599 1HG GLU 73 1HG GLU 73 -8.876 -8.252 17.921 600 2HG GLU 73 2HG GLU 73 -7.890 -9.707 17.956 601 H GLY 74 H GLY 74 -6.405 -11.084 17.822 602 1HA GLY 74 1HA GLY 74 -7.273 -12.816 16.577 603 2HA GLY 74 2HA GLY 74 -7.728 -11.620 15.375 604 H GLY 75 H GLY 75 -7.057 -13.918 14.308 605 1HA GLY 75 1HA GLY 75 -4.394 -14.581 13.902 606 2HA GLY 75 2HA GLY 75 -5.673 -14.862 12.731 607 H ARG 76 H ARG 76 -6.275 -12.011 12.451 608 HA ARG 76 HA ARG 76 -4.135 -11.365 10.583 609 1HB ARG 76 1HB ARG 76 -6.882 -11.118 10.452 610 2HB ARG 76 2HB ARG 76 -6.359 -9.468 10.767 611 1HG ARG 76 1HG ARG 76 -5.639 -9.215 8.687 612 2HG ARG 76 2HG ARG 76 -4.721 -10.716 8.745 613 1HD ARG 76 1HD ARG 76 -7.689 -10.788 8.434 614 2HD ARG 76 2HD ARG 76 -6.673 -10.435 7.042 615 HE ARG 76 HE ARG 76 -5.515 -12.637 7.807 616 1HH1 ARG 76 1HH1 ARG 76 -8.939 -11.957 7.796 617 2HH1 ARG 76 2HH1 ARG 76 -9.395 -13.610 7.600 618 1HH2 ARG 76 1HH2 ARG 76 -6.119 -14.813 7.525 619 2HH2 ARG 76 2HH2 ARG 76 -7.798 -15.231 7.441 620 H ALA 77 H ALA 77 -4.593 -8.482 10.628 621 HA ALA 77 HA ALA 77 -3.249 -7.889 13.191 622 1HB ALA 77 1HB ALA 77 -2.718 -7.007 10.420 623 2HB ALA 77 2HB ALA 77 -1.600 -7.358 11.733 624 3HB ALA 77 3HB ALA 77 -2.469 -5.824 11.701 625 H ILE 78 H ILE 78 -5.343 -7.559 14.164 626 HA ILE 78 HA ILE 78 -6.898 -5.285 13.221 627 HB ILE 78 HB ILE 78 -7.464 -6.866 15.712 628 1HG1 ILE 78 1HG1 ILE 78 -8.560 -7.561 13.000 629 2HG1 ILE 78 2HG1 ILE 78 -7.119 -8.333 13.641 630 1HG2 ILE 78 1HG2 ILE 78 -8.676 -4.662 14.597 631 2HG2 ILE 78 2HG2 ILE 78 -9.392 -5.752 15.781 632 3HG2 ILE 78 3HG2 ILE 78 -9.691 -6.000 14.062 633 1HD1 ILE 78 1HD1 ILE 78 -9.317 -8.377 15.527 634 2HD1 ILE 78 2HD1 ILE 78 -8.313 -9.695 14.923 635 3HD1 ILE 78 3HD1 ILE 78 -9.717 -9.161 13.999 636 H LEU 79 H LEU 79 -5.639 -3.478 13.665 637 HA LEU 79 HA LEU 79 -4.656 -3.069 16.370 638 1HB LEU 79 1HB LEU 79 -3.694 -0.991 15.502 639 2HB LEU 79 2HB LEU 79 -3.190 -2.387 14.571 640 HG LEU 79 HG LEU 79 -5.257 -1.661 13.061 641 1HD1 LEU 79 1HD1 LEU 79 -5.799 0.568 13.070 642 2HD1 LEU 79 2HD1 LEU 79 -4.294 1.046 13.846 643 3HD1 LEU 79 3HD1 LEU 79 -5.566 0.290 14.792 644 1HD2 LEU 79 1HD2 LEU 79 -2.659 -0.162 12.888 645 2HD2 LEU 79 2HD2 LEU 79 -3.715 -0.671 11.572 646 3HD2 LEU 79 3HD2 LEU 79 -2.804 -1.873 12.488 647 H GLN 80 H GLN 80 -4.953 -0.548 16.991 648 HA GLN 80 HA GLN 80 -7.770 0.148 16.640 649 1HB GLN 80 1HB GLN 80 -7.109 -1.264 18.778 650 2HB GLN 80 2HB GLN 80 -6.635 0.307 19.386 651 1HG GLN 80 1HG GLN 80 -8.853 1.151 19.135 652 2HG GLN 80 2HG GLN 80 -9.355 -0.307 18.279 653 1HE2 GLN 80 1HE2 GLN 80 -10.974 -0.794 19.727 654 2HE2 GLN 80 2HE2 GLN 80 -10.654 -1.359 21.328 655 H GLY 81 H GLY 81 -8.017 2.247 16.189 656 1HA GLY 81 1HA GLY 81 -6.714 4.374 17.487 657 2HA GLY 81 2HA GLY 81 -5.845 4.017 16.016 658 H LYS 82 H LYS 82 -6.352 5.328 14.428 659 HA LYS 82 HA LYS 82 -9.167 5.938 13.937 660 1HB LYS 82 1HB LYS 82 -7.128 8.131 13.772 661 2HB LYS 82 2HB LYS 82 -8.874 8.264 13.814 662 1HG LYS 82 1HG LYS 82 -8.760 7.369 16.172 663 2HG LYS 82 2HG LYS 82 -7.013 7.603 16.076 664 1HD LYS 82 1HD LYS 82 -8.015 9.528 17.129 665 2HD LYS 82 2HD LYS 82 -7.409 9.990 15.538 666 1HE LYS 82 1HE LYS 82 -9.459 10.480 14.772 667 2HE LYS 82 2HE LYS 82 -10.181 9.058 15.525 668 1HZ LYS 82 1HZ LYS 82 -10.341 11.714 16.363 669 2HZ LYS 82 2HZ LYS 82 -9.458 10.876 17.538 670 3HZ LYS 82 3HZ LYS 82 -11.004 10.346 17.105 671 H PHE 83 H PHE 83 -7.203 4.201 12.635 672 HA PHE 83 HA PHE 83 -6.683 5.542 10.090 673 1HB PHE 83 1HB PHE 83 -5.524 3.300 11.507 674 2HB PHE 83 2HB PHE 83 -5.971 2.827 9.871 675 HD1 PHE 83 HD1 PHE 83 -3.778 2.556 9.019 676 HD2 PHE 83 HD2 PHE 83 -4.935 6.228 10.829 677 HE1 PHE 83 HE1 PHE 83 -1.746 3.629 8.137 678 HE2 PHE 83 HE2 PHE 83 -2.909 7.306 9.951 679 HZ PHE 83 HZ PHE 83 -1.317 6.007 8.602 680 H THR 84 H THR 84 -9.318 5.422 10.619 681 HA THR 84 HA THR 84 -10.600 3.107 9.533 682 HB THR 84 HB THR 84 -12.638 4.291 9.893 683 HG1 THR 84 HG1 THR 84 -12.815 6.396 9.763 684 1HG2 THR 84 1HG2 THR 84 -12.391 5.350 12.128 685 2HG2 THR 84 2HG2 THR 84 -10.647 5.149 11.975 686 3HG2 THR 84 3HG2 THR 84 -11.696 3.737 12.011 687 H HIS 85 H HIS 85 -9.318 3.053 7.547 688 HA HIS 85 HA HIS 85 -8.891 3.472 5.347 689 1HB HIS 85 1HB HIS 85 -10.828 3.560 3.938 690 2HB HIS 85 2HB HIS 85 -11.224 2.545 5.316 691 HD2 HIS 85 HD2 HIS 85 -12.074 6.190 4.042 692 HE1 HIS 85 HE1 HIS 85 -15.057 4.902 6.767 693 HE2 HIS 85 HE2 HIS 85 -14.278 6.768 5.263 694 H PHE 86 H PHE 86 -8.295 5.651 7.019 695 HA PHE 86 HA PHE 86 -9.233 8.007 5.598 696 1HB PHE 86 1HB PHE 86 -8.069 7.471 8.220 697 2HB PHE 86 2HB PHE 86 -7.341 8.867 7.429 698 HD1 PHE 86 HD1 PHE 86 -10.830 7.682 7.115 699 HD2 PHE 86 HD2 PHE 86 -8.209 10.638 8.694 700 HE1 PHE 86 HE1 PHE 86 -12.770 9.053 7.751 701 HE2 PHE 86 HE2 PHE 86 -10.145 12.016 9.335 702 HZ PHE 86 HZ PHE 86 -12.429 11.224 8.863 703 H LEU 87 H LEU 87 -5.976 7.474 6.831 704 HA LEU 87 HA LEU 87 -4.765 8.713 4.596 705 1HB LEU 87 1HB LEU 87 -3.936 7.518 7.113 706 2HB LEU 87 2HB LEU 87 -2.805 7.161 5.823 707 HG LEU 87 HG LEU 87 -2.275 9.201 7.182 708 1HD1 LEU 87 1HD1 LEU 87 -1.497 10.454 5.326 709 2HD1 LEU 87 2HD1 LEU 87 -2.756 9.805 4.275 710 3HD1 LEU 87 3HD1 LEU 87 -1.460 8.757 4.850 711 1HD2 LEU 87 1HD2 LEU 87 -4.466 10.095 7.539 712 2HD2 LEU 87 2HD2 LEU 87 -4.749 10.231 5.805 713 3HD2 LEU 87 3HD2 LEU 87 -3.547 11.258 6.584 714 H ILE 88 H ILE 88 -5.301 5.350 5.514 715 HA ILE 88 HA ILE 88 -3.706 4.141 3.566 716 HB ILE 88 HB ILE 88 -6.307 2.989 4.554 717 1HG1 ILE 88 1HG1 ILE 88 -3.725 3.392 6.051 718 2HG1 ILE 88 2HG1 ILE 88 -5.376 3.626 6.602 719 1HG2 ILE 88 1HG2 ILE 88 -5.124 1.768 2.811 720 2HG2 ILE 88 2HG2 ILE 88 -5.150 0.867 4.323 721 3HG2 ILE 88 3HG2 ILE 88 -3.685 1.704 3.820 722 1HD1 ILE 88 1HD1 ILE 88 -4.992 1.705 7.695 723 2HD1 ILE 88 2HD1 ILE 88 -3.706 1.210 6.594 724 3HD1 ILE 88 3HD1 ILE 88 -5.395 0.972 6.141 725 H ASN 89 H ASN 89 -7.262 4.431 3.496 726 HA ASN 89 HA ASN 89 -7.630 3.627 0.877 727 1HB ASN 89 1HB ASN 89 -9.223 4.838 2.939 728 2HB ASN 89 2HB ASN 89 -9.636 5.540 1.379 729 1HD2 ASN 89 1HD2 ASN 89 -11.679 4.396 2.113 730 2HD2 ASN 89 2HD2 ASN 89 -11.888 2.772 1.560 731 H GLU 90 H GLU 90 -7.107 6.937 2.069 732 HA GLU 90 HA GLU 90 -7.537 8.288 -0.341 733 1HB GLU 90 1HB GLU 90 -6.531 8.905 2.259 734 2HB GLU 90 2HB GLU 90 -5.451 9.610 1.070 735 1HG GLU 90 1HG GLU 90 -6.989 11.097 0.347 736 2HG GLU 90 2HG GLU 90 -8.346 10.007 0.639 737 H ARG 91 H ARG 91 -4.407 7.309 1.070 738 HA ARG 91 HA ARG 91 -2.846 8.053 -1.131 739 1HB ARG 91 1HB ARG 91 -2.494 6.364 1.258 740 2HB ARG 91 2HB ARG 91 -1.392 6.039 -0.069 741 1HG ARG 91 1HG ARG 91 -1.774 8.681 1.318 742 2HG ARG 91 2HG ARG 91 -0.413 7.576 1.517 743 1HD ARG 91 1HD ARG 91 -0.998 8.379 -1.254 744 2HD ARG 91 2HD ARG 91 -0.443 9.669 -0.193 745 HE ARG 91 HE ARG 91 1.136 7.235 -0.170 746 1HH1 ARG 91 1HH1 ARG 91 0.738 10.470 -1.423 747 2HH1 ARG 91 2HH1 ARG 91 2.377 10.598 -1.960 748 1HH2 ARG 91 1HH2 ARG 91 3.293 7.398 -0.896 749 2HH2 ARG 91 2HH2 ARG 91 3.826 8.857 -1.666 750 H ILE 92 H ILE 92 -4.087 4.828 -0.212 751 HA ILE 92 HA ILE 92 -3.057 3.381 -2.333 752 HB ILE 92 HB ILE 92 -5.710 3.012 -0.934 753 1HG1 ILE 92 1HG1 ILE 92 -3.001 1.716 -0.583 754 2HG1 ILE 92 2HG1 ILE 92 -3.834 2.751 0.565 755 1HG2 ILE 92 1HG2 ILE 92 -4.872 0.560 -1.987 756 2HG2 ILE 92 2HG2 ILE 92 -4.682 1.723 -3.297 757 3HG2 ILE 92 3HG2 ILE 92 -6.247 1.533 -2.504 758 1HD1 ILE 92 1HD1 ILE 92 -3.827 0.140 0.799 759 2HD1 ILE 92 2HD1 ILE 92 -5.190 0.262 -0.306 760 3HD1 ILE 92 3HD1 ILE 92 -5.235 1.094 1.243 761 H GLU 93 H GLU 93 -6.306 4.822 -2.117 762 HA GLU 93 HA GLU 93 -7.212 4.297 -4.657 763 1HB GLU 93 1HB GLU 93 -8.477 5.371 -2.748 764 2HB GLU 93 2HB GLU 93 -7.724 6.894 -3.205 765 1HG GLU 93 1HG GLU 93 -8.769 6.787 -5.387 766 2HG GLU 93 2HG GLU 93 -9.473 5.218 -4.991 767 H ASP 94 H ASP 94 -4.909 6.690 -3.613 768 HA ASP 94 HA ASP 94 -4.918 8.203 -6.039 769 1HB ASP 94 1HB ASP 94 -4.186 9.091 -3.812 770 2HB ASP 94 2HB ASP 94 -2.755 8.071 -3.931 771 H TYR 95 H TYR 95 -3.213 5.400 -4.859 772 HA TYR 95 HA TYR 95 -1.278 5.438 -7.017 773 1HB TYR 95 1HB TYR 95 -0.782 4.627 -4.657 774 2HB TYR 95 2HB TYR 95 -1.758 3.212 -5.034 775 HD1 TYR 95 HD1 TYR 95 -0.414 1.369 -5.341 776 HD2 TYR 95 HD2 TYR 95 0.861 5.106 -6.926 777 HE1 TYR 95 HE1 TYR 95 1.556 0.273 -6.323 778 HE2 TYR 95 HE2 TYR 95 2.834 4.021 -7.915 779 HH TYR 95 HH TYR 95 4.027 1.222 -7.028 780 H VAL 96 H VAL 96 -3.782 3.175 -5.887 781 HA VAL 96 HA VAL 96 -3.719 1.493 -8.110 782 HB VAL 96 HB VAL 96 -4.814 0.934 -5.960 783 1HG1 VAL 96 1HG1 VAL 96 -6.755 1.861 -5.205 784 2HG1 VAL 96 2HG1 VAL 96 -7.301 2.314 -6.819 785 3HG1 VAL 96 3HG1 VAL 96 -6.055 3.263 -6.010 786 1HG2 VAL 96 1HG2 VAL 96 -5.993 0.521 -8.622 787 2HG2 VAL 96 2HG2 VAL 96 -7.019 0.101 -7.251 788 3HG2 VAL 96 3HG2 VAL 96 -5.431 -0.644 -7.428 789 H ASN 97 H ASN 97 -5.766 4.331 -7.461 790 HA ASN 97 HA ASN 97 -6.626 4.237 -10.273 791 1HB ASN 97 1HB ASN 97 -7.973 5.693 -7.989 792 2HB ASN 97 2HB ASN 97 -8.572 5.544 -9.636 793 1HD2 ASN 97 1HD2 ASN 97 -8.659 3.140 -10.360 794 2HD2 ASN 97 2HD2 ASN 97 -9.428 2.074 -9.237 795 H LYS 98 H LYS 98 -4.162 5.224 -10.049 796 HA LYS 98 HA LYS 98 -4.178 8.073 -9.597 797 1HB LYS 98 1HB LYS 98 -1.842 8.004 -10.294 798 2HB LYS 98 2HB LYS 98 -2.167 6.730 -9.130 799 1HG LYS 98 1HG LYS 98 -2.603 5.414 -11.450 800 2HG LYS 98 2HG LYS 98 -1.349 6.556 -11.936 801 1HD LYS 98 1HD LYS 98 -0.944 5.138 -9.371 802 2HD LYS 98 2HD LYS 98 -0.805 4.174 -10.842 803 1HE LYS 98 1HE LYS 98 0.894 5.651 -11.699 804 2HE LYS 98 2HE LYS 98 0.677 6.750 -10.337 805 1HZ LYS 98 1HZ LYS 98 1.860 5.430 -8.966 806 2HZ LYS 98 2HZ LYS 98 2.559 4.892 -10.408 807 3HZ LYS 98 3HZ LYS 98 1.328 3.991 -9.680 808 H PHE 99 H PHE 99 -4.959 6.028 -12.180 809 HA PHE 99 HA PHE 99 -4.248 7.829 -14.303 810 1HB PHE 99 1HB PHE 99 -5.182 6.253 -15.787 811 2HB PHE 99 2HB PHE 99 -4.473 5.294 -14.494 812 HD1 PHE 99 HD1 PHE 99 -5.954 4.287 -12.766 813 HD2 PHE 99 HD2 PHE 99 -7.487 6.181 -16.252 814 HE1 PHE 99 HE1 PHE 99 -8.115 3.162 -12.421 815 HE2 PHE 99 HE2 PHE 99 -9.652 5.062 -15.915 816 HZ PHE 99 HZ PHE 99 -9.968 3.551 -13.996 817 H VAL 100 H VAL 100 -7.303 6.860 -12.763 818 HA VAL 100 HA VAL 100 -8.799 8.837 -14.236 819 HB VAL 100 HB VAL 100 -9.892 6.752 -13.732 820 1HG1 VAL 100 1HG1 VAL 100 -10.489 6.249 -11.317 821 2HG1 VAL 100 2HG1 VAL 100 -9.244 7.417 -10.877 822 3HG1 VAL 100 3HG1 VAL 100 -8.814 5.976 -11.794 823 1HG2 VAL 100 1HG2 VAL 100 -11.944 7.560 -12.678 824 2HG2 VAL 100 2HG2 VAL 100 -11.304 8.740 -13.822 825 3HG2 VAL 100 3HG2 VAL 100 -11.085 8.983 -12.088 826 H ILE 101 H ILE 101 -7.029 8.782 -11.302 827 HA ILE 101 HA ILE 101 -8.508 11.064 -10.212 828 HB ILE 101 HB ILE 101 -6.239 9.498 -8.976 829 1HG1 ILE 101 1HG1 ILE 101 -8.397 8.242 -9.320 830 2HG1 ILE 101 2HG1 ILE 101 -7.885 8.380 -7.644 831 1HG2 ILE 101 1HG2 ILE 101 -7.308 10.653 -6.878 832 2HG2 ILE 101 2HG2 ILE 101 -7.846 11.837 -8.069 833 3HG2 ILE 101 3HG2 ILE 101 -6.125 11.505 -7.871 834 1HD1 ILE 101 1HD1 ILE 101 -9.503 10.573 -7.977 835 2HD1 ILE 101 2HD1 ILE 101 -9.967 9.039 -7.242 836 3HD1 ILE 101 3HD1 ILE 101 -10.294 9.335 -8.950 837 H CYS 102 H CYS 102 -5.172 10.160 -11.102 838 HA CYS 102 HA CYS 102 -4.299 12.918 -10.872 839 1HB CYS 102 1HB CYS 102 -2.920 10.802 -10.284 840 2HB CYS 102 2HB CYS 102 -2.638 10.690 -12.017 841 H HIS 103 H HIS 103 -6.139 11.561 -13.090 842 HA HIS 103 HA HIS 103 -6.593 11.911 -15.286 843 1HB HIS 103 1HB HIS 103 -4.763 14.303 -15.047 844 2HB HIS 103 2HB HIS 103 -6.081 14.075 -16.194 845 HD2 HIS 103 HD2 HIS 103 -5.619 16.193 -13.312 846 HE1 HIS 103 HE1 HIS 103 -9.582 14.770 -12.783 847 HE2 HIS 103 HE2 HIS 103 -7.845 16.427 -12.016 848 H GLU 104 H GLU 104 -4.742 10.012 -14.918 849 HA GLU 104 HA GLU 104 -2.971 8.892 -15.802 850 1HB GLU 104 1HB GLU 104 -4.640 8.880 -17.648 851 2HB GLU 104 2HB GLU 104 -3.852 10.300 -18.321 852 1HG GLU 104 1HG GLU 104 -3.103 8.366 -19.507 853 2HG GLU 104 2HG GLU 104 -1.769 8.996 -18.543 854 H CYS 105 H CYS 105 -1.471 10.253 -14.561 855 HA CYS 105 HA CYS 105 -0.143 12.450 -15.795 856 1HB CYS 105 1HB CYS 105 -0.305 11.544 -13.245 857 2HB CYS 105 2HB CYS 105 1.287 10.938 -13.689 858 H ASN 106 H ASN 106 -0.050 10.732 -17.786 859 HA ASN 106 HA ASN 106 2.237 9.021 -17.782 860 1HB ASN 106 1HB ASN 106 0.052 8.968 -19.251 861 2HB ASN 106 2HB ASN 106 0.967 10.024 -20.309 862 1HD2 ASN 106 1HD2 ASN 106 3.517 8.901 -19.926 863 2HD2 ASN 106 2HD2 ASN 106 3.519 7.333 -20.640 864 H ARG 107 H ARG 107 1.900 11.330 -20.414 865 HA ARG 107 HA ARG 107 4.555 12.368 -19.736 866 1HB ARG 107 1HB ARG 107 3.149 12.058 -22.374 867 2HB ARG 107 2HB ARG 107 4.597 13.034 -22.194 868 1HG ARG 107 1HG ARG 107 5.943 11.249 -22.124 869 2HG ARG 107 2HG ARG 107 4.831 10.320 -21.117 870 1HD ARG 107 1HD ARG 107 4.701 9.106 -23.047 871 2HD ARG 107 2HD ARG 107 3.415 10.273 -23.351 872 HE ARG 107 HE ARG 107 5.987 10.115 -24.679 873 1HH1 ARG 107 1HH1 ARG 107 3.076 11.971 -24.138 874 2HH1 ARG 107 2HH1 ARG 107 3.356 13.030 -25.474 875 1HH2 ARG 107 1HH2 ARG 107 6.343 11.507 -26.445 876 2HH2 ARG 107 2HH2 ARG 107 5.202 12.764 -26.787 877 HA PRO 108 HA PRO 108 1.310 15.859 -19.277 878 1HB PRO 108 1HB PRO 108 3.116 16.392 -16.974 879 2HB PRO 108 2HB PRO 108 1.357 16.514 -17.076 880 1HG PRO 108 1HG PRO 108 2.531 14.481 -15.806 881 2HG PRO 108 2HG PRO 108 1.044 14.251 -16.742 882 1HD PRO 108 1HD PRO 108 3.845 13.482 -17.409 883 2HD PRO 108 2HD PRO 108 2.315 12.688 -17.829 884 H ASP 109 H ASP 109 1.700 17.862 -20.098 885 HA ASP 109 HA ASP 109 4.330 18.406 -21.142 886 1HB ASP 109 1HB ASP 109 3.260 20.417 -22.121 887 2HB ASP 109 2HB ASP 109 2.380 18.939 -22.496 888 H THR 110 H THR 110 3.648 18.506 -18.150 889 HA THR 110 HA THR 110 4.681 21.200 -17.625 890 HB THR 110 HB THR 110 3.527 19.776 -15.337 891 HG1 THR 110 HG1 THR 110 2.027 19.071 -16.818 892 1HG2 THR 110 1HG2 THR 110 3.581 21.897 -14.690 893 2HG2 THR 110 2HG2 THR 110 2.162 22.133 -15.707 894 3HG2 THR 110 3HG2 THR 110 3.766 22.483 -16.341 895 H ARG 111 H ARG 111 5.767 21.179 -15.316 896 HA ARG 111 HA ARG 111 8.009 19.363 -15.592 897 1HB ARG 111 1HB ARG 111 7.646 22.006 -14.716 898 2HB ARG 111 2HB ARG 111 8.146 21.103 -13.294 899 1HG ARG 111 1HG ARG 111 9.879 20.208 -15.224 900 2HG ARG 111 2HG ARG 111 9.671 21.912 -15.634 901 1HD ARG 111 1HD ARG 111 11.028 22.482 -13.976 902 2HD ARG 111 2HD ARG 111 9.948 21.717 -12.817 903 HE ARG 111 HE ARG 111 11.204 19.656 -13.154 904 1HH1 ARG 111 1HH1 ARG 111 12.707 22.626 -14.233 905 2HH1 ARG 111 2HH1 ARG 111 14.309 21.981 -14.155 906 1HH2 ARG 111 1HH2 ARG 111 13.312 18.818 -13.061 907 2HH2 ARG 111 2HH2 ARG 111 14.654 19.824 -13.493 908 H ILE 112 H ILE 112 7.806 17.420 -14.738 909 HA ILE 112 HA ILE 112 6.446 17.093 -12.152 910 HB ILE 112 HB ILE 112 7.194 14.950 -14.143 911 1HG1 ILE 112 1HG1 ILE 112 4.392 15.239 -14.003 912 2HG1 ILE 112 2HG1 ILE 112 5.038 16.866 -14.190 913 1HG2 ILE 112 1HG2 ILE 112 5.263 14.833 -11.838 914 2HG2 ILE 112 2HG2 ILE 112 6.932 14.270 -11.766 915 3HG2 ILE 112 3HG2 ILE 112 5.790 13.501 -12.865 916 1HD1 ILE 112 1HD1 ILE 112 4.616 14.947 -16.176 917 2HD1 ILE 112 2HD1 ILE 112 6.365 15.080 -15.990 918 3HD1 ILE 112 3HD1 ILE 112 5.403 16.517 -16.339 919 H ILE 113 H ILE 113 7.452 16.036 -10.447 920 HA ILE 113 HA ILE 113 10.225 15.157 -10.779 921 HB ILE 113 HB ILE 113 10.906 16.393 -8.724 922 1HG1 ILE 113 1HG1 ILE 113 8.445 18.087 -9.132 923 2HG1 ILE 113 2HG1 ILE 113 8.462 16.739 -8.002 924 1HG2 ILE 113 1HG2 ILE 113 11.705 17.366 -10.668 925 2HG2 ILE 113 2HG2 ILE 113 10.866 18.703 -9.882 926 3HG2 ILE 113 3HG2 ILE 113 10.097 17.841 -11.213 927 1HD1 ILE 113 1HD1 ILE 113 10.661 18.031 -7.187 928 2HD1 ILE 113 2HD1 ILE 113 9.047 18.351 -6.553 929 3HD1 ILE 113 3HD1 ILE 113 9.722 19.388 -7.809 930 H ARG 114 H ARG 114 10.611 13.311 -9.647 931 HA ARG 114 HA ARG 114 8.813 12.702 -7.397 932 1HB ARG 114 1HB ARG 114 8.671 11.374 -9.765 933 2HB ARG 114 2HB ARG 114 9.828 10.373 -8.894 934 1HG ARG 114 1HG ARG 114 7.958 10.676 -6.993 935 2HG ARG 114 2HG ARG 114 6.950 10.781 -8.426 936 1HD ARG 114 1HD ARG 114 8.500 8.648 -9.031 937 2HD ARG 114 2HD ARG 114 8.381 8.503 -7.279 938 HE ARG 114 HE ARG 114 6.167 7.951 -7.503 939 1HH1 ARG 114 1HH1 ARG 114 7.279 9.366 -10.486 940 2HH1 ARG 114 2HH1 ARG 114 5.851 8.939 -11.367 941 1HH2 ARG 114 1HH2 ARG 114 4.291 7.377 -8.657 942 2HH2 ARG 114 2HH2 ARG 114 4.155 7.807 -10.329 943 H GLU 115 H GLU 115 9.843 12.358 -5.553 944 HA GLU 115 HA GLU 115 12.602 11.336 -5.664 945 1HB GLU 115 1HB GLU 115 13.201 12.743 -3.778 946 2HB GLU 115 2HB GLU 115 12.587 13.733 -5.095 947 1HG GLU 115 1HG GLU 115 10.642 14.258 -3.969 948 2HG GLU 115 2HG GLU 115 10.748 12.849 -2.917 949 H GLY 116 H GLY 116 13.119 9.700 -4.317 950 1HA GLY 116 1HA GLY 116 12.889 8.498 -2.254 951 2HA GLY 116 2HA GLY 116 11.204 8.982 -2.201 952 H ARG 117 H ARG 117 12.440 7.885 -5.229 953 HA ARG 117 HA ARG 117 11.918 6.087 -6.520 954 1HB ARG 117 1HB ARG 117 13.216 5.162 -4.278 955 2HB ARG 117 2HB ARG 117 11.780 4.151 -4.325 956 1HG ARG 117 1HG ARG 117 12.453 3.045 -6.166 957 2HG ARG 117 2HG ARG 117 13.190 4.476 -6.888 958 1HD ARG 117 1HD ARG 117 15.095 3.348 -6.412 959 2HD ARG 117 2HD ARG 117 14.872 4.124 -4.847 960 HE ARG 117 HE ARG 117 14.121 1.340 -5.464 961 1HH1 ARG 117 1HH1 ARG 117 15.115 3.796 -3.177 962 2HH1 ARG 117 2HH1 ARG 117 15.269 2.679 -1.867 963 1HH2 ARG 117 1HH2 ARG 117 14.327 -0.116 -3.734 964 2HH2 ARG 117 2HH2 ARG 117 14.823 0.465 -2.179 965 H ILE 118 H ILE 118 9.749 7.209 -6.600 966 HA ILE 118 HA ILE 118 7.502 7.018 -6.816 967 HB ILE 118 HB ILE 118 7.765 4.153 -5.935 968 1HG1 ILE 118 1HG1 ILE 118 7.687 4.895 -8.818 969 2HG1 ILE 118 2HG1 ILE 118 9.209 5.141 -7.969 970 1HG2 ILE 118 1HG2 ILE 118 5.566 5.787 -6.740 971 2HG2 ILE 118 2HG2 ILE 118 5.569 4.086 -6.274 972 3HG2 ILE 118 3HG2 ILE 118 5.827 4.540 -7.959 973 1HD1 ILE 118 1HD1 ILE 118 7.846 2.518 -7.693 974 2HD1 ILE 118 2HD1 ILE 118 9.566 2.910 -7.683 975 3HD1 ILE 118 3HD1 ILE 118 8.675 2.893 -9.205 976 H SER 119 H SER 119 7.982 8.382 -4.726 977 HA SER 119 HA SER 119 6.073 7.419 -2.740 978 1HB SER 119 1HB SER 119 7.474 7.718 -0.873 979 2HB SER 119 2HB SER 119 8.486 6.874 -2.044 980 HG SER 119 HG SER 119 9.595 8.628 -1.122 981 H LEU 120 H LEU 120 8.135 10.142 -3.772 982 HA LEU 120 HA LEU 120 5.923 11.957 -3.042 983 1HB LEU 120 1HB LEU 120 8.884 12.336 -2.665 984 2HB LEU 120 2HB LEU 120 7.761 13.679 -2.656 985 HG LEU 120 HG LEU 120 6.792 11.713 -0.834 986 1HD1 LEU 120 1HD1 LEU 120 9.109 10.887 -0.788 987 2HD1 LEU 120 2HD1 LEU 120 8.616 11.594 0.750 988 3HD1 LEU 120 3HD1 LEU 120 9.659 12.502 -0.344 989 1HD2 LEU 120 1HD2 LEU 120 6.367 14.137 -0.777 990 2HD2 LEU 120 2HD2 LEU 120 8.053 14.406 -0.341 991 3HD2 LEU 120 3HD2 LEU 120 6.988 13.529 0.756 992 H LEU 121 H LEU 121 5.555 13.732 -4.427 993 HA LEU 121 HA LEU 121 7.229 14.390 -6.605 994 1HB LEU 121 1HB LEU 121 6.533 12.291 -7.537 995 2HB LEU 121 2HB LEU 121 4.853 12.634 -7.204 996 HG LEU 121 HG LEU 121 6.139 14.596 -8.972 997 1HD1 LEU 121 1HD1 LEU 121 7.182 13.158 -10.303 998 2HD1 LEU 121 2HD1 LEU 121 5.578 12.611 -10.786 999 3HD1 LEU 121 3HD1 LEU 121 6.450 11.769 -9.516 1000 1HD2 LEU 121 1HD2 LEU 121 3.679 14.342 -8.375 1001 2HD2 LEU 121 2HD2 LEU 121 3.682 12.942 -9.449 1002 3HD2 LEU 121 3HD2 LEU 121 4.074 14.541 -10.081 1003 H LYS 122 H LYS 122 6.223 15.984 -8.079 1004 HA LYS 122 HA LYS 122 4.042 17.428 -6.726 1005 1HB LYS 122 1HB LYS 122 6.616 18.310 -7.565 1006 2HB LYS 122 2HB LYS 122 5.418 19.126 -8.563 1007 1HG LYS 122 1HG LYS 122 4.365 19.308 -6.024 1008 2HG LYS 122 2HG LYS 122 6.091 19.518 -5.773 1009 1HD LYS 122 1HD LYS 122 6.161 21.347 -7.323 1010 2HD LYS 122 2HD LYS 122 4.480 21.070 -7.788 1011 1HE LYS 122 1HE LYS 122 3.659 21.848 -5.750 1012 2HE LYS 122 2HE LYS 122 5.208 21.633 -4.939 1013 1HZ LYS 122 1HZ LYS 122 4.767 23.959 -5.324 1014 2HZ LYS 122 2HZ LYS 122 4.585 23.693 -6.985 1015 3HZ LYS 122 3HZ LYS 122 6.094 23.470 -6.253 1016 H CYS 123 H CYS 123 2.257 17.994 -7.849 1017 HA CYS 123 HA CYS 123 2.230 17.524 -10.751 1018 1HB CYS 123 1HB CYS 123 0.295 16.484 -8.696 1019 2HB CYS 123 2HB CYS 123 -0.200 16.727 -10.364 1020 H GLU 124 H GLU 124 2.622 19.967 -9.539 1021 HA GLU 124 HA GLU 124 0.541 21.595 -8.901 1022 1HB GLU 124 1HB GLU 124 1.884 23.388 -10.241 1023 2HB GLU 124 2HB GLU 124 2.609 22.632 -8.828 1024 1HG GLU 124 1HG GLU 124 4.144 21.488 -10.047 1025 2HG GLU 124 2HG GLU 124 3.093 21.353 -11.456 1026 H ALA 125 H ALA 125 1.387 20.438 -12.112 1027 HA ALA 125 HA ALA 125 -0.364 22.126 -13.560 1028 1HB ALA 125 1HB ALA 125 0.040 19.549 -14.816 1029 2HB ALA 125 2HB ALA 125 1.549 20.219 -14.196 1030 3HB ALA 125 3HB ALA 125 0.570 21.148 -15.330 1031 H CYS 126 H CYS 126 -0.713 18.606 -13.299 1032 HA CYS 126 HA CYS 126 -3.564 18.785 -13.602 1033 1HB CYS 126 1HB CYS 126 -3.500 16.338 -13.494 1034 2HB CYS 126 2HB CYS 126 -2.271 16.944 -14.598 1035 H GLY 127 H GLY 127 -3.129 20.247 -11.420 1036 1HA GLY 127 1HA GLY 127 -4.511 20.216 -9.438 1037 2HA GLY 127 2HA GLY 127 -4.106 18.518 -9.244 1038 H ALA 128 H ALA 128 -2.855 18.197 -7.552 1039 HA ALA 128 HA ALA 128 -0.458 19.789 -7.184 1040 1HB ALA 128 1HB ALA 128 -0.905 20.497 -4.969 1041 2HB ALA 128 2HB ALA 128 -2.379 19.531 -4.882 1042 3HB ALA 128 3HB ALA 128 -2.314 20.949 -5.928 1043 H LYS 129 H LYS 129 1.074 18.801 -5.783 1044 HA LYS 129 HA LYS 129 0.483 16.185 -4.688 1045 1HB LYS 129 1HB LYS 129 1.349 16.290 -7.285 1046 2HB LYS 129 2HB LYS 129 2.851 16.093 -6.415 1047 1HG LYS 129 1HG LYS 129 2.266 13.916 -6.811 1048 2HG LYS 129 2HG LYS 129 1.582 14.170 -5.205 1049 1HD LYS 129 1HD LYS 129 -0.588 14.753 -6.342 1050 2HD LYS 129 2HD LYS 129 0.142 14.206 -7.851 1051 1HE LYS 129 1HE LYS 129 -1.112 12.383 -6.988 1052 2HE LYS 129 2HE LYS 129 0.591 12.011 -6.723 1053 1HZ LYS 129 1HZ LYS 129 -1.484 12.708 -4.769 1054 2HZ LYS 129 2HZ LYS 129 0.121 13.115 -4.427 1055 3HZ LYS 129 3HZ LYS 129 -0.300 11.501 -4.697 1056 H ALA 130 H ALA 130 2.151 15.402 -3.283 1057 HA ALA 130 HA ALA 130 3.630 17.550 -2.036 1058 1HB ALA 130 1HB ALA 130 3.717 16.239 -0.175 1059 2HB ALA 130 2HB ALA 130 3.895 14.747 -1.097 1060 3HB ALA 130 3HB ALA 130 2.315 15.519 -0.966 1061 HA PRO 131 HA PRO 131 7.236 16.293 -4.523 1062 1HB PRO 131 1HB PRO 131 8.674 18.542 -4.049 1063 2HB PRO 131 2HB PRO 131 7.413 18.451 -5.276 1064 1HG PRO 131 1HG PRO 131 7.300 19.605 -2.520 1065 2HG PRO 131 2HG PRO 131 6.599 20.226 -4.023 1066 1HD PRO 131 1HD PRO 131 5.147 18.896 -2.144 1067 2HD PRO 131 2HD PRO 131 4.760 18.871 -3.874 1068 H LEU 132 H LEU 132 7.656 18.077 -1.463 1069 HA LEU 132 HA LEU 132 9.271 15.912 -0.401 1070 1HB LEU 132 1HB LEU 132 11.125 17.441 0.198 1071 2HB LEU 132 2HB LEU 132 10.952 17.198 -1.530 1072 HG LEU 132 HG LEU 132 9.590 19.562 -0.358 1073 1HD1 LEU 132 1HD1 LEU 132 12.171 19.141 0.404 1074 2HD1 LEU 132 2HD1 LEU 132 11.409 20.722 0.237 1075 3HD1 LEU 132 3HD1 LEU 132 12.379 20.067 -1.082 1076 1HD2 LEU 132 1HD2 LEU 132 9.446 20.111 -2.504 1077 2HD2 LEU 132 2HD2 LEU 132 10.210 18.575 -2.915 1078 3HD2 LEU 132 3HD2 LEU 132 11.198 20.018 -2.686 1079 H LYS 133 H LYS 133 10.204 16.874 1.861 1080 HA LYS 133 HA LYS 133 7.935 17.173 3.494 1081 1HB LYS 133 1HB LYS 133 10.873 17.218 3.885 1082 2HB LYS 133 2HB LYS 133 9.902 17.973 5.143 1083 1HG LYS 133 1HG LYS 133 8.821 15.407 4.379 1084 2HG LYS 133 2HG LYS 133 10.507 15.277 4.883 1085 1HD LYS 133 1HD LYS 133 9.338 16.990 6.743 1086 2HD LYS 133 2HD LYS 133 8.133 15.732 6.472 1087 1HE LYS 133 1HE LYS 133 10.940 14.861 6.828 1088 2HE LYS 133 2HE LYS 133 10.109 15.488 8.251 1089 1HZ LYS 133 1HZ LYS 133 8.574 13.792 8.210 1090 2HZ LYS 133 2HZ LYS 133 9.971 12.986 7.704 1091 3HZ LYS 133 3HZ LYS 133 8.809 13.453 6.569 1092 H ASN 134 H ASN 134 6.845 18.900 4.190 1093 HA ASN 134 HA ASN 134 7.444 21.482 3.102 1094 1HB ASN 134 1HB ASN 134 5.207 20.200 4.465 1095 2HB ASN 134 2HB ASN 134 5.459 21.856 5.009 1096 1HD2 ASN 134 1HD2 ASN 134 4.063 19.911 2.692 1097 2HD2 ASN 134 2HD2 ASN 134 3.700 21.120 1.513 1098 H VAL 135 H VAL 135 7.085 23.401 4.778 1099 HA VAL 135 HA VAL 135 8.955 22.939 7.011 1100 HB VAL 135 HB VAL 135 8.653 25.481 5.401 1101 1HG1 VAL 135 1HG1 VAL 135 9.309 26.139 7.544 1102 2HG1 VAL 135 2HG1 VAL 135 10.827 26.017 6.655 1103 3HG1 VAL 135 3HG1 VAL 135 10.347 24.729 7.761 1104 1HG2 VAL 135 1HG2 VAL 135 10.209 24.742 3.992 1105 2HG2 VAL 135 2HG2 VAL 135 10.023 23.146 4.719 1106 3HG2 VAL 135 3HG2 VAL 135 11.261 24.250 5.318 Start of MODEL 14 1 H MET 1 H MET 1 -0.394 -11.707 -20.547 2 HA MET 1 HA MET 1 -2.621 -11.344 -18.851 3 1HB MET 1 1HB MET 1 0.121 -12.449 -18.848 4 2HB MET 1 2HB MET 1 -0.477 -11.926 -17.280 5 1HG MET 1 1HG MET 1 -2.115 -13.521 -17.214 6 2HG MET 1 2HG MET 1 -2.213 -13.651 -18.969 7 1HE MET 1 1HE MET 1 -2.645 -15.901 -17.761 8 2HE MET 1 2HE MET 1 -1.471 -16.626 -16.663 9 3HE MET 1 3HE MET 1 -1.516 -17.119 -18.357 10 H ASP 2 H ASP 2 0.687 -10.023 -18.609 11 HA ASP 2 HA ASP 2 -0.463 -7.664 -17.269 12 1HB ASP 2 1HB ASP 2 2.120 -9.117 -16.674 13 2HB ASP 2 2HB ASP 2 1.715 -7.539 -16.008 14 H ASP 3 H ASP 3 1.562 -5.966 -17.148 15 HA ASP 3 HA ASP 3 2.103 -5.391 -19.959 16 1HB ASP 3 1HB ASP 3 2.607 -3.119 -19.205 17 2HB ASP 3 2HB ASP 3 1.032 -3.638 -18.612 18 H TYR 4 H TYR 4 3.686 -6.788 -17.364 19 HA TYR 4 HA TYR 4 5.830 -7.459 -17.041 20 1HB TYR 4 1HB TYR 4 5.721 -6.843 -19.897 21 2HB TYR 4 2HB TYR 4 7.335 -6.658 -19.218 22 HD1 TYR 4 HD1 TYR 4 8.656 -8.544 -18.712 23 HD2 TYR 4 HD2 TYR 4 4.532 -9.048 -19.624 24 HE1 TYR 4 HE1 TYR 4 8.985 -10.978 -18.827 25 HE2 TYR 4 HE2 TYR 4 4.848 -11.483 -19.741 26 HH TYR 4 HH TYR 4 6.946 -13.127 -18.494 27 H GLU 5 H GLU 5 6.384 -6.155 -15.361 28 HA GLU 5 HA GLU 5 7.083 -3.404 -15.678 29 1HB GLU 5 1HB GLU 5 7.870 -3.610 -13.303 30 2HB GLU 5 2HB GLU 5 6.197 -4.079 -13.568 31 1HG GLU 5 1HG GLU 5 7.499 -6.457 -13.868 32 2HG GLU 5 2HG GLU 5 8.473 -5.656 -12.639 33 H LYS 6 H LYS 6 9.240 -2.576 -14.864 34 HA LYS 6 HA LYS 6 11.417 -4.266 -15.913 35 1HB LYS 6 1HB LYS 6 10.737 -2.236 -17.306 36 2HB LYS 6 2HB LYS 6 11.392 -1.253 -16.005 37 1HG LYS 6 1HG LYS 6 12.995 -1.536 -17.817 38 2HG LYS 6 2HG LYS 6 13.581 -2.263 -16.319 39 1HD LYS 6 1HD LYS 6 12.050 -4.081 -18.038 40 2HD LYS 6 2HD LYS 6 13.558 -3.498 -18.748 41 1HE LYS 6 1HE LYS 6 14.510 -4.113 -16.367 42 2HE LYS 6 2HE LYS 6 13.114 -5.188 -16.338 43 1HZ LYS 6 1HZ LYS 6 13.880 -6.304 -18.258 44 2HZ LYS 6 2HZ LYS 6 15.212 -6.181 -17.223 45 3HZ LYS 6 3HZ LYS 6 15.079 -5.148 -18.556 46 H LEU 7 H LEU 7 12.837 -4.828 -14.416 47 HA LEU 7 HA LEU 7 12.853 -3.804 -11.797 48 1HB LEU 7 1HB LEU 7 14.240 -5.841 -13.296 49 2HB LEU 7 2HB LEU 7 15.364 -4.982 -12.260 50 HG LEU 7 HG LEU 7 13.095 -5.540 -10.674 51 1HD1 LEU 7 1HD1 LEU 7 12.785 -7.887 -10.844 52 2HD1 LEU 7 2HD1 LEU 7 14.067 -8.035 -12.046 53 3HD1 LEU 7 3HD1 LEU 7 12.560 -7.218 -12.460 54 1HD2 LEU 7 1HD2 LEU 7 14.640 -6.447 -9.246 55 2HD2 LEU 7 2HD2 LEU 7 15.692 -5.470 -10.270 56 3HD2 LEU 7 3HD2 LEU 7 15.559 -7.208 -10.545 57 H LEU 8 H LEU 8 15.770 -3.785 -13.815 58 HA LEU 8 HA LEU 8 16.702 -1.386 -12.548 59 1HB LEU 8 1HB LEU 8 17.768 -3.386 -14.420 60 2HB LEU 8 2HB LEU 8 18.383 -1.763 -14.667 61 HG LEU 8 HG LEU 8 18.529 -2.255 -11.887 62 1HD1 LEU 8 1HD1 LEU 8 19.133 -4.367 -11.556 63 2HD1 LEU 8 2HD1 LEU 8 20.248 -4.339 -12.922 64 3HD1 LEU 8 3HD1 LEU 8 18.543 -4.707 -13.183 65 1HD2 LEU 8 1HD2 LEU 8 20.001 -0.895 -13.467 66 2HD2 LEU 8 2HD2 LEU 8 20.824 -2.415 -13.818 67 3HD2 LEU 8 3HD2 LEU 8 20.807 -1.782 -12.172 68 H GLU 9 H GLU 9 15.131 0.166 -13.089 69 HA GLU 9 HA GLU 9 14.753 0.826 -15.900 70 1HB GLU 9 1HB GLU 9 13.589 2.325 -13.563 71 2HB GLU 9 2HB GLU 9 12.981 2.230 -15.209 72 1HG GLU 9 1HG GLU 9 11.877 0.315 -14.830 73 2HG GLU 9 2HG GLU 9 13.147 -0.340 -13.799 74 H ARG 10 H ARG 10 16.326 1.990 -16.808 75 HA ARG 10 HA ARG 10 17.659 4.061 -15.217 76 1HB ARG 10 1HB ARG 10 18.481 2.286 -17.393 77 2HB ARG 10 2HB ARG 10 18.982 3.953 -17.635 78 1HG ARG 10 1HG ARG 10 20.677 3.637 -16.252 79 2HG ARG 10 2HG ARG 10 19.544 3.291 -14.944 80 1HD ARG 10 1HD ARG 10 20.586 1.293 -14.918 81 2HD ARG 10 2HD ARG 10 19.499 0.936 -16.259 82 HE ARG 10 HE ARG 10 21.852 2.129 -17.243 83 1HH1 ARG 10 1HH1 ARG 10 20.732 -0.857 -15.828 84 2HH1 ARG 10 2HH1 ARG 10 21.927 -1.828 -16.620 85 1HH2 ARG 10 1HH2 ARG 10 23.426 0.857 -18.285 86 2HH2 ARG 10 2HH2 ARG 10 23.459 -0.854 -18.015 87 H ALA 11 H ALA 11 17.769 6.174 -15.872 88 HA ALA 11 HA ALA 11 17.258 8.105 -16.961 89 1HB ALA 11 1HB ALA 11 16.016 7.886 -19.225 90 2HB ALA 11 2HB ALA 11 16.425 6.179 -19.088 91 3HB ALA 11 3HB ALA 11 17.703 7.390 -19.107 92 H ILE 12 H ILE 12 15.499 6.644 -15.085 93 HA ILE 12 HA ILE 12 12.909 7.817 -15.843 94 HB ILE 12 HB ILE 12 13.573 5.521 -14.007 95 1HG1 ILE 12 1HG1 ILE 12 11.690 4.494 -15.437 96 2HG1 ILE 12 2HG1 ILE 12 11.918 5.880 -16.499 97 1HG2 ILE 12 1HG2 ILE 12 11.067 7.170 -14.104 98 2HG2 ILE 12 2HG2 ILE 12 12.019 6.690 -12.701 99 3HG2 ILE 12 3HG2 ILE 12 11.056 5.491 -13.563 100 1HD1 ILE 12 1HD1 ILE 12 13.142 3.971 -17.318 101 2HD1 ILE 12 2HD1 ILE 12 13.992 3.827 -15.780 102 3HD1 ILE 12 3HD1 ILE 12 14.258 5.234 -16.806 103 H ASP 13 H ASP 13 15.520 7.902 -13.606 104 HA ASP 13 HA ASP 13 14.313 10.199 -12.286 105 1HB ASP 13 1HB ASP 13 14.852 7.606 -10.995 106 2HB ASP 13 2HB ASP 13 15.449 9.012 -10.119 107 H GLN 14 H GLN 14 17.092 8.486 -13.388 108 HA GLN 14 HA GLN 14 18.954 10.272 -12.048 109 1HB GLN 14 1HB GLN 14 19.327 7.913 -13.891 110 2HB GLN 14 2HB GLN 14 20.668 8.919 -13.360 111 1HG GLN 14 1HG GLN 14 19.334 8.264 -11.020 112 2HG GLN 14 2HG GLN 14 19.291 6.787 -11.980 113 1HE2 GLN 14 1HE2 GLN 14 21.561 6.548 -13.199 114 2HE2 GLN 14 2HE2 GLN 14 22.914 6.597 -12.125 115 H LEU 15 H LEU 15 18.825 9.197 -15.436 116 HA LEU 15 HA LEU 15 20.144 11.354 -16.544 117 1HB LEU 15 1HB LEU 15 19.605 9.222 -17.683 118 2HB LEU 15 2HB LEU 15 17.934 9.732 -17.805 119 HG LEU 15 HG LEU 15 19.565 11.765 -18.970 120 1HD1 LEU 15 1HD1 LEU 15 20.042 9.678 -20.823 121 2HD1 LEU 15 2HD1 LEU 15 20.714 9.180 -19.272 122 3HD1 LEU 15 3HD1 LEU 15 21.216 10.705 -20.002 123 1HD2 LEU 15 1HD2 LEU 15 17.614 9.771 -20.107 124 2HD2 LEU 15 2HD2 LEU 15 18.255 11.159 -20.985 125 3HD2 LEU 15 3HD2 LEU 15 17.261 11.406 -19.550 126 HA PRO 16 HA PRO 16 17.572 14.953 -16.087 127 1HB PRO 16 1HB PRO 16 18.031 15.903 -18.713 128 2HB PRO 16 2HB PRO 16 18.920 16.351 -17.255 129 1HG PRO 16 1HG PRO 16 19.587 14.316 -19.332 130 2HG PRO 16 2HG PRO 16 20.667 15.382 -18.413 131 1HD PRO 16 1HD PRO 16 20.497 12.810 -17.789 132 2HD PRO 16 2HD PRO 16 20.556 14.033 -16.501 133 HA PRO 17 HA PRO 17 13.835 13.255 -17.896 134 1HB PRO 17 1HB PRO 17 12.189 15.324 -17.117 135 2HB PRO 17 2HB PRO 17 12.626 13.952 -16.094 136 1HG PRO 17 1HG PRO 17 13.782 16.708 -16.163 137 2HG PRO 17 2HG PRO 17 13.412 15.682 -14.765 138 1HD PRO 17 1HD PRO 17 15.921 15.967 -15.678 139 2HD PRO 17 2HD PRO 17 15.341 14.423 -15.020 140 H GLU 18 H GLU 18 13.215 16.718 -18.057 141 HA GLU 18 HA GLU 18 12.885 18.141 -19.795 142 1HB GLU 18 1HB GLU 18 15.091 16.432 -20.674 143 2HB GLU 18 2HB GLU 18 14.168 17.108 -22.009 144 1HG GLU 18 1HG GLU 18 15.881 18.640 -21.624 145 2HG GLU 18 2HG GLU 18 14.459 19.358 -20.868 146 H VAL 19 H VAL 19 13.141 15.034 -21.507 147 HA VAL 19 HA VAL 19 10.783 15.576 -23.038 148 HB VAL 19 HB VAL 19 12.026 12.850 -22.861 149 1HG1 VAL 19 1HG1 VAL 19 10.449 14.409 -24.860 150 2HG1 VAL 19 2HG1 VAL 19 10.197 12.769 -24.264 151 3HG1 VAL 19 3HG1 VAL 19 11.503 13.102 -25.402 152 1HG2 VAL 19 1HG2 VAL 19 13.096 15.078 -24.587 153 2HG2 VAL 19 2HG2 VAL 19 13.720 13.434 -24.447 154 3HG2 VAL 19 3HG2 VAL 19 13.853 14.546 -23.086 155 H PHE 20 H PHE 20 8.985 13.991 -23.178 156 HA PHE 20 HA PHE 20 7.905 13.550 -20.545 157 1HB PHE 20 1HB PHE 20 6.738 12.962 -23.272 158 2HB PHE 20 2HB PHE 20 5.868 12.917 -21.749 159 HD1 PHE 20 HD1 PHE 20 5.780 15.098 -20.385 160 HD2 PHE 20 HD2 PHE 20 6.828 14.921 -24.506 161 HE1 PHE 20 HE1 PHE 20 5.238 17.486 -20.621 162 HE2 PHE 20 HE2 PHE 20 6.288 17.308 -24.750 163 HZ PHE 20 HZ PHE 20 5.493 18.596 -22.805 164 H GLU 21 H GLU 21 7.047 11.528 -19.792 165 HA GLU 21 HA GLU 21 7.734 9.075 -21.135 166 1HB GLU 21 1HB GLU 21 9.480 10.192 -19.079 167 2HB GLU 21 2HB GLU 21 8.931 8.567 -18.690 168 1HG GLU 21 1HG GLU 21 9.768 7.762 -20.833 169 2HG GLU 21 2HG GLU 21 10.301 9.393 -21.240 170 H THR 22 H THR 22 6.766 7.226 -20.180 171 HA THR 22 HA THR 22 4.602 7.900 -18.313 172 HB THR 22 HB THR 22 3.739 6.991 -20.336 173 HG1 THR 22 HG1 THR 22 3.052 6.032 -18.218 174 1HG2 THR 22 1HG2 THR 22 5.744 4.774 -20.018 175 2HG2 THR 22 2HG2 THR 22 5.632 5.947 -21.330 176 3HG2 THR 22 3HG2 THR 22 4.378 4.723 -21.133 177 H LYS 23 H LYS 23 4.282 6.785 -16.428 178 HA LYS 23 HA LYS 23 6.521 5.113 -15.554 179 1HB LYS 23 1HB LYS 23 5.386 5.453 -13.252 180 2HB LYS 23 2HB LYS 23 6.260 6.795 -13.973 181 1HG LYS 23 1HG LYS 23 4.392 7.897 -13.337 182 2HG LYS 23 2HG LYS 23 3.842 7.359 -14.921 183 1HD LYS 23 1HD LYS 23 2.326 5.938 -14.051 184 2HD LYS 23 2HD LYS 23 3.399 5.442 -12.739 185 1HE LYS 23 1HE LYS 23 1.322 6.672 -12.030 186 2HE LYS 23 2HE LYS 23 2.840 7.349 -11.443 187 1HZ LYS 23 1HZ LYS 23 0.895 8.739 -12.701 188 2HZ LYS 23 2HZ LYS 23 1.983 8.448 -13.962 189 3HZ LYS 23 3HZ LYS 23 2.506 9.236 -12.560 190 H ARG 24 H ARG 24 6.215 3.116 -14.537 191 HA ARG 24 HA ARG 24 3.823 1.702 -15.430 192 1HB ARG 24 1HB ARG 24 6.561 0.896 -14.541 193 2HB ARG 24 2HB ARG 24 5.254 -0.271 -14.410 194 1HG ARG 24 1HG ARG 24 5.412 1.073 -17.007 195 2HG ARG 24 2HG ARG 24 6.818 0.086 -16.602 196 1HD ARG 24 1HD ARG 24 5.679 -1.834 -16.818 197 2HD ARG 24 2HD ARG 24 4.260 -1.192 -15.995 198 HE ARG 24 HE ARG 24 3.466 -0.364 -18.059 199 1HH1 ARG 24 1HH1 ARG 24 6.426 -2.197 -18.403 200 2HH1 ARG 24 2HH1 ARG 24 6.203 -2.462 -20.098 201 1HH2 ARG 24 1HH2 ARG 24 3.183 -0.716 -20.284 202 2HH2 ARG 24 2HH2 ARG 24 4.368 -1.623 -21.166 203 H PHE 25 H PHE 25 2.591 2.971 -13.747 204 HA PHE 25 HA PHE 25 2.950 1.959 -11.029 205 1HB PHE 25 1HB PHE 25 1.644 4.326 -12.244 206 2HB PHE 25 2HB PHE 25 0.901 3.684 -10.784 207 HD1 PHE 25 HD1 PHE 25 1.426 5.824 -9.667 208 HD2 PHE 25 HD2 PHE 25 4.479 3.272 -11.183 209 HE1 PHE 25 HE1 PHE 25 3.096 7.014 -8.306 210 HE2 PHE 25 HE2 PHE 25 6.151 4.457 -9.823 211 HZ PHE 25 HZ PHE 25 5.458 6.327 -8.382 212 H GLU 26 H GLU 26 2.021 0.042 -10.688 213 HA GLU 26 HA GLU 26 -0.848 -0.204 -11.179 214 1HB GLU 26 1HB GLU 26 1.183 -2.243 -12.103 215 2HB GLU 26 2HB GLU 26 -0.548 -2.535 -12.024 216 1HG GLU 26 1HG GLU 26 0.173 -0.143 -13.532 217 2HG GLU 26 2HG GLU 26 0.814 -1.639 -14.207 218 H VAL 27 H VAL 27 -1.584 -0.467 -9.159 219 HA VAL 27 HA VAL 27 -0.653 -2.750 -7.629 220 HB VAL 27 HB VAL 27 -0.657 -0.009 -6.359 221 1HG1 VAL 27 1HG1 VAL 27 -0.465 -2.763 -5.336 222 2HG1 VAL 27 2HG1 VAL 27 -1.025 -1.290 -4.542 223 3HG1 VAL 27 3HG1 VAL 27 0.703 -1.621 -4.672 224 1HG2 VAL 27 1HG2 VAL 27 1.820 -0.421 -6.146 225 2HG2 VAL 27 2HG2 VAL 27 1.244 -0.078 -7.777 226 3HG2 VAL 27 3HG2 VAL 27 1.621 -1.735 -7.305 227 HA PRO 28 HA PRO 28 -5.286 -1.534 -7.664 228 1HB PRO 28 1HB PRO 28 -5.349 -4.430 -8.349 229 2HB PRO 28 2HB PRO 28 -6.366 -3.109 -8.941 230 1HG PRO 28 1HG PRO 28 -4.433 -4.089 -10.474 231 2HG PRO 28 2HG PRO 28 -4.742 -2.343 -10.418 232 1HD PRO 28 1HD PRO 28 -2.554 -3.924 -9.137 233 2HD PRO 28 2HD PRO 28 -2.505 -2.305 -9.861 234 H LYS 29 H LYS 29 -6.928 -2.421 -6.242 235 HA LYS 29 HA LYS 29 -7.669 -3.214 -4.252 236 1HB LYS 29 1HB LYS 29 -5.776 -5.245 -5.194 237 2HB LYS 29 2HB LYS 29 -5.989 -5.250 -3.451 238 1HG LYS 29 1HG LYS 29 -8.472 -5.080 -5.009 239 2HG LYS 29 2HG LYS 29 -7.567 -6.584 -5.189 240 1HD LYS 29 1HD LYS 29 -7.819 -5.630 -2.425 241 2HD LYS 29 2HD LYS 29 -9.347 -6.062 -3.195 242 1HE LYS 29 1HE LYS 29 -6.949 -7.869 -3.268 243 2HE LYS 29 2HE LYS 29 -8.109 -7.904 -1.940 244 1HZ LYS 29 1HZ LYS 29 -9.863 -8.364 -3.562 245 2HZ LYS 29 2HZ LYS 29 -8.666 -9.558 -3.584 246 3HZ LYS 29 3HZ LYS 29 -8.717 -8.390 -4.807 247 H ALA 30 H ALA 30 -6.179 -4.247 -2.038 248 HA ALA 30 HA ALA 30 -4.760 -3.649 -0.344 249 1HB ALA 30 1HB ALA 30 -2.851 -2.657 -0.904 250 2HB ALA 30 2HB ALA 30 -3.680 -1.155 -1.303 251 3HB ALA 30 3HB ALA 30 -3.508 -2.419 -2.521 252 H TYR 31 H TYR 31 -6.863 -3.258 0.625 253 HA TYR 31 HA TYR 31 -7.097 -0.488 1.457 254 1HB TYR 31 1HB TYR 31 -9.479 -0.338 0.934 255 2HB TYR 31 2HB TYR 31 -8.540 -0.625 -0.526 256 HD1 TYR 31 HD1 TYR 31 -11.508 -1.402 0.931 257 HD2 TYR 31 HD2 TYR 31 -8.184 -3.373 -0.852 258 HE1 TYR 31 HE1 TYR 31 -12.938 -3.331 0.407 259 HE2 TYR 31 HE2 TYR 31 -9.608 -5.306 -1.374 260 HH TYR 31 HH TYR 31 -12.556 -5.387 -1.673 261 H SER 32 H SER 32 -7.364 -0.405 3.557 262 HA SER 32 HA SER 32 -7.774 -2.728 5.139 263 1HB SER 32 1HB SER 32 -7.991 0.095 6.151 264 2HB SER 32 2HB SER 32 -7.393 -1.331 6.996 265 HG SER 32 HG SER 32 -5.731 -1.273 5.188 266 H VAL 33 H VAL 33 -9.323 -2.187 7.195 267 HA VAL 33 HA VAL 33 -11.971 -1.449 6.186 268 HB VAL 33 HB VAL 33 -12.810 -3.469 7.608 269 1HG1 VAL 33 1HG1 VAL 33 -12.460 -4.945 5.506 270 2HG1 VAL 33 2HG1 VAL 33 -11.706 -3.503 4.826 271 3HG1 VAL 33 3HG1 VAL 33 -13.387 -3.452 5.356 272 1HG2 VAL 33 1HG2 VAL 33 -10.332 -3.921 8.249 273 2HG2 VAL 33 2HG2 VAL 33 -10.271 -4.736 6.687 274 3HG2 VAL 33 3HG2 VAL 33 -11.417 -5.271 7.916 275 H ILE 34 H ILE 34 -13.238 -0.419 7.619 276 HA ILE 34 HA ILE 34 -12.069 0.236 10.218 277 HB ILE 34 HB ILE 34 -14.561 1.439 9.034 278 1HG1 ILE 34 1HG1 ILE 34 -12.151 3.038 8.698 279 2HG1 ILE 34 2HG1 ILE 34 -12.068 1.528 7.799 280 1HG2 ILE 34 1HG2 ILE 34 -13.775 1.770 11.478 281 2HG2 ILE 34 2HG2 ILE 34 -14.284 3.169 10.539 282 3HG2 ILE 34 3HG2 ILE 34 -12.568 2.837 10.766 283 1HD1 ILE 34 1HD1 ILE 34 -14.636 2.789 7.471 284 2HD1 ILE 34 2HD1 ILE 34 -13.456 2.295 6.256 285 3HD1 ILE 34 3HD1 ILE 34 -13.321 3.877 7.026 286 H GLN 35 H GLN 35 -13.282 0.128 12.162 287 HA GLN 35 HA GLN 35 -15.869 -1.115 12.211 288 1HB GLN 35 1HB GLN 35 -13.720 -2.851 12.143 289 2HB GLN 35 2HB GLN 35 -14.068 -2.720 13.861 290 1HG GLN 35 1HG GLN 35 -15.393 -4.488 13.250 291 2HG GLN 35 2HG GLN 35 -16.522 -3.140 13.127 292 1HE2 GLN 35 1HE2 GLN 35 -17.067 -2.345 11.063 293 2HE2 GLN 35 2HE2 GLN 35 -16.883 -3.323 9.651 294 H GLY 36 H GLY 36 -16.530 0.654 13.398 295 1HA GLY 36 1HA GLY 36 -17.000 1.786 15.347 296 2HA GLY 36 2HA GLY 36 -16.110 0.539 16.211 297 H ASN 37 H ASN 37 -13.702 0.681 16.015 298 HA ASN 37 HA ASN 37 -12.585 3.275 15.440 299 1HB ASN 37 1HB ASN 37 -11.599 3.422 17.802 300 2HB ASN 37 2HB ASN 37 -13.296 3.854 17.614 301 1HD2 ASN 37 1HD2 ASN 37 -11.241 1.057 18.328 302 2HD2 ASN 37 2HD2 ASN 37 -12.292 0.368 19.511 303 H ARG 38 H ARG 38 -12.324 0.265 14.894 304 HA ARG 38 HA ARG 38 -9.410 0.164 15.258 305 1HB ARG 38 1HB ARG 38 -10.721 -2.460 15.099 306 2HB ARG 38 2HB ARG 38 -9.428 -1.909 16.148 307 1HG ARG 38 1HG ARG 38 -10.866 -1.959 17.826 308 2HG ARG 38 2HG ARG 38 -11.718 -0.608 17.082 309 1HD ARG 38 1HD ARG 38 -13.414 -1.911 16.403 310 2HD ARG 38 2HD ARG 38 -12.348 -3.229 15.939 311 HE ARG 38 HE ARG 38 -13.364 -2.724 18.654 312 1HH1 ARG 38 1HH1 ARG 38 -11.928 -4.883 16.303 313 2HH1 ARG 38 2HH1 ARG 38 -12.126 -6.284 17.296 314 1HH2 ARG 38 1HH2 ARG 38 -13.620 -4.574 19.947 315 2HH2 ARG 38 2HH2 ARG 38 -13.083 -6.112 19.357 316 H THR 39 H THR 39 -8.224 -0.618 13.540 317 HA THR 39 HA THR 39 -9.743 -0.986 11.051 318 HB THR 39 HB THR 39 -7.661 0.789 11.669 319 HG1 THR 39 HG1 THR 39 -8.476 0.033 9.067 320 1HG2 THR 39 1HG2 THR 39 -6.682 -1.004 9.495 321 2HG2 THR 39 2HG2 THR 39 -6.101 -1.152 11.152 322 3HG2 THR 39 3HG2 THR 39 -5.862 0.350 10.265 323 H PHE 40 H PHE 40 -9.876 -3.008 10.351 324 HA PHE 40 HA PHE 40 -8.061 -5.028 11.368 325 1HB PHE 40 1HB PHE 40 -10.492 -5.256 9.598 326 2HB PHE 40 2HB PHE 40 -9.563 -6.621 10.184 327 HD1 PHE 40 HD1 PHE 40 -11.221 -7.724 11.385 328 HD2 PHE 40 HD2 PHE 40 -10.463 -3.608 12.163 329 HE1 PHE 40 HE1 PHE 40 -12.660 -7.838 13.375 330 HE2 PHE 40 HE2 PHE 40 -11.894 -3.719 14.152 331 HZ PHE 40 HZ PHE 40 -12.997 -5.832 14.763 332 H ILE 41 H ILE 41 -6.190 -4.146 10.156 333 HA ILE 41 HA ILE 41 -6.010 -4.113 7.369 334 HB ILE 41 HB ILE 41 -4.158 -3.950 9.582 335 1HG1 ILE 41 1HG1 ILE 41 -2.862 -2.633 7.876 336 2HG1 ILE 41 2HG1 ILE 41 -4.095 -3.075 6.697 337 1HG2 ILE 41 1HG2 ILE 41 -3.385 -6.166 8.643 338 2HG2 ILE 41 2HG2 ILE 41 -2.180 -4.890 8.698 339 3HG2 ILE 41 3HG2 ILE 41 -2.960 -5.295 7.170 340 1HD1 ILE 41 1HD1 ILE 41 -4.104 -0.872 8.363 341 2HD1 ILE 41 2HD1 ILE 41 -5.251 -1.989 9.098 342 3HD1 ILE 41 3HD1 ILE 41 -5.460 -1.493 7.422 343 H GLN 42 H GLN 42 -6.242 -5.753 5.948 344 HA GLN 42 HA GLN 42 -5.726 -8.492 6.885 345 1HB GLN 42 1HB GLN 42 -6.980 -9.112 4.721 346 2HB GLN 42 2HB GLN 42 -7.910 -8.481 6.070 347 1HG GLN 42 1HG GLN 42 -7.085 -6.294 4.457 348 2HG GLN 42 2HG GLN 42 -7.773 -7.531 3.411 349 1HE2 GLN 42 1HE2 GLN 42 -8.976 -5.094 3.714 350 2HE2 GLN 42 2HE2 GLN 42 -10.463 -5.280 4.572 351 H ASN 43 H ASN 43 -5.081 -6.244 4.258 352 HA ASN 43 HA ASN 43 -2.891 -8.000 3.376 353 1HB ASN 43 1HB ASN 43 -3.000 -6.746 1.224 354 2HB ASN 43 2HB ASN 43 -4.486 -7.618 1.591 355 1HD2 ASN 43 1HD2 ASN 43 -6.312 -6.453 2.245 356 2HD2 ASN 43 2HD2 ASN 43 -6.472 -4.765 1.916 357 H PHE 44 H PHE 44 -2.134 -6.761 5.529 358 HA PHE 44 HA PHE 44 -1.369 -4.148 5.622 359 1HB PHE 44 1HB PHE 44 0.728 -5.024 6.875 360 2HB PHE 44 2HB PHE 44 -0.856 -5.354 7.552 361 HD1 PHE 44 HD1 PHE 44 2.142 -6.771 6.108 362 HD2 PHE 44 HD2 PHE 44 -1.830 -7.611 7.384 363 HE1 PHE 44 HE1 PHE 44 2.665 -9.175 6.144 364 HE2 PHE 44 HE2 PHE 44 -1.315 -10.014 7.421 365 HZ PHE 44 HZ PHE 44 0.936 -10.800 6.802 366 H ARG 45 H ARG 45 0.505 -6.780 4.134 367 HA ARG 45 HA ARG 45 2.665 -5.204 3.295 368 1HB ARG 45 1HB ARG 45 2.122 -7.845 3.263 369 2HB ARG 45 2HB ARG 45 1.877 -7.465 1.563 370 1HG ARG 45 1HG ARG 45 4.361 -6.723 3.081 371 2HG ARG 45 2HG ARG 45 4.179 -8.226 2.171 372 1HD ARG 45 1HD ARG 45 4.212 -7.164 0.147 373 2HD ARG 45 2HD ARG 45 3.542 -5.671 0.796 374 HE ARG 45 HE ARG 45 6.133 -6.123 1.831 375 1HH1 ARG 45 1HH1 ARG 45 4.473 -5.118 -1.071 376 2HH1 ARG 45 2HH1 ARG 45 5.796 -4.161 -1.645 377 1HH2 ARG 45 1HH2 ARG 45 7.871 -4.866 1.077 378 2HH2 ARG 45 2HH2 ARG 45 7.726 -4.019 -0.426 379 H GLU 46 H GLU 46 -0.303 -6.136 1.586 380 HA GLU 46 HA GLU 46 0.364 -4.753 -0.809 381 1HB GLU 46 1HB GLU 46 -1.523 -6.596 -0.172 382 2HB GLU 46 2HB GLU 46 -2.497 -5.134 -0.215 383 1HG GLU 46 1HG GLU 46 -1.313 -4.730 -2.493 384 2HG GLU 46 2HG GLU 46 -0.974 -6.457 -2.413 385 H VAL 47 H VAL 47 -2.040 -3.997 1.721 386 HA VAL 47 HA VAL 47 -2.738 -1.477 0.781 387 HB VAL 47 HB VAL 47 -3.932 -2.741 2.582 388 1HG1 VAL 47 1HG1 VAL 47 -1.505 -2.765 3.858 389 2HG1 VAL 47 2HG1 VAL 47 -3.059 -3.169 4.586 390 3HG1 VAL 47 3HG1 VAL 47 -2.406 -1.539 4.750 391 1HG2 VAL 47 1HG2 VAL 47 -3.453 -0.089 3.776 392 2HG2 VAL 47 2HG2 VAL 47 -4.960 -0.865 3.288 393 3HG2 VAL 47 3HG2 VAL 47 -3.926 -0.109 2.076 394 H ALA 48 H ALA 48 0.028 -2.504 2.664 395 HA ALA 48 HA ALA 48 0.852 0.012 3.590 396 1HB ALA 48 1HB ALA 48 1.763 -2.103 4.453 397 2HB ALA 48 2HB ALA 48 3.023 -0.977 3.960 398 3HB ALA 48 3HB ALA 48 2.608 -2.342 2.923 399 H ASP 49 H ASP 49 2.120 -1.876 0.870 400 HA ASP 49 HA ASP 49 3.843 -0.056 -0.223 401 1HB ASP 49 1HB ASP 49 3.450 -2.408 -1.016 402 2HB ASP 49 2HB ASP 49 2.018 -1.826 -1.858 403 H ALA 50 H ALA 50 0.500 -0.478 -1.446 404 HA ALA 50 HA ALA 50 0.387 1.641 -3.142 405 1HB ALA 50 1HB ALA 50 -2.056 1.676 -2.718 406 2HB ALA 50 2HB ALA 50 -1.787 0.570 -1.368 407 3HB ALA 50 3HB ALA 50 -1.388 0.070 -3.012 408 H LEU 51 H LEU 51 -0.777 1.926 0.255 409 HA LEU 51 HA LEU 51 -1.078 4.720 0.115 410 1HB LEU 51 1HB LEU 51 -2.336 3.848 1.820 411 2HB LEU 51 2HB LEU 51 -1.120 2.684 2.278 412 HG LEU 51 HG LEU 51 0.154 4.495 3.367 413 1HD1 LEU 51 1HD1 LEU 51 -2.190 6.293 3.165 414 2HD1 LEU 51 2HD1 LEU 51 -1.086 6.182 1.798 415 3HD1 LEU 51 3HD1 LEU 51 -0.480 6.678 3.375 416 1HD2 LEU 51 1HD2 LEU 51 -1.165 3.325 4.892 417 2HD2 LEU 51 2HD2 LEU 51 -2.663 3.909 4.198 418 3HD2 LEU 51 3HD2 LEU 51 -1.661 4.992 5.158 419 H ASN 52 H ASN 52 1.701 2.798 0.377 420 HA ASN 52 HA ASN 52 3.486 4.912 0.225 421 1HB ASN 52 1HB ASN 52 2.615 5.053 2.708 422 2HB ASN 52 2HB ASN 52 3.748 3.729 2.962 423 1HD2 ASN 52 1HD2 ASN 52 3.664 6.848 1.266 424 2HD2 ASN 52 2HD2 ASN 52 5.220 7.373 1.803 425 H ARG 53 H ARG 53 5.028 3.970 -0.923 426 HA ARG 53 HA ARG 53 5.427 1.329 -1.383 427 1HB ARG 53 1HB ARG 53 6.704 3.632 -2.144 428 2HB ARG 53 2HB ARG 53 7.968 2.796 -1.254 429 1HG ARG 53 1HG ARG 53 8.036 2.300 -3.650 430 2HG ARG 53 2HG ARG 53 7.732 0.854 -2.685 431 1HD ARG 53 1HD ARG 53 5.414 0.880 -3.238 432 2HD ARG 53 2HD ARG 53 5.551 2.474 -3.974 433 HE ARG 53 HE ARG 53 7.008 0.197 -5.123 434 1HH1 ARG 53 1HH1 ARG 53 4.565 2.683 -5.424 435 2HH1 ARG 53 2HH1 ARG 53 4.368 2.452 -7.127 436 1HH2 ARG 53 1HH2 ARG 53 6.740 -0.101 -7.365 437 2HH2 ARG 53 2HH2 ARG 53 5.598 0.875 -8.227 438 H ASP 54 H ASP 54 7.278 3.208 1.022 439 HA ASP 54 HA ASP 54 8.595 0.929 2.089 440 1HB ASP 54 1HB ASP 54 8.146 3.670 3.293 441 2HB ASP 54 2HB ASP 54 9.241 2.452 3.940 442 HA PRO 55 HA PRO 55 5.142 -0.571 4.491 443 1HB PRO 55 1HB PRO 55 6.450 -2.510 5.854 444 2HB PRO 55 2HB PRO 55 6.005 -2.675 4.152 445 1HG PRO 55 1HG PRO 55 8.642 -1.949 5.360 446 2HG PRO 55 2HG PRO 55 8.293 -3.024 3.995 447 1HD PRO 55 1HD PRO 55 9.159 -0.462 3.688 448 2HD PRO 55 2HD PRO 55 8.121 -1.284 2.506 449 H GLN 56 H GLN 56 8.273 -0.143 6.138 450 HA GLN 56 HA GLN 56 7.355 0.050 8.747 451 1HB GLN 56 1HB GLN 56 9.796 0.551 7.352 452 2HB GLN 56 2HB GLN 56 9.498 1.895 8.445 453 1HG GLN 56 1HG GLN 56 9.064 0.083 10.214 454 2HG GLN 56 2HG GLN 56 9.877 -1.000 9.085 455 1HE2 GLN 56 1HE2 GLN 56 11.869 -1.330 9.745 456 2HE2 GLN 56 2HE2 GLN 56 12.961 -0.129 10.337 457 H HIS 57 H HIS 57 7.083 2.304 6.162 458 HA HIS 57 HA HIS 57 6.701 4.649 7.739 459 1HB HIS 57 1HB HIS 57 7.009 4.152 5.044 460 2HB HIS 57 2HB HIS 57 5.320 4.634 5.156 461 HD2 HIS 57 HD2 HIS 57 8.865 6.189 5.468 462 HE1 HIS 57 HE1 HIS 57 6.015 9.291 5.979 463 HE2 HIS 57 HE2 HIS 57 8.445 8.739 5.606 464 H LEU 58 H LEU 58 4.372 2.734 5.860 465 HA LEU 58 HA LEU 58 2.021 3.816 6.708 466 1HB LEU 58 1HB LEU 58 2.772 1.564 5.302 467 2HB LEU 58 2HB LEU 58 1.908 0.897 6.675 468 HG LEU 58 HG LEU 58 0.310 2.997 5.746 469 1HD1 LEU 58 1HD1 LEU 58 1.163 3.242 3.639 470 2HD1 LEU 58 2HD1 LEU 58 0.003 1.947 3.346 471 3HD1 LEU 58 3HD1 LEU 58 1.713 1.576 3.555 472 1HD2 LEU 58 1HD2 LEU 58 -1.140 1.050 4.973 473 2HD2 LEU 58 2HD2 LEU 58 -0.672 1.073 6.673 474 3HD2 LEU 58 3HD2 LEU 58 0.160 0.003 5.544 475 H LEU 59 H LEU 59 3.917 1.334 8.397 476 HA LEU 59 HA LEU 59 2.125 0.820 10.474 477 1HB LEU 59 1HB LEU 59 4.180 -0.493 9.956 478 2HB LEU 59 2HB LEU 59 5.131 0.789 10.685 479 HG LEU 59 HG LEU 59 3.015 -0.177 12.448 480 1HD1 LEU 59 1HD1 LEU 59 4.466 -2.273 12.954 481 2HD1 LEU 59 2HD1 LEU 59 4.957 -2.111 11.268 482 3HD1 LEU 59 3HD1 LEU 59 3.255 -2.331 11.673 483 1HD2 LEU 59 1HD2 LEU 59 4.851 1.281 13.150 484 2HD2 LEU 59 2HD2 LEU 59 6.008 0.013 12.750 485 3HD2 LEU 59 3HD2 LEU 59 4.842 -0.236 14.050 486 H LYS 60 H LYS 60 4.929 3.014 10.518 487 HA LYS 60 HA LYS 60 4.474 4.116 13.037 488 1HB LYS 60 1HB LYS 60 5.600 5.662 10.705 489 2HB LYS 60 2HB LYS 60 5.948 5.883 12.414 490 1HG LYS 60 1HG LYS 60 6.590 3.249 11.228 491 2HG LYS 60 2HG LYS 60 7.600 4.621 10.773 492 1HD LYS 60 1HD LYS 60 8.731 3.989 12.634 493 2HD LYS 60 2HD LYS 60 7.517 5.005 13.416 494 1HE LYS 60 1HE LYS 60 6.211 3.132 14.034 495 2HE LYS 60 2HE LYS 60 7.128 2.056 12.981 496 1HZ LYS 60 1HZ LYS 60 7.943 3.244 15.557 497 2HZ LYS 60 2HZ LYS 60 9.096 2.673 14.459 498 3HZ LYS 60 3HZ LYS 60 7.940 1.615 15.095 499 H PHE 61 H PHE 61 2.967 4.747 9.972 500 HA PHE 61 HA PHE 61 1.808 7.243 10.630 501 1HB PHE 61 1HB PHE 61 1.858 5.480 8.391 502 2HB PHE 61 2HB PHE 61 0.180 5.890 8.729 503 HD1 PHE 61 HD1 PHE 61 3.008 6.855 6.967 504 HD2 PHE 61 HD2 PHE 61 -0.169 8.479 9.286 505 HE1 PHE 61 HE1 PHE 61 3.346 9.043 5.892 506 HE2 PHE 61 HE2 PHE 61 0.159 10.667 8.212 507 HZ PHE 61 HZ PHE 61 1.919 10.953 6.515 508 H LEU 62 H LEU 62 0.524 3.918 10.719 509 HA LEU 62 HA LEU 62 -2.059 4.567 11.547 510 1HB LEU 62 1HB LEU 62 -0.562 2.104 12.423 511 2HB LEU 62 2HB LEU 62 -2.295 2.293 12.234 512 HG LEU 62 HG LEU 62 -0.876 2.810 9.746 513 1HD1 LEU 62 1HD1 LEU 62 0.401 1.003 9.485 514 2HD1 LEU 62 2HD1 LEU 62 -0.807 -0.059 10.207 515 3HD1 LEU 62 3HD1 LEU 62 0.318 0.825 11.237 516 1HD2 LEU 62 1HD2 LEU 62 -2.767 0.555 10.111 517 2HD2 LEU 62 2HD2 LEU 62 -2.676 1.764 8.831 518 3HD2 LEU 62 3HD2 LEU 62 -3.375 2.186 10.395 519 H LEU 63 H LEU 63 0.771 3.670 13.579 520 HA LEU 63 HA LEU 63 -0.573 4.090 16.027 521 1HB LEU 63 1HB LEU 63 2.388 4.391 15.648 522 2HB LEU 63 2HB LEU 63 1.521 3.829 17.065 523 HG LEU 63 HG LEU 63 0.953 2.086 14.854 524 1HD1 LEU 63 1HD1 LEU 63 3.188 3.018 14.105 525 2HD1 LEU 63 2HD1 LEU 63 3.076 1.265 14.267 526 3HD1 LEU 63 3HD1 LEU 63 3.879 2.217 15.515 527 1HD2 LEU 63 1HD2 LEU 63 2.653 0.971 16.897 528 2HD2 LEU 63 2HD2 LEU 63 0.963 0.626 16.528 529 3HD2 LEU 63 3HD2 LEU 63 1.374 1.955 17.610 530 H ARG 64 H ARG 64 1.016 6.225 13.801 531 HA ARG 64 HA ARG 64 1.565 8.387 15.505 532 1HB ARG 64 1HB ARG 64 2.438 8.227 13.213 533 2HB ARG 64 2HB ARG 64 0.816 8.459 12.576 534 1HG ARG 64 1HG ARG 64 0.867 10.673 13.913 535 2HG ARG 64 2HG ARG 64 2.615 10.426 13.929 536 1HD ARG 64 1HD ARG 64 1.937 9.952 11.300 537 2HD ARG 64 2HD ARG 64 0.858 11.269 11.759 538 HE ARG 64 HE ARG 64 3.450 11.890 12.627 539 1HH1 ARG 64 1HH1 ARG 64 1.640 11.535 9.662 540 2HH1 ARG 64 2HH1 ARG 64 2.637 12.638 8.774 541 1HH2 ARG 64 1HH2 ARG 64 4.758 13.351 11.457 542 2HH2 ARG 64 2HH2 ARG 64 4.405 13.666 9.791 543 H GLU 65 H GLU 65 -1.378 7.486 13.767 544 HA GLU 65 HA GLU 65 -2.762 9.776 14.982 545 1HB GLU 65 1HB GLU 65 -3.601 7.943 12.733 546 2HB GLU 65 2HB GLU 65 -4.591 9.244 13.382 547 1HG GLU 65 1HG GLU 65 -1.868 9.969 12.504 548 2HG GLU 65 2HG GLU 65 -3.017 9.523 11.245 549 H LEU 66 H LEU 66 -2.476 6.357 15.180 550 HA LEU 66 HA LEU 66 -4.945 5.553 16.162 551 1HB LEU 66 1HB LEU 66 -2.188 4.590 16.254 552 2HB LEU 66 2HB LEU 66 -3.129 4.087 17.637 553 HG LEU 66 HG LEU 66 -4.682 2.902 16.251 554 1HD1 LEU 66 1HD1 LEU 66 -4.104 4.760 14.312 555 2HD1 LEU 66 2HD1 LEU 66 -5.075 3.305 14.090 556 3HD1 LEU 66 3HD1 LEU 66 -3.361 3.290 13.687 557 1HD2 LEU 66 1HD2 LEU 66 -3.179 1.269 16.364 558 2HD2 LEU 66 2HD2 LEU 66 -1.838 2.395 16.156 559 3HD2 LEU 66 3HD2 LEU 66 -2.662 1.734 14.744 560 H GLY 67 H GLY 67 -6.057 6.492 17.773 561 1HA GLY 67 1HA GLY 67 -4.722 7.892 19.918 562 2HA GLY 67 2HA GLY 67 -6.456 7.729 19.700 563 H THR 68 H THR 68 -5.902 4.706 19.464 564 HA THR 68 HA THR 68 -5.961 4.231 22.352 565 HB THR 68 HB THR 68 -7.275 2.351 22.004 566 HG1 THR 68 HG1 THR 68 -5.730 1.921 19.930 567 1HG2 THR 68 1HG2 THR 68 -8.860 2.863 20.030 568 2HG2 THR 68 2HG2 THR 68 -7.962 4.377 19.932 569 3HG2 THR 68 3HG2 THR 68 -8.809 3.951 21.417 570 H ALA 69 H ALA 69 -5.105 2.005 22.975 571 HA ALA 69 HA ALA 69 -2.491 1.797 23.133 572 1HB ALA 69 1HB ALA 69 -4.532 0.026 23.564 573 2HB ALA 69 2HB ALA 69 -2.830 -0.270 23.916 574 3HB ALA 69 3HB ALA 69 -3.526 -0.833 22.396 575 H GLY 70 H GLY 70 -4.043 -0.027 20.468 576 1HA GLY 70 1HA GLY 70 -3.366 -0.134 18.231 577 2HA GLY 70 2HA GLY 70 -1.964 0.845 18.633 578 H ASN 71 H ASN 71 -3.131 -2.287 18.039 579 HA ASN 71 HA ASN 71 -0.488 -3.377 18.063 580 1HB ASN 71 1HB ASN 71 -1.791 -3.507 20.499 581 2HB ASN 71 2HB ASN 71 -2.107 -5.088 19.791 582 1HD2 ASN 71 1HD2 ASN 71 -0.098 -3.514 21.771 583 2HD2 ASN 71 2HD2 ASN 71 1.350 -4.429 21.544 584 H LEU 72 H LEU 72 -0.486 -5.712 17.432 585 HA LEU 72 HA LEU 72 -2.467 -6.121 15.361 586 1HB LEU 72 1HB LEU 72 -0.040 -7.734 16.158 587 2HB LEU 72 2HB LEU 72 -1.067 -8.102 14.784 588 HG LEU 72 HG LEU 72 -0.473 -5.839 13.848 589 1HD1 LEU 72 1HD1 LEU 72 1.724 -4.942 14.787 590 2HD1 LEU 72 2HD1 LEU 72 1.350 -5.885 16.229 591 3HD1 LEU 72 3HD1 LEU 72 0.253 -4.609 15.700 592 1HD2 LEU 72 1HD2 LEU 72 2.123 -7.176 14.116 593 2HD2 LEU 72 2HD2 LEU 72 1.180 -6.805 12.674 594 3HD2 LEU 72 3HD2 LEU 72 0.799 -8.235 13.631 595 H GLU 73 H GLU 73 -4.363 -7.003 15.884 596 HA GLU 73 HA GLU 73 -4.430 -9.085 17.957 597 1HB GLU 73 1HB GLU 73 -5.885 -7.027 18.218 598 2HB GLU 73 2HB GLU 73 -6.785 -7.579 16.815 599 1HG GLU 73 1HG GLU 73 -6.482 -9.628 18.858 600 2HG GLU 73 2HG GLU 73 -7.340 -8.193 19.419 601 H GLY 74 H GLY 74 -5.800 -10.959 17.575 602 1HA GLY 74 1HA GLY 74 -6.439 -12.769 16.312 603 2HA GLY 74 2HA GLY 74 -6.988 -11.593 15.125 604 H GLY 75 H GLY 75 -6.101 -13.891 14.122 605 1HA GLY 75 1HA GLY 75 -3.386 -14.250 13.670 606 2HA GLY 75 2HA GLY 75 -4.651 -14.721 12.545 607 H ARG 76 H ARG 76 -5.533 -11.876 12.325 608 HA ARG 76 HA ARG 76 -3.591 -11.098 10.292 609 1HB ARG 76 1HB ARG 76 -6.282 -11.197 10.202 610 2HB ARG 76 2HB ARG 76 -6.067 -9.526 10.708 611 1HG ARG 76 1HG ARG 76 -5.706 -8.968 8.614 612 2HG ARG 76 2HG ARG 76 -4.253 -9.964 8.608 613 1HD ARG 76 1HD ARG 76 -7.040 -10.925 7.974 614 2HD ARG 76 2HD ARG 76 -5.805 -10.535 6.780 615 HE ARG 76 HE ARG 76 -5.901 -12.873 8.507 616 1HH1 ARG 76 1HH1 ARG 76 -4.051 -10.971 6.230 617 2HH1 ARG 76 2HH1 ARG 76 -2.990 -12.275 5.818 618 1HH2 ARG 76 1HH2 ARG 76 -4.505 -14.582 7.961 619 2HH2 ARG 76 2HH2 ARG 76 -3.246 -14.323 6.800 620 H ALA 77 H ALA 77 -4.131 -8.328 10.215 621 HA ALA 77 HA ALA 77 -2.764 -7.479 12.677 622 1HB ALA 77 1HB ALA 77 -2.662 -5.452 10.680 623 2HB ALA 77 2HB ALA 77 -2.224 -6.992 9.941 624 3HB ALA 77 3HB ALA 77 -1.343 -6.410 11.352 625 H ILE 78 H ILE 78 -4.892 -7.431 13.742 626 HA ILE 78 HA ILE 78 -6.694 -5.291 12.909 627 HB ILE 78 HB ILE 78 -6.997 -6.962 15.388 628 1HG1 ILE 78 1HG1 ILE 78 -6.666 -8.536 13.557 629 2HG1 ILE 78 2HG1 ILE 78 -8.354 -8.546 14.055 630 1HG2 ILE 78 1HG2 ILE 78 -8.410 -4.857 14.698 631 2HG2 ILE 78 2HG2 ILE 78 -9.170 -6.268 15.434 632 3HG2 ILE 78 3HG2 ILE 78 -9.250 -6.034 13.688 633 1HD1 ILE 78 1HD1 ILE 78 -7.792 -8.557 11.554 634 2HD1 ILE 78 2HD1 ILE 78 -7.438 -6.845 11.780 635 3HD1 ILE 78 3HD1 ILE 78 -9.048 -7.466 12.132 636 H LEU 79 H LEU 79 -5.643 -3.361 13.360 637 HA LEU 79 HA LEU 79 -4.551 -2.936 16.036 638 1HB LEU 79 1HB LEU 79 -3.653 -0.870 15.189 639 2HB LEU 79 2HB LEU 79 -3.271 -2.165 14.072 640 HG LEU 79 HG LEU 79 -5.475 -1.318 12.883 641 1HD1 LEU 79 1HD1 LEU 79 -6.326 0.489 13.866 642 2HD1 LEU 79 2HD1 LEU 79 -4.954 1.365 13.191 643 3HD1 LEU 79 3HD1 LEU 79 -4.880 0.747 14.840 644 1HD2 LEU 79 1HD2 LEU 79 -3.196 0.487 12.393 645 2HD2 LEU 79 2HD2 LEU 79 -4.084 -0.551 11.279 646 3HD2 LEU 79 3HD2 LEU 79 -2.844 -1.240 12.326 647 H GLN 80 H GLN 80 -5.007 -0.623 16.930 648 HA GLN 80 HA GLN 80 -7.816 0.109 16.558 649 1HB GLN 80 1HB GLN 80 -6.745 -1.347 18.801 650 2HB GLN 80 2HB GLN 80 -7.356 0.209 19.334 651 1HG GLN 80 1HG GLN 80 -9.375 -0.584 17.750 652 2HG GLN 80 2HG GLN 80 -8.788 -2.142 18.334 653 1HE2 GLN 80 1HE2 GLN 80 -10.167 -2.754 19.860 654 2HE2 GLN 80 2HE2 GLN 80 -10.672 -1.793 21.204 655 H GLY 81 H GLY 81 -8.143 2.267 16.608 656 1HA GLY 81 1HA GLY 81 -7.204 4.168 18.262 657 2HA GLY 81 2HA GLY 81 -5.879 4.012 17.127 658 H LYS 82 H LYS 82 -6.488 4.265 14.799 659 HA LYS 82 HA LYS 82 -8.870 5.796 14.242 660 1HB LYS 82 1HB LYS 82 -6.156 7.043 14.429 661 2HB LYS 82 2HB LYS 82 -7.238 7.607 13.166 662 1HG LYS 82 1HG LYS 82 -8.656 7.482 15.646 663 2HG LYS 82 2HG LYS 82 -7.165 8.402 15.852 664 1HD LYS 82 1HD LYS 82 -7.800 10.022 14.336 665 2HD LYS 82 2HD LYS 82 -8.897 8.938 13.480 666 1HE LYS 82 1HE LYS 82 -10.626 9.533 14.758 667 2HE LYS 82 2HE LYS 82 -9.695 9.327 16.240 668 1HZ LYS 82 1HZ LYS 82 -10.562 11.641 15.698 669 2HZ LYS 82 2HZ LYS 82 -9.345 11.707 14.525 670 3HZ LYS 82 3HZ LYS 82 -8.937 11.511 16.156 671 H PHE 83 H PHE 83 -7.033 6.865 11.851 672 HA PHE 83 HA PHE 83 -6.773 6.285 9.679 673 1HB PHE 83 1HB PHE 83 -5.626 4.074 11.253 674 2HB PHE 83 2HB PHE 83 -5.981 3.687 9.569 675 HD1 PHE 83 HD1 PHE 83 -4.189 3.887 8.189 676 HD2 PHE 83 HD2 PHE 83 -4.599 6.626 11.411 677 HE1 PHE 83 HE1 PHE 83 -2.144 5.039 7.457 678 HE2 PHE 83 HE2 PHE 83 -2.551 7.782 10.694 679 HZ PHE 83 HZ PHE 83 -1.327 6.996 8.710 680 H THR 84 H THR 84 -9.369 6.242 10.455 681 HA THR 84 HA THR 84 -10.697 3.807 9.790 682 HB THR 84 HB THR 84 -12.707 5.452 9.614 683 HG1 THR 84 HG1 THR 84 -10.942 7.235 9.560 684 1HG2 THR 84 1HG2 THR 84 -13.134 4.886 11.706 685 2HG2 THR 84 2HG2 THR 84 -11.809 5.884 12.306 686 3HG2 THR 84 3HG2 THR 84 -11.502 4.223 11.799 687 H HIS 85 H HIS 85 -9.223 3.712 7.796 688 HA HIS 85 HA HIS 85 -8.928 3.767 5.540 689 1HB HIS 85 1HB HIS 85 -11.511 2.995 6.055 690 2HB HIS 85 2HB HIS 85 -11.751 4.319 4.924 691 HD2 HIS 85 HD2 HIS 85 -12.364 2.846 2.695 692 HE1 HIS 85 HE1 HIS 85 -8.861 0.459 2.664 693 HE2 HIS 85 HE2 HIS 85 -10.884 1.195 1.365 694 H PHE 86 H PHE 86 -8.593 6.242 6.884 695 HA PHE 86 HA PHE 86 -9.726 8.252 5.096 696 1HB PHE 86 1HB PHE 86 -8.495 8.290 7.779 697 2HB PHE 86 2HB PHE 86 -8.095 9.664 6.753 698 HD1 PHE 86 HD1 PHE 86 -10.514 10.159 5.266 699 HD2 PHE 86 HD2 PHE 86 -10.033 8.994 9.329 700 HE1 PHE 86 HE1 PHE 86 -12.674 11.202 5.817 701 HE2 PHE 86 HE2 PHE 86 -12.191 10.033 9.888 702 HZ PHE 86 HZ PHE 86 -13.515 11.139 8.131 703 H LEU 87 H LEU 87 -6.469 7.903 6.471 704 HA LEU 87 HA LEU 87 -5.207 9.091 4.227 705 1HB LEU 87 1HB LEU 87 -4.300 7.701 6.701 706 2HB LEU 87 2HB LEU 87 -3.151 7.847 5.389 707 HG LEU 87 HG LEU 87 -2.805 9.641 6.947 708 1HD1 LEU 87 1HD1 LEU 87 -3.690 11.588 5.305 709 2HD1 LEU 87 2HD1 LEU 87 -3.769 10.196 4.226 710 3HD1 LEU 87 3HD1 LEU 87 -2.247 10.620 5.006 711 1HD2 LEU 87 1HD2 LEU 87 -5.606 10.600 6.444 712 2HD2 LEU 87 2HD2 LEU 87 -4.455 11.152 7.661 713 3HD2 LEU 87 3HD2 LEU 87 -5.191 9.555 7.803 714 H ILE 88 H ILE 88 -5.505 5.737 5.339 715 HA ILE 88 HA ILE 88 -3.941 4.527 3.381 716 HB ILE 88 HB ILE 88 -6.439 3.303 4.546 717 1HG1 ILE 88 1HG1 ILE 88 -3.715 3.692 5.799 718 2HG1 ILE 88 2HG1 ILE 88 -5.278 4.185 6.435 719 1HG2 ILE 88 1HG2 ILE 88 -4.167 2.320 3.014 720 2HG2 ILE 88 2HG2 ILE 88 -5.755 1.604 3.274 721 3HG2 ILE 88 3HG2 ILE 88 -4.482 1.387 4.472 722 1HD1 ILE 88 1HD1 ILE 88 -5.256 1.351 6.058 723 2HD1 ILE 88 2HD1 ILE 88 -5.468 2.280 7.538 724 3HD1 ILE 88 3HD1 ILE 88 -3.849 1.844 6.995 725 H ASN 89 H ASN 89 -7.502 4.631 3.388 726 HA ASN 89 HA ASN 89 -7.919 3.709 0.827 727 1HB ASN 89 1HB ASN 89 -9.688 4.060 2.528 728 2HB ASN 89 2HB ASN 89 -9.594 5.790 2.235 729 1HD2 ASN 89 1HD2 ASN 89 -9.374 3.236 -0.178 730 2HD2 ASN 89 2HD2 ASN 89 -10.816 3.665 -1.023 731 H GLU 90 H GLU 90 -7.511 7.073 1.844 732 HA GLU 90 HA GLU 90 -7.978 8.307 -0.617 733 1HB GLU 90 1HB GLU 90 -7.580 9.354 1.727 734 2HB GLU 90 2HB GLU 90 -5.883 9.340 1.267 735 1HG GLU 90 1HG GLU 90 -6.584 11.463 0.677 736 2HG GLU 90 2HG GLU 90 -6.656 10.576 -0.845 737 H ARG 91 H ARG 91 -4.826 7.464 0.816 738 HA ARG 91 HA ARG 91 -3.291 8.169 -1.408 739 1HB ARG 91 1HB ARG 91 -2.660 7.506 1.072 740 2HB ARG 91 2HB ARG 91 -2.404 5.931 0.338 741 1HG ARG 91 1HG ARG 91 -0.318 7.091 0.376 742 2HG ARG 91 2HG ARG 91 -0.870 7.008 -1.297 743 1HD ARG 91 1HD ARG 91 0.025 9.225 -0.707 744 2HD ARG 91 2HD ARG 91 -1.669 9.281 -1.186 745 HE ARG 91 HE ARG 91 -0.888 9.255 1.651 746 1HH1 ARG 91 1HH1 ARG 91 -2.568 10.765 -1.026 747 2HH1 ARG 91 2HH1 ARG 91 -3.395 11.900 -0.017 748 1HH2 ARG 91 1HH2 ARG 91 -1.975 10.758 2.960 749 2HH2 ARG 91 2HH2 ARG 91 -3.058 11.901 2.236 750 H ILE 92 H ILE 92 -4.519 4.941 -0.448 751 HA ILE 92 HA ILE 92 -3.351 3.533 -2.550 752 HB ILE 92 HB ILE 92 -5.774 3.015 -0.864 753 1HG1 ILE 92 1HG1 ILE 92 -4.244 0.847 -0.645 754 2HG1 ILE 92 2HG1 ILE 92 -3.021 1.967 -1.215 755 1HG2 ILE 92 1HG2 ILE 92 -5.976 0.789 -2.034 756 2HG2 ILE 92 2HG2 ILE 92 -4.982 1.462 -3.323 757 3HG2 ILE 92 3HG2 ILE 92 -6.549 2.180 -2.948 758 1HD1 ILE 92 1HD1 ILE 92 -3.085 1.813 1.213 759 2HD1 ILE 92 2HD1 ILE 92 -4.749 2.403 1.188 760 3HD1 ILE 92 3HD1 ILE 92 -3.437 3.436 0.622 761 H GLU 93 H GLU 93 -6.714 4.760 -2.341 762 HA GLU 93 HA GLU 93 -7.518 4.163 -4.926 763 1HB GLU 93 1HB GLU 93 -8.420 5.981 -2.808 764 2HB GLU 93 2HB GLU 93 -8.852 6.506 -4.428 765 1HG GLU 93 1HG GLU 93 -9.716 4.103 -4.742 766 2HG GLU 93 2HG GLU 93 -9.651 4.016 -2.982 767 H ASP 94 H ASP 94 -5.413 6.656 -3.795 768 HA ASP 94 HA ASP 94 -5.609 8.392 -6.028 769 1HB ASP 94 1HB ASP 94 -4.208 8.330 -3.561 770 2HB ASP 94 2HB ASP 94 -3.006 8.530 -4.831 771 H TYR 95 H TYR 95 -3.491 5.688 -5.216 772 HA TYR 95 HA TYR 95 -2.034 5.940 -7.707 773 1HB TYR 95 1HB TYR 95 -1.794 3.943 -5.444 774 2HB TYR 95 2HB TYR 95 -0.765 3.957 -6.869 775 HD1 TYR 95 HD1 TYR 95 -1.918 6.987 -5.063 776 HD2 TYR 95 HD2 TYR 95 1.323 4.329 -5.792 777 HE1 TYR 95 HE1 TYR 95 -0.398 8.548 -3.942 778 HE2 TYR 95 HE2 TYR 95 2.856 5.890 -4.666 779 HH TYR 95 HH TYR 95 3.005 8.228 -4.081 780 H VAL 96 H VAL 96 -3.930 3.342 -6.122 781 HA VAL 96 HA VAL 96 -4.054 1.585 -8.270 782 HB VAL 96 HB VAL 96 -4.843 0.833 -6.121 783 1HG1 VAL 96 1HG1 VAL 96 -5.943 3.268 -5.805 784 2HG1 VAL 96 2HG1 VAL 96 -6.363 1.872 -4.821 785 3HG1 VAL 96 3HG1 VAL 96 -7.379 2.328 -6.185 786 1HG2 VAL 96 1HG2 VAL 96 -5.984 0.092 -8.374 787 2HG2 VAL 96 2HG2 VAL 96 -7.397 0.870 -7.660 788 3HG2 VAL 96 3HG2 VAL 96 -6.607 -0.464 -6.821 789 H ASN 97 H ASN 97 -6.408 4.106 -7.368 790 HA ASN 97 HA ASN 97 -7.542 3.871 -10.058 791 1HB ASN 97 1HB ASN 97 -8.730 4.127 -7.416 792 2HB ASN 97 2HB ASN 97 -9.316 5.373 -8.514 793 1HD2 ASN 97 1HD2 ASN 97 -9.443 2.091 -7.626 794 2HD2 ASN 97 2HD2 ASN 97 -10.546 1.561 -8.845 795 H LYS 98 H LYS 98 -5.339 5.200 -10.199 796 HA LYS 98 HA LYS 98 -5.625 8.001 -9.618 797 1HB LYS 98 1HB LYS 98 -3.500 8.184 -10.990 798 2HB LYS 98 2HB LYS 98 -3.404 7.209 -9.536 799 1HG LYS 98 1HG LYS 98 -2.307 5.858 -10.992 800 2HG LYS 98 2HG LYS 98 -3.948 5.250 -11.203 801 1HD LYS 98 1HD LYS 98 -3.974 5.855 -13.346 802 2HD LYS 98 2HD LYS 98 -3.441 7.490 -12.952 803 1HE LYS 98 1HE LYS 98 -1.348 5.448 -12.742 804 2HE LYS 98 2HE LYS 98 -1.992 5.664 -14.369 805 1HZ LYS 98 1HZ LYS 98 -1.286 7.838 -14.454 806 2HZ LYS 98 2HZ LYS 98 -0.031 7.118 -13.577 807 3HZ LYS 98 3HZ LYS 98 -1.220 8.013 -12.774 808 H PHE 99 H PHE 99 -7.164 6.175 -11.791 809 HA PHE 99 HA PHE 99 -6.838 7.738 -14.163 810 1HB PHE 99 1HB PHE 99 -8.762 5.566 -13.366 811 2HB PHE 99 2HB PHE 99 -8.884 6.407 -14.907 812 HD1 PHE 99 HD1 PHE 99 -8.292 3.398 -14.157 813 HD2 PHE 99 HD2 PHE 99 -5.891 6.678 -15.418 814 HE1 PHE 99 HE1 PHE 99 -6.662 1.831 -15.129 815 HE2 PHE 99 HE2 PHE 99 -4.260 5.119 -16.389 816 HZ PHE 99 HZ PHE 99 -4.643 2.692 -16.247 817 H VAL 100 H VAL 100 -9.431 7.407 -11.733 818 HA VAL 100 HA VAL 100 -10.875 9.615 -12.941 819 HB VAL 100 HB VAL 100 -12.102 7.653 -12.070 820 1HG1 VAL 100 1HG1 VAL 100 -10.535 8.175 -9.724 821 2HG1 VAL 100 2HG1 VAL 100 -11.561 6.790 -10.099 822 3HG1 VAL 100 3HG1 VAL 100 -12.253 8.214 -9.324 823 1HG2 VAL 100 1HG2 VAL 100 -12.640 10.435 -11.219 824 2HG2 VAL 100 2HG2 VAL 100 -13.623 9.171 -10.482 825 3HG2 VAL 100 3HG2 VAL 100 -13.589 9.353 -12.236 826 H ILE 101 H ILE 101 -8.679 9.119 -10.308 827 HA ILE 101 HA ILE 101 -9.421 11.633 -9.052 828 HB ILE 101 HB ILE 101 -8.876 9.797 -7.564 829 1HG1 ILE 101 1HG1 ILE 101 -6.836 10.958 -6.374 830 2HG1 ILE 101 2HG1 ILE 101 -7.103 12.208 -7.583 831 1HG2 ILE 101 1HG2 ILE 101 -6.880 8.633 -7.518 832 2HG2 ILE 101 2HG2 ILE 101 -6.022 9.866 -8.444 833 3HG2 ILE 101 3HG2 ILE 101 -7.197 8.824 -9.240 834 1HD1 ILE 101 1HD1 ILE 101 -8.241 12.719 -5.500 835 2HD1 ILE 101 2HD1 ILE 101 -9.140 11.205 -5.610 836 3HD1 ILE 101 3HD1 ILE 101 -9.396 12.472 -6.810 837 H CYS 102 H CYS 102 -6.443 10.260 -10.530 838 HA CYS 102 HA CYS 102 -5.292 12.922 -10.647 839 1HB CYS 102 1HB CYS 102 -3.936 10.860 -10.099 840 2HB CYS 102 2HB CYS 102 -4.105 10.395 -11.789 841 H HIS 103 H HIS 103 -7.678 12.101 -12.329 842 HA HIS 103 HA HIS 103 -8.473 12.413 -14.438 843 1HB HIS 103 1HB HIS 103 -6.070 14.236 -14.676 844 2HB HIS 103 2HB HIS 103 -7.506 14.273 -15.695 845 HD2 HIS 103 HD2 HIS 103 -8.975 13.844 -12.364 846 HE1 HIS 103 HE1 HIS 103 -8.343 18.030 -12.660 847 HE2 HIS 103 HE2 HIS 103 -9.573 16.190 -11.454 848 H GLU 104 H GLU 104 -7.030 10.097 -14.217 849 HA GLU 104 HA GLU 104 -5.826 8.529 -15.350 850 1HB GLU 104 1HB GLU 104 -7.882 8.921 -16.761 851 2HB GLU 104 2HB GLU 104 -6.881 9.925 -17.801 852 1HG GLU 104 1HG GLU 104 -6.176 8.140 -18.892 853 2HG GLU 104 2HG GLU 104 -5.553 7.444 -17.398 854 H CYS 105 H CYS 105 -3.819 9.549 -14.623 855 HA CYS 105 HA CYS 105 -2.347 11.193 -16.463 856 1HB CYS 105 1HB CYS 105 -2.192 10.735 -13.771 857 2HB CYS 105 2HB CYS 105 -0.847 9.768 -14.361 858 H ASN 106 H ASN 106 -3.139 9.002 -17.910 859 HA ASN 106 HA ASN 106 -1.201 6.908 -17.916 860 1HB ASN 106 1HB ASN 106 -3.591 6.723 -18.713 861 2HB ASN 106 2HB ASN 106 -3.120 7.650 -20.131 862 1HD2 ASN 106 1HD2 ASN 106 -4.164 5.302 -20.630 863 2HD2 ASN 106 2HD2 ASN 106 -2.970 4.145 -21.099 864 H ARG 107 H ARG 107 -2.017 9.002 -20.660 865 HA ARG 107 HA ARG 107 0.636 8.818 -21.720 866 1HB ARG 107 1HB ARG 107 -1.699 9.162 -22.920 867 2HB ARG 107 2HB ARG 107 -1.327 10.863 -22.677 868 1HG ARG 107 1HG ARG 107 0.977 10.120 -23.754 869 2HG ARG 107 2HG ARG 107 -0.049 8.871 -24.456 870 1HD ARG 107 1HD ARG 107 -1.575 10.671 -25.249 871 2HD ARG 107 2HD ARG 107 -0.402 11.855 -24.676 872 HE ARG 107 HE ARG 107 -0.048 10.001 -26.923 873 1HH1 ARG 107 1HH1 ARG 107 1.107 12.727 -25.057 874 2HH1 ARG 107 2HH1 ARG 107 2.293 13.179 -26.233 875 1HH2 ARG 107 1HH2 ARG 107 1.517 10.601 -28.456 876 2HH2 ARG 107 2HH2 ARG 107 2.528 11.976 -28.157 877 HA PRO 108 HA PRO 108 2.508 12.149 -19.499 878 1HB PRO 108 1HB PRO 108 3.976 12.701 -22.011 879 2HB PRO 108 2HB PRO 108 4.595 12.376 -20.388 880 1HG PRO 108 1HG PRO 108 4.745 10.536 -22.314 881 2HG PRO 108 2HG PRO 108 4.404 10.082 -20.631 882 1HD PRO 108 1HD PRO 108 2.546 10.287 -22.957 883 2HD PRO 108 2HD PRO 108 2.561 9.111 -21.629 884 H ASP 109 H ASP 109 0.335 13.219 -19.721 885 HA ASP 109 HA ASP 109 0.224 15.365 -21.698 886 1HB ASP 109 1HB ASP 109 -1.723 14.305 -19.650 887 2HB ASP 109 2HB ASP 109 -2.009 15.815 -20.507 888 H THR 110 H THR 110 1.459 14.820 -18.646 889 HA THR 110 HA THR 110 1.624 17.686 -18.110 890 HB THR 110 HB THR 110 1.117 17.225 -15.710 891 HG1 THR 110 HG1 THR 110 1.309 15.122 -15.359 892 1HG2 THR 110 1HG2 THR 110 -1.206 16.267 -17.308 893 2HG2 THR 110 2HG2 THR 110 -0.611 17.915 -17.505 894 3HG2 THR 110 3HG2 THR 110 -1.166 17.360 -15.932 895 H ARG 111 H ARG 111 3.133 17.989 -16.062 896 HA ARG 111 HA ARG 111 5.597 16.580 -16.695 897 1HB ARG 111 1HB ARG 111 4.829 19.094 -15.338 898 2HB ARG 111 2HB ARG 111 6.255 18.294 -14.698 899 1HG ARG 111 1HG ARG 111 7.374 18.444 -16.791 900 2HG ARG 111 2HG ARG 111 5.903 18.985 -17.604 901 1HD ARG 111 1HD ARG 111 6.674 20.644 -15.320 902 2HD ARG 111 2HD ARG 111 7.870 20.619 -16.613 903 HE ARG 111 HE ARG 111 6.361 21.679 -18.020 904 1HH1 ARG 111 1HH1 ARG 111 4.869 20.967 -14.938 905 2HH1 ARG 111 2HH1 ARG 111 3.478 21.947 -15.251 906 1HH2 ARG 111 1HH2 ARG 111 4.531 22.963 -18.420 907 2HH2 ARG 111 2HH2 ARG 111 3.283 23.075 -17.224 908 H ILE 112 H ILE 112 5.545 14.572 -15.756 909 HA ILE 112 HA ILE 112 4.576 14.230 -13.054 910 HB ILE 112 HB ILE 112 6.054 12.148 -14.643 911 1HG1 ILE 112 1HG1 ILE 112 3.071 12.630 -14.744 912 2HG1 ILE 112 2HG1 ILE 112 4.183 13.190 -15.989 913 1HG2 ILE 112 1HG2 ILE 112 4.200 12.171 -12.304 914 2HG2 ILE 112 2HG2 ILE 112 5.737 11.332 -12.513 915 3HG2 ILE 112 3HG2 ILE 112 4.292 10.742 -13.335 916 1HD1 ILE 112 1HD1 ILE 112 3.288 10.436 -15.342 917 2HD1 ILE 112 2HD1 ILE 112 4.897 10.664 -16.024 918 3HD1 ILE 112 3HD1 ILE 112 3.478 11.228 -16.905 919 H ILE 113 H ILE 113 5.765 13.908 -11.255 920 HA ILE 113 HA ILE 113 8.673 13.734 -11.450 921 HB ILE 113 HB ILE 113 7.305 15.851 -9.786 922 1HG1 ILE 113 1HG1 ILE 113 8.946 16.124 -12.314 923 2HG1 ILE 113 2HG1 ILE 113 7.213 16.397 -12.175 924 1HG2 ILE 113 1HG2 ILE 113 9.328 15.028 -8.747 925 2HG2 ILE 113 2HG2 ILE 113 9.598 16.654 -9.378 926 3HG2 ILE 113 3HG2 ILE 113 10.223 15.254 -10.251 927 1HD1 ILE 113 1HD1 ILE 113 8.157 18.086 -10.283 928 2HD1 ILE 113 2HD1 ILE 113 7.812 18.537 -11.952 929 3HD1 ILE 113 3HD1 ILE 113 9.459 18.134 -11.470 930 H ARG 114 H ARG 114 9.530 12.468 -9.906 931 HA ARG 114 HA ARG 114 7.999 11.946 -7.477 932 1HB ARG 114 1HB ARG 114 7.561 10.182 -9.308 933 2HB ARG 114 2HB ARG 114 9.207 9.646 -8.995 934 1HG ARG 114 1HG ARG 114 8.700 8.881 -6.882 935 2HG ARG 114 2HG ARG 114 7.299 9.930 -6.728 936 1HD ARG 114 1HD ARG 114 6.920 7.410 -7.073 937 2HD ARG 114 2HD ARG 114 5.946 8.552 -7.987 938 HE ARG 114 HE ARG 114 6.782 7.606 -9.867 939 1HH1 ARG 114 1HH1 ARG 114 9.173 7.190 -7.354 940 2HH1 ARG 114 2HH1 ARG 114 10.208 6.210 -8.333 941 1HH2 ARG 114 1HH2 ARG 114 8.142 6.318 -11.146 942 2HH2 ARG 114 2HH2 ARG 114 9.625 5.716 -10.484 943 H GLU 115 H GLU 115 9.293 12.285 -5.789 944 HA GLU 115 HA GLU 115 12.158 11.652 -6.073 945 1HB GLU 115 1HB GLU 115 11.738 14.080 -6.017 946 2HB GLU 115 2HB GLU 115 10.897 13.896 -4.485 947 1HG GLU 115 1HG GLU 115 13.322 12.724 -3.979 948 2HG GLU 115 2HG GLU 115 13.746 14.055 -5.054 949 H GLY 116 H GLY 116 13.209 10.741 -4.297 950 1HA GLY 116 1HA GLY 116 13.347 9.983 -2.057 951 2HA GLY 116 2HA GLY 116 11.605 10.145 -1.921 952 H ARG 117 H ARG 117 12.752 8.590 -4.755 953 HA ARG 117 HA ARG 117 12.651 6.450 -5.505 954 1HB ARG 117 1HB ARG 117 14.117 6.294 -3.249 955 2HB ARG 117 2HB ARG 117 12.780 5.243 -2.803 956 1HG ARG 117 1HG ARG 117 13.376 3.634 -4.270 957 2HG ARG 117 2HG ARG 117 13.963 4.791 -5.467 958 1HD ARG 117 1HD ARG 117 15.991 5.128 -4.224 959 2HD ARG 117 2HD ARG 117 15.393 4.132 -2.900 960 HE ARG 117 HE ARG 117 16.016 3.089 -5.588 961 1HH1 ARG 117 1HH1 ARG 117 15.948 2.715 -2.108 962 2HH1 ARG 117 2HH1 ARG 117 16.654 1.137 -2.147 963 1HH2 ARG 117 1HH2 ARG 117 16.944 1.014 -5.624 964 2HH2 ARG 117 2HH2 ARG 117 17.218 0.173 -4.135 965 H ILE 118 H ILE 118 10.331 7.233 -5.779 966 HA ILE 118 HA ILE 118 8.114 6.734 -5.839 967 HB ILE 118 HB ILE 118 8.771 4.114 -4.512 968 1HG1 ILE 118 1HG1 ILE 118 8.681 4.194 -7.458 969 2HG1 ILE 118 2HG1 ILE 118 10.078 4.994 -6.746 970 1HG2 ILE 118 1HG2 ILE 118 6.370 4.970 -4.999 971 2HG2 ILE 118 2HG2 ILE 118 6.802 3.314 -5.420 972 3HG2 ILE 118 3HG2 ILE 118 6.750 4.557 -6.670 973 1HD1 ILE 118 1HD1 ILE 118 9.244 2.127 -6.441 974 2HD1 ILE 118 2HD1 ILE 118 10.491 2.885 -5.451 975 3HD1 ILE 118 3HD1 ILE 118 10.704 2.763 -7.198 976 H SER 119 H SER 119 8.429 8.433 -3.983 977 HA SER 119 HA SER 119 6.724 7.521 -1.795 978 1HB SER 119 1HB SER 119 8.224 8.855 -0.190 979 2HB SER 119 2HB SER 119 8.814 7.282 -0.724 980 HG SER 119 HG SER 119 9.805 9.798 -1.218 981 H LEU 120 H LEU 120 8.146 10.129 -3.640 982 HA LEU 120 HA LEU 120 5.964 11.912 -2.767 983 1HB LEU 120 1HB LEU 120 8.688 12.825 -3.660 984 2HB LEU 120 2HB LEU 120 7.449 13.766 -2.860 985 HG LEU 120 HG LEU 120 9.047 11.536 -1.610 986 1HD1 LEU 120 1HD1 LEU 120 10.579 13.068 -1.159 987 2HD1 LEU 120 2HD1 LEU 120 9.372 14.016 -0.291 988 3HD1 LEU 120 3HD1 LEU 120 9.635 14.286 -2.013 989 1HD2 LEU 120 1HD2 LEU 120 6.528 12.647 -0.887 990 2HD2 LEU 120 2HD2 LEU 120 7.727 13.150 0.304 991 3HD2 LEU 120 3HD2 LEU 120 7.489 11.437 -0.036 992 H LEU 121 H LEU 121 4.872 13.034 -4.374 993 HA LEU 121 HA LEU 121 5.930 13.162 -7.050 994 1HB LEU 121 1HB LEU 121 5.031 10.911 -7.075 995 2HB LEU 121 2HB LEU 121 3.489 11.488 -6.471 996 HG LEU 121 HG LEU 121 3.789 12.971 -8.762 997 1HD1 LEU 121 1HD1 LEU 121 5.749 11.103 -9.040 998 2HD1 LEU 121 2HD1 LEU 121 4.924 11.910 -10.373 999 3HD1 LEU 121 3HD1 LEU 121 4.389 10.317 -9.842 1000 1HD2 LEU 121 1HD2 LEU 121 2.283 10.563 -7.950 1001 2HD2 LEU 121 2HD2 LEU 121 2.327 10.918 -9.677 1002 3HD2 LEU 121 3HD2 LEU 121 1.704 12.119 -8.546 1003 H LYS 122 H LYS 122 5.033 14.773 -8.279 1004 HA LYS 122 HA LYS 122 2.693 16.170 -7.158 1005 1HB LYS 122 1HB LYS 122 3.715 18.321 -7.941 1006 2HB LYS 122 2HB LYS 122 4.522 17.564 -6.580 1007 1HG LYS 122 1HG LYS 122 6.405 17.095 -7.778 1008 2HG LYS 122 2HG LYS 122 5.536 16.988 -9.311 1009 1HD LYS 122 1HD LYS 122 6.594 18.993 -9.614 1010 2HD LYS 122 2HD LYS 122 5.113 19.557 -8.840 1011 1HE LYS 122 1HE LYS 122 7.128 18.820 -6.894 1012 2HE LYS 122 2HE LYS 122 7.721 20.047 -8.012 1013 1HZ LYS 122 1HZ LYS 122 5.827 20.296 -5.892 1014 2HZ LYS 122 2HZ LYS 122 5.198 20.877 -7.352 1015 3HZ LYS 122 3HZ LYS 122 6.649 21.504 -6.746 1016 H CYS 123 H CYS 123 1.261 17.115 -8.590 1017 HA CYS 123 HA CYS 123 1.729 16.730 -11.456 1018 1HB CYS 123 1HB CYS 123 -0.253 15.304 -9.794 1019 2HB CYS 123 2HB CYS 123 -0.902 15.999 -11.272 1020 H GLU 124 H GLU 124 1.848 19.131 -10.105 1021 HA GLU 124 HA GLU 124 -0.394 20.653 -9.748 1022 1HB GLU 124 1HB GLU 124 1.018 22.602 -10.543 1023 2HB GLU 124 2HB GLU 124 1.700 21.630 -9.246 1024 1HG GLU 124 1HG GLU 124 3.525 21.313 -10.447 1025 2HG GLU 124 2HG GLU 124 2.569 20.511 -11.692 1026 H ALA 125 H ALA 125 0.880 19.501 -12.774 1027 HA ALA 125 HA ALA 125 -0.431 21.356 -14.463 1028 1HB ALA 125 1HB ALA 125 -0.120 19.338 -16.129 1029 2HB ALA 125 2HB ALA 125 0.918 18.742 -14.833 1030 3HB ALA 125 3HB ALA 125 1.249 20.303 -15.580 1031 H CYS 126 H CYS 126 -1.219 17.870 -14.197 1032 HA CYS 126 HA CYS 126 -3.925 18.428 -15.038 1033 1HB CYS 126 1HB CYS 126 -4.267 16.007 -14.948 1034 2HB CYS 126 2HB CYS 126 -2.805 16.396 -15.840 1035 H GLY 127 H GLY 127 -3.422 19.774 -12.715 1036 1HA GLY 127 1HA GLY 127 -5.186 20.020 -11.032 1037 2HA GLY 127 2HA GLY 127 -5.062 18.286 -10.770 1038 H ALA 128 H ALA 128 -3.998 17.737 -8.995 1039 HA ALA 128 HA ALA 128 -1.525 19.066 -8.318 1040 1HB ALA 128 1HB ALA 128 -2.687 20.575 -7.069 1041 2HB ALA 128 2HB ALA 128 -2.464 19.299 -5.872 1042 3HB ALA 128 3HB ALA 128 -4.002 19.452 -6.722 1043 H LYS 129 H LYS 129 -0.234 17.936 -6.853 1044 HA LYS 129 HA LYS 129 -1.191 15.376 -5.830 1045 1HB LYS 129 1HB LYS 129 0.512 15.646 -8.129 1046 2HB LYS 129 2HB LYS 129 1.399 14.863 -6.838 1047 1HG LYS 129 1HG LYS 129 -1.322 13.945 -7.688 1048 2HG LYS 129 2HG LYS 129 0.152 13.390 -8.482 1049 1HD LYS 129 1HD LYS 129 0.385 11.854 -6.896 1050 2HD LYS 129 2HD LYS 129 0.601 13.148 -5.715 1051 1HE LYS 129 1HE LYS 129 -1.921 13.259 -5.572 1052 2HE LYS 129 2HE LYS 129 -1.951 11.764 -6.504 1053 1HZ LYS 129 1HZ LYS 129 -2.084 11.359 -4.116 1054 2HZ LYS 129 2HZ LYS 129 -0.589 12.118 -3.889 1055 3HZ LYS 129 3HZ LYS 129 -0.682 10.681 -4.776 1056 H ALA 130 H ALA 130 0.148 14.563 -4.114 1057 HA ALA 130 HA ALA 130 1.409 16.693 -2.628 1058 1HB ALA 130 1HB ALA 130 1.356 15.245 -0.773 1059 2HB ALA 130 2HB ALA 130 1.239 13.810 -1.793 1060 3HB ALA 130 3HB ALA 130 -0.128 14.917 -1.666 1061 HA PRO 131 HA PRO 131 5.394 15.348 -4.330 1062 1HB PRO 131 1HB PRO 131 6.753 17.608 -3.834 1063 2HB PRO 131 2HB PRO 131 5.579 17.505 -5.145 1064 1HG PRO 131 1HG PRO 131 5.226 18.638 -2.391 1065 2HG PRO 131 2HG PRO 131 4.750 19.335 -3.952 1066 1HD PRO 131 1HD PRO 131 3.005 18.016 -2.341 1067 2HD PRO 131 2HD PRO 131 2.871 18.024 -4.109 1068 H LEU 132 H LEU 132 6.952 17.441 -2.162 1069 HA LEU 132 HA LEU 132 7.577 15.160 -0.443 1070 1HB LEU 132 1HB LEU 132 9.657 16.275 0.112 1071 2HB LEU 132 2HB LEU 132 9.489 16.092 -1.619 1072 HG LEU 132 HG LEU 132 8.890 18.678 -0.192 1073 1HD1 LEU 132 1HD1 LEU 132 11.074 19.435 -0.689 1074 2HD1 LEU 132 2HD1 LEU 132 11.438 17.983 -1.621 1075 3HD1 LEU 132 3HD1 LEU 132 11.252 17.883 0.130 1076 1HD2 LEU 132 1HD2 LEU 132 9.721 19.225 -2.743 1077 2HD2 LEU 132 2HD2 LEU 132 8.042 19.150 -2.210 1078 3HD2 LEU 132 3HD2 LEU 132 8.793 17.740 -2.956 1079 H LYS 133 H LYS 133 7.062 18.696 -0.172 1080 HA LYS 133 HA LYS 133 5.258 18.615 1.909 1081 1HB LYS 133 1HB LYS 133 7.186 17.535 3.148 1082 2HB LYS 133 2HB LYS 133 8.033 19.067 3.019 1083 1HG LYS 133 1HG LYS 133 7.121 19.431 5.035 1084 2HG LYS 133 2HG LYS 133 5.711 19.905 4.087 1085 1HD LYS 133 1HD LYS 133 4.879 18.424 5.710 1086 2HD LYS 133 2HD LYS 133 4.997 17.460 4.235 1087 1HE LYS 133 1HE LYS 133 7.239 16.674 5.050 1088 2HE LYS 133 2HE LYS 133 6.888 17.475 6.581 1089 1HZ LYS 133 1HZ LYS 133 6.178 15.347 6.986 1090 2HZ LYS 133 2HZ LYS 133 5.634 15.092 5.405 1091 3HZ LYS 133 3HZ LYS 133 4.735 16.058 6.462 1092 H ASN 134 H ASN 134 4.317 20.504 1.513 1093 HA ASN 134 HA ASN 134 5.689 22.732 0.397 1094 1HB ASN 134 1HB ASN 134 3.598 23.853 0.403 1095 2HB ASN 134 2HB ASN 134 3.238 22.164 0.081 1096 1HD2 ASN 134 1HD2 ASN 134 3.707 21.506 2.977 1097 2HD2 ASN 134 2HD2 ASN 134 2.272 22.031 3.774 1098 H VAL 135 H VAL 135 5.361 24.985 1.441 1099 HA VAL 135 HA VAL 135 6.584 24.845 4.090 1100 HB VAL 135 HB VAL 135 7.058 27.263 3.752 1101 1HG1 VAL 135 1HG1 VAL 135 8.879 25.985 3.190 1102 2HG1 VAL 135 2HG1 VAL 135 8.577 26.813 1.664 1103 3HG1 VAL 135 3HG1 VAL 135 8.031 25.152 1.887 1104 1HG2 VAL 135 1HG2 VAL 135 5.089 27.067 1.788 1105 2HG2 VAL 135 2HG2 VAL 135 6.595 27.297 0.900 1106 3HG2 VAL 135 3HG2 VAL 135 6.110 28.462 2.133 Start of MODEL 15 1 H MET 1 H MET 1 -45.776 -15.077 -17.201 2 HA MET 1 HA MET 1 -46.315 -17.179 -19.190 3 1HB MET 1 1HB MET 1 -46.783 -14.205 -19.082 4 2HB MET 1 2HB MET 1 -46.675 -15.066 -20.611 5 1HG MET 1 1HG MET 1 -48.737 -15.879 -20.427 6 2HG MET 1 2HG MET 1 -48.506 -16.324 -18.737 7 1HE MET 1 1HE MET 1 -50.030 -14.320 -21.253 8 2HE MET 1 2HE MET 1 -50.893 -13.005 -20.454 9 3HE MET 1 3HE MET 1 -51.395 -14.676 -20.194 10 H ASP 2 H ASP 2 -44.622 -14.055 -18.860 11 HA ASP 2 HA ASP 2 -42.493 -15.003 -20.580 12 1HB ASP 2 1HB ASP 2 -42.674 -12.356 -19.131 13 2HB ASP 2 2HB ASP 2 -41.662 -12.746 -20.519 14 H ASP 3 H ASP 3 -41.533 -16.634 -19.329 15 HA ASP 3 HA ASP 3 -40.352 -15.866 -16.771 16 1HB ASP 3 1HB ASP 3 -41.294 -18.327 -17.927 17 2HB ASP 3 2HB ASP 3 -39.615 -18.514 -17.433 18 H TYR 4 H TYR 4 -39.301 -17.351 -19.838 19 HA TYR 4 HA TYR 4 -36.654 -16.141 -19.395 20 1HB TYR 4 1HB TYR 4 -37.111 -18.790 -20.772 21 2HB TYR 4 2HB TYR 4 -35.570 -18.071 -20.316 22 HD1 TYR 4 HD1 TYR 4 -38.512 -19.888 -19.129 23 HD2 TYR 4 HD2 TYR 4 -34.813 -18.117 -18.000 24 HE1 TYR 4 HE1 TYR 4 -38.600 -21.086 -16.983 25 HE2 TYR 4 HE2 TYR 4 -34.889 -19.311 -15.851 26 HH TYR 4 HH TYR 4 -35.952 -21.366 -14.924 27 H GLU 5 H GLU 5 -37.016 -14.387 -20.715 28 HA GLU 5 HA GLU 5 -37.932 -14.818 -23.442 29 1HB GLU 5 1HB GLU 5 -37.526 -12.453 -21.679 30 2HB GLU 5 2HB GLU 5 -37.400 -12.201 -23.416 31 1HG GLU 5 1HG GLU 5 -39.749 -13.717 -22.465 32 2HG GLU 5 2HG GLU 5 -39.692 -12.001 -22.064 33 H LYS 6 H LYS 6 -35.360 -12.646 -22.334 34 HA LYS 6 HA LYS 6 -33.189 -14.039 -23.421 35 1HB LYS 6 1HB LYS 6 -34.754 -13.113 -25.454 36 2HB LYS 6 2HB LYS 6 -33.629 -11.778 -25.254 37 1HG LYS 6 1HG LYS 6 -31.967 -12.903 -26.210 38 2HG LYS 6 2HG LYS 6 -32.291 -14.352 -25.257 39 1HD LYS 6 1HD LYS 6 -34.329 -13.862 -27.276 40 2HD LYS 6 2HD LYS 6 -32.718 -14.048 -27.971 41 1HE LYS 6 1HE LYS 6 -32.703 -16.242 -27.569 42 2HE LYS 6 2HE LYS 6 -33.236 -16.011 -25.904 43 1HZ LYS 6 1HZ LYS 6 -34.705 -17.193 -27.791 44 2HZ LYS 6 2HZ LYS 6 -35.273 -15.605 -27.923 45 3HZ LYS 6 3HZ LYS 6 -35.362 -16.414 -26.440 46 H LEU 7 H LEU 7 -31.520 -13.253 -22.337 47 HA LEU 7 HA LEU 7 -31.663 -10.807 -20.918 48 1HB LEU 7 1HB LEU 7 -29.046 -11.273 -20.767 49 2HB LEU 7 2HB LEU 7 -30.214 -12.145 -19.799 50 HG LEU 7 HG LEU 7 -30.134 -13.902 -21.718 51 1HD1 LEU 7 1HD1 LEU 7 -27.393 -12.753 -22.091 52 2HD1 LEU 7 2HD1 LEU 7 -28.735 -12.310 -23.143 53 3HD1 LEU 7 3HD1 LEU 7 -28.214 -13.989 -23.041 54 1HD2 LEU 7 1HD2 LEU 7 -28.495 -15.110 -20.543 55 2HD2 LEU 7 2HD2 LEU 7 -29.260 -14.067 -19.346 56 3HD2 LEU 7 3HD2 LEU 7 -27.682 -13.639 -20.007 57 H LEU 8 H LEU 8 -31.043 -8.783 -21.456 58 HA LEU 8 HA LEU 8 -30.135 -8.352 -24.186 59 1HB LEU 8 1HB LEU 8 -31.966 -7.014 -22.880 60 2HB LEU 8 2HB LEU 8 -30.595 -6.143 -22.219 61 HG LEU 8 HG LEU 8 -30.061 -6.083 -24.911 62 1HD1 LEU 8 1HD1 LEU 8 -32.929 -5.325 -24.832 63 2HD1 LEU 8 2HD1 LEU 8 -32.526 -7.032 -25.014 64 3HD1 LEU 8 3HD1 LEU 8 -31.931 -5.856 -26.186 65 1HD2 LEU 8 1HD2 LEU 8 -31.433 -3.750 -24.508 66 2HD2 LEU 8 2HD2 LEU 8 -29.751 -4.037 -24.065 67 3HD2 LEU 8 3HD2 LEU 8 -31.025 -4.237 -22.863 68 H GLU 9 H GLU 9 -28.304 -9.579 -22.381 69 HA GLU 9 HA GLU 9 -26.101 -7.689 -22.607 70 1HB GLU 9 1HB GLU 9 -26.987 -9.029 -20.062 71 2HB GLU 9 2HB GLU 9 -25.317 -8.531 -20.299 72 1HG GLU 9 1HG GLU 9 -25.937 -6.577 -19.446 73 2HG GLU 9 2HG GLU 9 -26.726 -6.282 -20.996 74 H ARG 10 H ARG 10 -25.266 -8.931 -24.259 75 HA ARG 10 HA ARG 10 -24.568 -11.709 -23.611 76 1HB ARG 10 1HB ARG 10 -24.243 -11.983 -26.063 77 2HB ARG 10 2HB ARG 10 -25.887 -11.546 -25.622 78 1HG ARG 10 1HG ARG 10 -24.006 -9.364 -26.339 79 2HG ARG 10 2HG ARG 10 -24.628 -10.394 -27.628 80 1HD ARG 10 1HD ARG 10 -26.350 -8.945 -25.621 81 2HD ARG 10 2HD ARG 10 -25.976 -8.342 -27.232 82 HE ARG 10 HE ARG 10 -27.137 -10.975 -27.204 83 1HH1 ARG 10 1HH1 ARG 10 -27.781 -7.543 -27.271 84 2HH1 ARG 10 2HH1 ARG 10 -29.360 -7.727 -27.956 85 1HH2 ARG 10 1HH2 ARG 10 -29.216 -11.216 -28.100 86 2HH2 ARG 10 2HH2 ARG 10 -30.175 -9.812 -28.424 87 H ALA 11 H ALA 11 -22.466 -12.370 -24.916 88 HA ALA 11 HA ALA 11 -20.182 -12.284 -24.836 89 1HB ALA 11 1HB ALA 11 -20.777 -9.469 -25.730 90 2HB ALA 11 2HB ALA 11 -20.497 -10.875 -26.757 91 3HB ALA 11 3HB ALA 11 -19.183 -10.220 -25.780 92 H ILE 12 H ILE 12 -21.358 -11.990 -22.338 93 HA ILE 12 HA ILE 12 -20.212 -9.766 -20.953 94 HB ILE 12 HB ILE 12 -21.166 -12.245 -19.565 95 1HG1 ILE 12 1HG1 ILE 12 -23.303 -10.372 -19.794 96 2HG1 ILE 12 2HG1 ILE 12 -22.706 -10.700 -21.417 97 1HG2 ILE 12 1HG2 ILE 12 -20.189 -9.863 -18.645 98 2HG2 ILE 12 2HG2 ILE 12 -21.209 -10.970 -17.726 99 3HG2 ILE 12 3HG2 ILE 12 -21.933 -9.604 -18.575 100 1HD1 ILE 12 1HD1 ILE 12 -24.196 -12.382 -21.271 101 2HD1 ILE 12 2HD1 ILE 12 -24.099 -12.466 -19.512 102 3HD1 ILE 12 3HD1 ILE 12 -22.837 -13.202 -20.501 103 H ASP 13 H ASP 13 -19.168 -12.910 -21.826 104 HA ASP 13 HA ASP 13 -16.504 -12.504 -21.128 105 1HB ASP 13 1HB ASP 13 -17.585 -12.744 -18.801 106 2HB ASP 13 2HB ASP 13 -17.769 -14.448 -19.206 107 H GLN 14 H GLN 14 -19.127 -14.682 -21.834 108 HA GLN 14 HA GLN 14 -17.313 -16.773 -22.728 109 1HB GLN 14 1HB GLN 14 -20.332 -16.722 -22.797 110 2HB GLN 14 2HB GLN 14 -19.296 -18.124 -23.036 111 1HG GLN 14 1HG GLN 14 -19.144 -16.575 -20.491 112 2HG GLN 14 2HG GLN 14 -20.443 -17.740 -20.744 113 1HE2 GLN 14 1HE2 GLN 14 -16.922 -17.454 -21.032 114 2HE2 GLN 14 2HE2 GLN 14 -16.573 -19.051 -20.473 115 H LEU 15 H LEU 15 -19.572 -14.425 -24.076 116 HA LEU 15 HA LEU 15 -18.963 -15.377 -26.775 117 1HB LEU 15 1HB LEU 15 -21.069 -13.613 -25.604 118 2HB LEU 15 2HB LEU 15 -20.642 -13.401 -27.291 119 HG LEU 15 HG LEU 15 -21.136 -16.195 -26.603 120 1HD1 LEU 15 1HD1 LEU 15 -22.891 -14.302 -25.434 121 2HD1 LEU 15 2HD1 LEU 15 -23.051 -16.056 -25.500 122 3HD1 LEU 15 3HD1 LEU 15 -23.738 -15.061 -26.783 123 1HD2 LEU 15 1HD2 LEU 15 -21.100 -15.825 -28.861 124 2HD2 LEU 15 2HD2 LEU 15 -21.859 -14.238 -28.726 125 3HD2 LEU 15 3HD2 LEU 15 -22.833 -15.697 -28.557 126 HA PRO 16 HA PRO 16 -15.806 -12.437 -27.645 127 1HB PRO 16 1HB PRO 16 -16.733 -11.591 -30.159 128 2HB PRO 16 2HB PRO 16 -15.626 -12.930 -29.848 129 1HG PRO 16 1HG PRO 16 -18.565 -12.974 -30.330 130 2HG PRO 16 2HG PRO 16 -17.325 -14.145 -30.816 131 1HD PRO 16 1HD PRO 16 -18.987 -14.648 -28.778 132 2HD PRO 16 2HD PRO 16 -17.284 -15.155 -28.721 133 HA PRO 17 HA PRO 17 -17.748 -8.689 -26.195 134 1HB PRO 17 1HB PRO 17 -15.504 -7.100 -26.352 135 2HB PRO 17 2HB PRO 17 -15.852 -8.196 -25.020 136 1HG PRO 17 1HG PRO 17 -14.089 -8.616 -27.398 137 2HG PRO 17 2HG PRO 17 -13.794 -9.029 -25.698 138 1HD PRO 17 1HD PRO 17 -14.559 -10.888 -27.472 139 2HD PRO 17 2HD PRO 17 -15.140 -10.919 -25.795 140 H GLU 18 H GLU 18 -15.772 -6.523 -27.716 141 HA GLU 18 HA GLU 18 -15.944 -5.185 -29.538 142 1HB GLU 18 1HB GLU 18 -17.008 -7.754 -30.553 143 2HB GLU 18 2HB GLU 18 -17.452 -6.322 -31.467 144 1HG GLU 18 1HG GLU 18 -15.427 -7.470 -32.301 145 2HG GLU 18 2HG GLU 18 -15.162 -5.782 -31.866 146 H VAL 19 H VAL 19 -18.575 -6.220 -27.739 147 HA VAL 19 HA VAL 19 -20.602 -4.687 -29.100 148 HB VAL 19 HB VAL 19 -20.745 -5.875 -26.329 149 1HG1 VAL 19 1HG1 VAL 19 -22.516 -4.242 -27.697 150 2HG1 VAL 19 2HG1 VAL 19 -22.882 -5.248 -26.297 151 3HG1 VAL 19 3HG1 VAL 19 -23.164 -5.865 -27.923 152 1HG2 VAL 19 1HG2 VAL 19 -21.177 -7.154 -29.013 153 2HG2 VAL 19 2HG2 VAL 19 -21.936 -7.776 -27.547 154 3HG2 VAL 19 3HG2 VAL 19 -20.178 -7.716 -27.673 155 H PHE 20 H PHE 20 -21.568 -2.788 -28.345 156 HA PHE 20 HA PHE 20 -19.805 -1.020 -26.910 157 1HB PHE 20 1HB PHE 20 -21.820 0.590 -27.249 158 2HB PHE 20 2HB PHE 20 -20.881 0.090 -28.650 159 HD1 PHE 20 HD1 PHE 20 -22.496 0.373 -30.332 160 HD2 PHE 20 HD2 PHE 20 -23.419 -1.964 -26.896 161 HE1 PHE 20 HE1 PHE 20 -24.547 -0.426 -31.429 162 HE2 PHE 20 HE2 PHE 20 -25.469 -2.767 -27.987 163 HZ PHE 20 HZ PHE 20 -26.037 -1.998 -30.259 164 H GLU 21 H GLU 21 -20.506 -3.039 -25.175 165 HA GLU 21 HA GLU 21 -21.994 -1.540 -23.163 166 1HB GLU 21 1HB GLU 21 -23.672 -2.988 -24.174 167 2HB GLU 21 2HB GLU 21 -22.636 -4.390 -23.943 168 1HG GLU 21 1HG GLU 21 -24.409 -4.298 -22.279 169 2HG GLU 21 2HG GLU 21 -22.817 -4.156 -21.535 170 H THR 22 H THR 22 -20.684 -1.390 -21.470 171 HA THR 22 HA THR 22 -18.464 -3.144 -21.092 172 HB THR 22 HB THR 22 -18.381 -0.769 -20.450 173 HG1 THR 22 HG1 THR 22 -17.983 -1.662 -17.971 174 1HG2 THR 22 1HG2 THR 22 -20.695 -0.562 -19.595 175 2HG2 THR 22 2HG2 THR 22 -19.472 0.078 -18.498 176 3HG2 THR 22 3HG2 THR 22 -20.212 -1.490 -18.175 177 H LYS 23 H LYS 23 -18.208 -4.826 -19.735 178 HA LYS 23 HA LYS 23 -20.601 -5.997 -18.603 179 1HB LYS 23 1HB LYS 23 -17.751 -6.980 -18.781 180 2HB LYS 23 2HB LYS 23 -19.070 -7.909 -18.081 181 1HG LYS 23 1HG LYS 23 -19.141 -8.769 -20.154 182 2HG LYS 23 2HG LYS 23 -20.166 -7.363 -20.449 183 1HD LYS 23 1HD LYS 23 -18.718 -7.097 -22.183 184 2HD LYS 23 2HD LYS 23 -17.788 -6.257 -20.941 185 1HE LYS 23 1HE LYS 23 -16.316 -8.027 -20.664 186 2HE LYS 23 2HE LYS 23 -17.443 -9.198 -21.346 187 1HZ LYS 23 1HZ LYS 23 -15.376 -7.927 -22.651 188 2HZ LYS 23 2HZ LYS 23 -16.785 -7.215 -23.261 189 3HZ LYS 23 3HZ LYS 23 -16.580 -8.892 -23.344 190 H ARG 24 H ARG 24 -19.923 -7.328 -16.434 191 HA ARG 24 HA ARG 24 -19.532 -5.238 -14.460 192 1HB ARG 24 1HB ARG 24 -19.997 -8.152 -13.862 193 2HB ARG 24 2HB ARG 24 -20.393 -6.755 -12.870 194 1HG ARG 24 1HG ARG 24 -22.056 -6.108 -14.648 195 2HG ARG 24 2HG ARG 24 -21.767 -7.690 -15.373 196 1HD ARG 24 1HD ARG 24 -22.227 -8.108 -12.616 197 2HD ARG 24 2HD ARG 24 -23.467 -6.993 -13.183 198 HE ARG 24 HE ARG 24 -24.288 -8.648 -14.613 199 1HH1 ARG 24 1HH1 ARG 24 -21.486 -9.776 -12.850 200 2HH1 ARG 24 2HH1 ARG 24 -21.782 -11.442 -13.209 201 1HH2 ARG 24 1HH2 ARG 24 -24.666 -10.839 -15.086 202 2HH2 ARG 24 2HH2 ARG 24 -23.582 -12.046 -14.479 203 H PHE 25 H PHE 25 -17.271 -4.910 -15.050 204 HA PHE 25 HA PHE 25 -15.404 -7.021 -14.346 205 1HB PHE 25 1HB PHE 25 -15.237 -5.231 -16.283 206 2HB PHE 25 2HB PHE 25 -14.540 -4.237 -15.008 207 HD1 PHE 25 HD1 PHE 25 -13.756 -6.341 -17.609 208 HD2 PHE 25 HD2 PHE 25 -12.721 -5.617 -13.545 209 HE1 PHE 25 HE1 PHE 25 -11.572 -7.409 -17.982 210 HE2 PHE 25 HE2 PHE 25 -10.533 -6.687 -13.907 211 HZ PHE 25 HZ PHE 25 -9.956 -7.583 -16.129 212 H GLU 26 H GLU 26 -14.797 -7.304 -12.300 213 HA GLU 26 HA GLU 26 -14.284 -4.946 -10.645 214 1HB GLU 26 1HB GLU 26 -15.321 -6.319 -8.702 215 2HB GLU 26 2HB GLU 26 -16.384 -5.441 -9.793 216 1HG GLU 26 1HG GLU 26 -17.501 -7.330 -10.062 217 2HG GLU 26 2HG GLU 26 -16.119 -7.937 -10.969 218 H VAL 27 H VAL 27 -12.260 -5.057 -9.981 219 HA VAL 27 HA VAL 27 -11.235 -7.499 -8.813 220 HB VAL 27 HB VAL 27 -9.719 -6.218 -11.091 221 1HG1 VAL 27 1HG1 VAL 27 -8.724 -8.773 -10.310 222 2HG1 VAL 27 2HG1 VAL 27 -8.825 -7.742 -8.883 223 3HG1 VAL 27 3HG1 VAL 27 -7.904 -7.212 -10.291 224 1HG2 VAL 27 1HG2 VAL 27 -10.716 -9.038 -11.087 225 2HG2 VAL 27 2HG2 VAL 27 -10.242 -8.021 -12.446 226 3HG2 VAL 27 3HG2 VAL 27 -11.765 -7.724 -11.617 227 HA PRO 28 HA PRO 28 -8.123 -3.785 -7.951 228 1HB PRO 28 1HB PRO 28 -9.969 -1.557 -8.653 229 2HB PRO 28 2HB PRO 28 -8.214 -1.665 -8.838 230 1HG PRO 28 1HG PRO 28 -9.798 -1.899 -10.955 231 2HG PRO 28 2HG PRO 28 -8.368 -2.936 -10.782 232 1HD PRO 28 1HD PRO 28 -11.252 -3.585 -10.315 233 2HD PRO 28 2HD PRO 28 -9.979 -4.579 -11.049 234 H LYS 29 H LYS 29 -8.183 -3.850 -5.802 235 HA LYS 29 HA LYS 29 -9.803 -2.255 -4.202 236 1HB LYS 29 1HB LYS 29 -11.262 -3.964 -3.140 237 2HB LYS 29 2HB LYS 29 -11.673 -3.650 -4.820 238 1HG LYS 29 1HG LYS 29 -11.583 -5.830 -5.178 239 2HG LYS 29 2HG LYS 29 -9.844 -5.754 -4.900 240 1HD LYS 29 1HD LYS 29 -10.016 -6.514 -2.739 241 2HD LYS 29 2HD LYS 29 -11.664 -5.912 -2.545 242 1HE LYS 29 1HE LYS 29 -10.821 -8.289 -4.203 243 2HE LYS 29 2HE LYS 29 -11.615 -8.353 -2.631 244 1HZ LYS 29 1HZ LYS 29 -13.086 -6.738 -4.448 245 2HZ LYS 29 2HZ LYS 29 -13.584 -8.106 -3.590 246 3HZ LYS 29 3HZ LYS 29 -12.834 -8.281 -5.096 247 H ALA 30 H ALA 30 -8.372 -1.894 -2.639 248 HA ALA 30 HA ALA 30 -7.413 -4.065 -1.007 249 1HB ALA 30 1HB ALA 30 -5.122 -3.912 -1.412 250 2HB ALA 30 2HB ALA 30 -5.281 -2.380 -2.271 251 3HB ALA 30 3HB ALA 30 -5.837 -3.874 -3.025 252 H TYR 31 H TYR 31 -7.709 -3.326 0.980 253 HA TYR 31 HA TYR 31 -6.425 -1.072 2.033 254 1HB TYR 31 1HB TYR 31 -8.212 0.497 2.354 255 2HB TYR 31 2HB TYR 31 -8.146 0.109 0.640 256 HD1 TYR 31 HD1 TYR 31 -10.378 0.922 2.993 257 HD2 TYR 31 HD2 TYR 31 -9.640 -2.298 0.312 258 HE1 TYR 31 HE1 TYR 31 -12.765 0.335 3.047 259 HE2 TYR 31 HE2 TYR 31 -12.023 -2.893 0.359 260 HH TYR 31 HH TYR 31 -14.401 -0.845 1.795 261 H SER 32 H SER 32 -7.427 -0.477 4.265 262 HA SER 32 HA SER 32 -7.593 -2.874 5.774 263 1HB SER 32 1HB SER 32 -8.270 -0.058 6.658 264 2HB SER 32 2HB SER 32 -7.893 -1.423 7.709 265 HG SER 32 HG SER 32 -6.082 -0.074 7.389 266 H VAL 33 H VAL 33 -9.443 -2.771 7.624 267 HA VAL 33 HA VAL 33 -12.027 -2.500 6.245 268 HB VAL 33 HB VAL 33 -11.973 -4.655 8.234 269 1HG1 VAL 33 1HG1 VAL 33 -12.939 -4.429 5.389 270 2HG1 VAL 33 2HG1 VAL 33 -13.901 -4.229 6.853 271 3HG1 VAL 33 3HG1 VAL 33 -13.233 -5.810 6.445 272 1HG2 VAL 33 1HG2 VAL 33 -9.716 -4.891 7.128 273 2HG2 VAL 33 2HG2 VAL 33 -10.577 -5.192 5.621 274 3HG2 VAL 33 3HG2 VAL 33 -10.784 -6.286 6.989 275 H ILE 34 H ILE 34 -13.140 -1.002 7.271 276 HA ILE 34 HA ILE 34 -12.579 -0.017 9.812 277 HB ILE 34 HB ILE 34 -14.556 1.279 9.626 278 1HG1 ILE 34 1HG1 ILE 34 -16.148 -0.492 9.053 279 2HG1 ILE 34 2HG1 ILE 34 -16.300 0.871 7.950 280 1HG2 ILE 34 1HG2 ILE 34 -12.875 2.069 8.178 281 2HG2 ILE 34 2HG2 ILE 34 -14.379 2.129 7.261 282 3HG2 ILE 34 3HG2 ILE 34 -13.228 0.828 6.977 283 1HD1 ILE 34 1HD1 ILE 34 -14.852 -0.412 6.349 284 2HD1 ILE 34 2HD1 ILE 34 -16.456 -1.082 6.649 285 3HD1 ILE 34 3HD1 ILE 34 -15.042 -1.802 7.420 286 H GLN 35 H GLN 35 -13.333 -0.448 11.819 287 HA GLN 35 HA GLN 35 -15.598 -2.193 12.224 288 1HB GLN 35 1HB GLN 35 -12.988 -3.290 12.149 289 2HB GLN 35 2HB GLN 35 -13.496 -3.292 13.833 290 1HG GLN 35 1HG GLN 35 -15.702 -4.213 12.389 291 2HG GLN 35 2HG GLN 35 -14.300 -5.004 11.672 292 1HE2 GLN 35 1HE2 GLN 35 -13.022 -6.362 12.954 293 2HE2 GLN 35 2HE2 GLN 35 -13.610 -7.026 14.437 294 H GLY 36 H GLY 36 -16.553 -0.542 13.379 295 1HA GLY 36 1HA GLY 36 -17.076 0.663 15.263 296 2HA GLY 36 2HA GLY 36 -15.951 -0.372 16.129 297 H ASN 37 H ASN 37 -13.692 0.212 16.124 298 HA ASN 37 HA ASN 37 -13.014 2.910 15.286 299 1HB ASN 37 1HB ASN 37 -13.591 2.178 18.062 300 2HB ASN 37 2HB ASN 37 -12.002 2.911 17.859 301 1HD2 ASN 37 1HD2 ASN 37 -13.156 4.512 19.270 302 2HD2 ASN 37 2HD2 ASN 37 -13.998 5.793 18.474 303 H ARG 38 H ARG 38 -12.234 0.053 14.785 304 HA ARG 38 HA ARG 38 -9.342 0.386 15.212 305 1HB ARG 38 1HB ARG 38 -10.567 -2.345 15.193 306 2HB ARG 38 2HB ARG 38 -9.050 -1.819 15.892 307 1HG ARG 38 1HG ARG 38 -10.003 -1.692 17.864 308 2HG ARG 38 2HG ARG 38 -11.113 -0.461 17.262 309 1HD ARG 38 1HD ARG 38 -12.328 -2.606 16.275 310 2HD ARG 38 2HD ARG 38 -11.500 -3.380 17.626 311 HE ARG 38 HE ARG 38 -13.050 -0.986 18.212 312 1HH1 ARG 38 1HH1 ARG 38 -12.841 -4.474 18.282 313 2HH1 ARG 38 2HH1 ARG 38 -14.091 -4.645 19.466 314 1HH2 ARG 38 1HH2 ARG 38 -14.690 -1.214 19.763 315 2HH2 ARG 38 2HH2 ARG 38 -15.142 -2.795 20.307 316 H THR 39 H THR 39 -8.001 -0.494 13.580 317 HA THR 39 HA THR 39 -9.402 -0.910 11.034 318 HB THR 39 HB THR 39 -7.143 0.653 11.726 319 HG1 THR 39 HG1 THR 39 -7.761 0.138 9.055 320 1HG2 THR 39 1HG2 THR 39 -6.417 -1.547 9.807 321 2HG2 THR 39 2HG2 THR 39 -5.657 -1.210 11.359 322 3HG2 THR 39 3HG2 THR 39 -5.505 -0.056 10.038 323 H PHE 40 H PHE 40 -9.594 -2.916 10.317 324 HA PHE 40 HA PHE 40 -7.947 -5.019 11.455 325 1HB PHE 40 1HB PHE 40 -10.515 -5.095 11.016 326 2HB PHE 40 2HB PHE 40 -10.044 -5.454 9.360 327 HD1 PHE 40 HD1 PHE 40 -7.522 -7.070 10.217 328 HD2 PHE 40 HD2 PHE 40 -11.618 -7.178 11.360 329 HE1 PHE 40 HE1 PHE 40 -7.295 -9.438 10.786 330 HE2 PHE 40 HE2 PHE 40 -11.399 -9.557 11.938 331 HZ PHE 40 HZ PHE 40 -9.233 -10.696 11.653 332 H ILE 41 H ILE 41 -5.947 -4.309 10.398 333 HA ILE 41 HA ILE 41 -5.636 -4.188 7.617 334 HB ILE 41 HB ILE 41 -3.874 -4.231 9.901 335 1HG1 ILE 41 1HG1 ILE 41 -2.449 -2.910 8.424 336 2HG1 ILE 41 2HG1 ILE 41 -3.394 -3.422 7.027 337 1HG2 ILE 41 1HG2 ILE 41 -3.209 -6.462 9.129 338 2HG2 ILE 41 2HG2 ILE 41 -1.914 -5.291 8.906 339 3HG2 ILE 41 3HG2 ILE 41 -2.881 -5.806 7.526 340 1HD1 ILE 41 1HD1 ILE 41 -4.032 -1.439 9.132 341 2HD1 ILE 41 2HD1 ILE 41 -5.361 -2.359 8.428 342 3HD1 ILE 41 3HD1 ILE 41 -4.320 -1.384 7.394 343 H GLN 42 H GLN 42 -6.031 -5.731 6.175 344 HA GLN 42 HA GLN 42 -5.658 -8.530 7.001 345 1HB GLN 42 1HB GLN 42 -7.997 -7.801 6.395 346 2HB GLN 42 2HB GLN 42 -7.419 -7.540 4.755 347 1HG GLN 42 1HG GLN 42 -7.671 -9.682 4.273 348 2HG GLN 42 2HG GLN 42 -6.661 -10.155 5.639 349 1HE2 GLN 42 1HE2 GLN 42 -7.782 -11.817 6.471 350 2HE2 GLN 42 2HE2 GLN 42 -9.412 -11.721 7.037 351 H ASN 43 H ASN 43 -5.145 -6.151 4.479 352 HA ASN 43 HA ASN 43 -3.290 -8.007 3.150 353 1HB ASN 43 1HB ASN 43 -5.089 -5.859 2.136 354 2HB ASN 43 2HB ASN 43 -3.564 -6.120 1.292 355 1HD2 ASN 43 1HD2 ASN 43 -3.567 -7.580 -0.252 356 2HD2 ASN 43 2HD2 ASN 43 -4.717 -8.854 -0.447 357 H PHE 44 H PHE 44 -2.182 -6.998 5.319 358 HA PHE 44 HA PHE 44 -1.113 -4.485 5.405 359 1HB PHE 44 1HB PHE 44 -0.774 -6.173 7.166 360 2HB PHE 44 2HB PHE 44 0.347 -7.037 6.118 361 HD1 PHE 44 HD1 PHE 44 2.454 -6.861 7.028 362 HD2 PHE 44 HD2 PHE 44 -0.029 -3.407 6.889 363 HE1 PHE 44 HE1 PHE 44 4.312 -5.495 7.889 364 HE2 PHE 44 HE2 PHE 44 1.823 -2.035 7.750 365 HZ PHE 44 HZ PHE 44 3.997 -3.080 8.251 366 H ARG 45 H ARG 45 -0.333 -6.974 3.117 367 HA ARG 45 HA ARG 45 2.155 -5.734 2.315 368 1HB ARG 45 1HB ARG 45 1.846 -8.191 2.225 369 2HB ARG 45 2HB ARG 45 0.605 -7.969 0.999 370 1HG ARG 45 1HG ARG 45 2.459 -8.482 -0.262 371 2HG ARG 45 2HG ARG 45 2.453 -6.718 -0.304 372 1HD ARG 45 1HD ARG 45 4.653 -7.131 0.197 373 2HD ARG 45 2HD ARG 45 3.972 -6.965 1.815 374 HE ARG 45 HE ARG 45 4.880 -9.426 0.536 375 1HH1 ARG 45 1HH1 ARG 45 3.415 -7.877 3.309 376 2HH1 ARG 45 2HH1 ARG 45 3.648 -9.245 4.344 377 1HH2 ARG 45 1HH2 ARG 45 5.180 -11.216 1.902 378 2HH2 ARG 45 2HH2 ARG 45 4.649 -11.136 3.548 379 H GLU 46 H GLU 46 -0.972 -6.375 0.733 380 HA GLU 46 HA GLU 46 -0.406 -4.740 -1.528 381 1HB GLU 46 1HB GLU 46 -2.168 -6.636 -1.251 382 2HB GLU 46 2HB GLU 46 -3.189 -5.354 -0.623 383 1HG GLU 46 1HG GLU 46 -3.756 -5.467 -2.869 384 2HG GLU 46 2HG GLU 46 -2.642 -4.103 -2.781 385 H VAL 47 H VAL 47 -2.034 -4.250 1.524 386 HA VAL 47 HA VAL 47 -3.015 -1.643 0.938 387 HB VAL 47 HB VAL 47 -2.478 -2.758 3.691 388 1HG1 VAL 47 1HG1 VAL 47 -4.188 -1.283 4.431 389 2HG1 VAL 47 2HG1 VAL 47 -4.643 -0.880 2.777 390 3HG1 VAL 47 3HG1 VAL 47 -3.094 -0.337 3.421 391 1HG2 VAL 47 1HG2 VAL 47 -5.187 -3.046 2.594 392 2HG2 VAL 47 2HG2 VAL 47 -4.240 -4.146 3.595 393 3HG2 VAL 47 3HG2 VAL 47 -3.971 -4.086 1.854 394 H ALA 48 H ALA 48 -0.153 -2.892 2.640 395 HA ALA 48 HA ALA 48 0.825 -0.402 3.482 396 1HB ALA 48 1HB ALA 48 3.016 -1.566 3.703 397 2HB ALA 48 2HB ALA 48 2.270 -2.984 2.969 398 3HB ALA 48 3HB ALA 48 1.670 -2.367 4.510 399 H ASP 49 H ASP 49 1.033 -2.006 0.390 400 HA ASP 49 HA ASP 49 3.211 -0.358 -0.538 401 1HB ASP 49 1HB ASP 49 1.937 -2.702 -1.433 402 2HB ASP 49 2HB ASP 49 1.676 -1.500 -2.694 403 H ALA 50 H ALA 50 -0.145 -0.649 -1.716 404 HA ALA 50 HA ALA 50 -0.221 1.676 -3.187 405 1HB ALA 50 1HB ALA 50 -2.277 0.982 -3.616 406 2HB ALA 50 2HB ALA 50 -2.769 1.242 -1.944 407 3HB ALA 50 3HB ALA 50 -2.042 -0.291 -2.418 408 H LEU 51 H LEU 51 -0.752 1.331 0.300 409 HA LEU 51 HA LEU 51 -1.678 4.009 0.634 410 1HB LEU 51 1HB LEU 51 -2.434 2.617 2.324 411 2HB LEU 51 2HB LEU 51 -0.897 1.792 2.474 412 HG LEU 51 HG LEU 51 0.050 3.603 3.685 413 1HD1 LEU 51 1HD1 LEU 51 -2.300 5.276 3.929 414 2HD1 LEU 51 2HD1 LEU 51 -1.677 5.181 2.286 415 3HD1 LEU 51 3HD1 LEU 51 -0.626 5.706 3.594 416 1HD2 LEU 51 1HD2 LEU 51 -1.071 3.353 5.680 417 2HD2 LEU 51 2HD2 LEU 51 -1.696 1.982 4.766 418 3HD2 LEU 51 3HD2 LEU 51 -2.657 3.449 4.919 419 H ASN 52 H ASN 52 1.442 2.381 1.027 420 HA ASN 52 HA ASN 52 2.904 4.722 0.444 421 1HB ASN 52 1HB ASN 52 2.065 4.782 3.043 422 2HB ASN 52 2HB ASN 52 3.630 3.989 3.203 423 1HD2 ASN 52 1HD2 ASN 52 1.978 6.883 2.163 424 2HD2 ASN 52 2HD2 ASN 52 3.367 7.908 2.163 425 H ARG 53 H ARG 53 4.252 3.683 -0.846 426 HA ARG 53 HA ARG 53 5.139 1.165 -0.968 427 1HB ARG 53 1HB ARG 53 5.752 3.144 -2.448 428 2HB ARG 53 2HB ARG 53 7.061 3.459 -1.317 429 1HG ARG 53 1HG ARG 53 8.023 2.241 -3.065 430 2HG ARG 53 2HG ARG 53 7.824 1.085 -1.748 431 1HD ARG 53 1HD ARG 53 5.457 0.835 -3.093 432 2HD ARG 53 2HD ARG 53 6.592 1.151 -4.404 433 HE ARG 53 HE ARG 53 6.300 -1.272 -3.045 434 1HH1 ARG 53 1HH1 ARG 53 8.848 0.863 -4.122 435 2HH1 ARG 53 2HH1 ARG 53 10.017 -0.404 -4.267 436 1HH2 ARG 53 1HH2 ARG 53 7.843 -2.939 -3.245 437 2HH2 ARG 53 2HH2 ARG 53 9.448 -2.559 -3.776 438 H ASP 54 H ASP 54 7.236 3.583 0.627 439 HA ASP 54 HA ASP 54 8.886 1.714 1.885 440 1HB ASP 54 1HB ASP 54 8.290 4.612 2.337 441 2HB ASP 54 2HB ASP 54 9.243 3.743 3.535 442 HA PRO 55 HA PRO 55 6.085 0.246 5.034 443 1HB PRO 55 1HB PRO 55 7.848 -1.229 6.460 444 2HB PRO 55 2HB PRO 55 7.221 -1.752 4.892 445 1HG PRO 55 1HG PRO 55 9.836 -0.449 5.547 446 2HG PRO 55 2HG PRO 55 9.507 -1.812 4.461 447 1HD PRO 55 1HD PRO 55 9.882 0.721 3.565 448 2HD PRO 55 2HD PRO 55 8.824 -0.441 2.742 449 H GLN 56 H GLN 56 9.133 1.831 5.755 450 HA GLN 56 HA GLN 56 8.779 2.202 8.515 451 1HB GLN 56 1HB GLN 56 10.531 3.249 6.419 452 2HB GLN 56 2HB GLN 56 10.214 4.411 7.699 453 1HG GLN 56 1HG GLN 56 10.758 2.190 9.147 454 2HG GLN 56 2HG GLN 56 11.786 1.938 7.736 455 1HE2 GLN 56 1HE2 GLN 56 13.551 2.165 9.242 456 2HE2 GLN 56 2HE2 GLN 56 14.098 3.742 9.687 457 H HIS 57 H HIS 57 7.564 3.968 5.744 458 HA HIS 57 HA HIS 57 6.684 6.245 7.228 459 1HB HIS 57 1HB HIS 57 6.986 5.694 4.557 460 2HB HIS 57 2HB HIS 57 5.234 5.661 4.741 461 HD2 HIS 57 HD2 HIS 57 5.107 8.196 6.927 462 HE1 HIS 57 HE1 HIS 57 6.820 10.361 3.705 463 HE2 HIS 57 HE2 HIS 57 5.690 10.518 5.952 464 H LEU 58 H LEU 58 4.844 3.656 5.623 465 HA LEU 58 HA LEU 58 2.329 4.137 6.518 466 1HB LEU 58 1HB LEU 58 3.695 1.969 5.391 467 2HB LEU 58 2HB LEU 58 2.900 1.320 6.812 468 HG LEU 58 HG LEU 58 0.982 2.908 5.477 469 1HD1 LEU 58 1HD1 LEU 58 2.861 2.230 3.614 470 2HD1 LEU 58 2HD1 LEU 58 1.162 2.542 3.266 471 3HD1 LEU 58 3HD1 LEU 58 1.725 0.901 3.504 472 1HD2 LEU 58 1HD2 LEU 58 0.703 0.830 6.862 473 2HD2 LEU 58 2HD2 LEU 58 1.235 -0.095 5.458 474 3HD2 LEU 58 3HD2 LEU 58 -0.238 0.870 5.373 475 H LEU 59 H LEU 59 4.883 2.467 8.303 476 HA LEU 59 HA LEU 59 3.338 1.772 10.546 477 1HB LEU 59 1HB LEU 59 5.812 1.163 9.735 478 2HB LEU 59 2HB LEU 59 6.210 2.387 10.927 479 HG LEU 59 HG LEU 59 4.673 0.997 12.502 480 1HD1 LEU 59 1HD1 LEU 59 5.265 -1.515 11.636 481 2HD1 LEU 59 2HD1 LEU 59 4.874 -0.699 10.123 482 3HD1 LEU 59 3HD1 LEU 59 3.704 -0.722 11.440 483 1HD2 LEU 59 1HD2 LEU 59 7.321 1.241 12.265 484 2HD2 LEU 59 2HD2 LEU 59 7.167 -0.480 11.912 485 3HD2 LEU 59 3HD2 LEU 59 6.561 0.164 13.437 486 H LYS 60 H LYS 60 5.615 4.483 10.105 487 HA LYS 60 HA LYS 60 5.144 5.710 12.568 488 1HB LYS 60 1HB LYS 60 5.880 6.975 9.921 489 2HB LYS 60 2HB LYS 60 5.989 7.777 11.483 490 1HG LYS 60 1HG LYS 60 7.473 5.261 10.775 491 2HG LYS 60 2HG LYS 60 8.144 6.886 10.626 492 1HD LYS 60 1HD LYS 60 6.984 6.505 13.235 493 2HD LYS 60 2HD LYS 60 8.153 5.230 12.887 494 1HE LYS 60 1HE LYS 60 8.978 7.966 12.171 495 2HE LYS 60 2HE LYS 60 8.814 7.640 13.896 496 1HZ LYS 60 1HZ LYS 60 10.176 5.500 13.144 497 2HZ LYS 60 2HZ LYS 60 10.926 6.937 13.626 498 3HZ LYS 60 3HZ LYS 60 10.739 6.592 11.981 499 H PHE 61 H PHE 61 3.221 5.560 9.708 500 HA PHE 61 HA PHE 61 1.590 7.838 10.346 501 1HB PHE 61 1HB PHE 61 1.798 5.882 8.159 502 2HB PHE 61 2HB PHE 61 0.158 6.426 8.492 503 HD1 PHE 61 HD1 PHE 61 2.879 8.733 9.196 504 HD2 PHE 61 HD2 PHE 61 0.115 7.410 6.242 505 HE1 PHE 61 HE1 PHE 61 3.272 10.791 7.911 506 HE2 PHE 61 HE2 PHE 61 0.504 9.465 4.950 507 HZ PHE 61 HZ PHE 61 2.083 11.159 5.785 508 H LEU 62 H LEU 62 1.196 4.295 10.547 509 HA LEU 62 HA LEU 62 -1.458 4.326 11.434 510 1HB LEU 62 1HB LEU 62 -1.191 2.074 12.081 511 2HB LEU 62 2HB LEU 62 -0.175 2.299 10.672 512 HG LEU 62 HG LEU 62 1.686 2.699 12.520 513 1HD1 LEU 62 1HD1 LEU 62 0.708 2.471 14.552 514 2HD1 LEU 62 2HD1 LEU 62 1.085 0.776 14.246 515 3HD1 LEU 62 3HD1 LEU 62 -0.540 1.384 13.948 516 1HD2 LEU 62 1HD2 LEU 62 2.501 0.683 11.898 517 2HD2 LEU 62 2HD2 LEU 62 1.193 0.791 10.723 518 3HD2 LEU 62 3HD2 LEU 62 0.976 -0.150 12.199 519 H LEU 63 H LEU 63 1.569 4.506 13.274 520 HA LEU 63 HA LEU 63 0.203 4.557 15.799 521 1HB LEU 63 1HB LEU 63 2.411 5.055 16.749 522 2HB LEU 63 2HB LEU 63 2.423 3.646 15.707 523 HG LEU 63 HG LEU 63 3.186 5.458 13.905 524 1HD1 LEU 63 1HD1 LEU 63 4.868 6.941 15.133 525 2HD1 LEU 63 2HD1 LEU 63 3.904 6.620 16.575 526 3HD1 LEU 63 3HD1 LEU 63 3.171 7.414 15.183 527 1HD2 LEU 63 1HD2 LEU 63 4.462 3.515 15.572 528 2HD2 LEU 63 2HD2 LEU 63 5.553 4.877 15.320 529 3HD2 LEU 63 3HD2 LEU 63 4.877 4.022 13.934 530 H ARG 64 H ARG 64 1.522 6.945 13.599 531 HA ARG 64 HA ARG 64 1.400 9.170 15.326 532 1HB ARG 64 1HB ARG 64 1.574 8.795 12.386 533 2HB ARG 64 2HB ARG 64 1.015 10.362 12.952 534 1HG ARG 64 1HG ARG 64 3.329 9.558 14.444 535 2HG ARG 64 2HG ARG 64 3.659 9.468 12.714 536 1HD ARG 64 1HD ARG 64 4.103 11.658 12.904 537 2HD ARG 64 2HD ARG 64 2.352 11.839 12.877 538 HE ARG 64 HE ARG 64 3.959 11.735 15.349 539 1HH1 ARG 64 1HH1 ARG 64 1.231 12.949 13.526 540 2HH1 ARG 64 2HH1 ARG 64 0.692 13.986 14.799 541 1HH2 ARG 64 1HH2 ARG 64 3.241 13.105 17.017 542 2HH2 ARG 64 2HH2 ARG 64 1.827 14.077 16.776 543 H GLU 65 H GLU 65 -1.035 7.499 13.506 544 HA GLU 65 HA GLU 65 -3.005 9.556 14.234 545 1HB GLU 65 1HB GLU 65 -2.660 7.851 11.892 546 2HB GLU 65 2HB GLU 65 -4.295 7.790 12.537 547 1HG GLU 65 1HG GLU 65 -4.079 10.386 12.553 548 2HG GLU 65 2HG GLU 65 -2.798 10.090 11.379 549 H LEU 66 H LEU 66 -1.830 6.658 15.313 550 HA LEU 66 HA LEU 66 -4.355 5.484 16.102 551 1HB LEU 66 1HB LEU 66 -1.587 4.656 15.994 552 2HB LEU 66 2HB LEU 66 -2.288 4.264 17.546 553 HG LEU 66 HG LEU 66 -3.973 2.902 16.530 554 1HD1 LEU 66 1HD1 LEU 66 -3.780 4.542 14.361 555 2HD1 LEU 66 2HD1 LEU 66 -4.669 3.021 14.416 556 3HD1 LEU 66 3HD1 LEU 66 -3.025 3.060 13.777 557 1HD2 LEU 66 1HD2 LEU 66 -2.069 1.676 14.875 558 2HD2 LEU 66 2HD2 LEU 66 -2.468 1.280 16.544 559 3HD2 LEU 66 3HD2 LEU 66 -1.175 2.428 16.196 560 H GLY 67 H GLY 67 -5.422 6.683 17.607 561 1HA GLY 67 1HA GLY 67 -3.996 8.009 19.739 562 2HA GLY 67 2HA GLY 67 -5.738 7.984 19.505 563 H THR 68 H THR 68 -4.731 4.851 19.305 564 HA THR 68 HA THR 68 -5.094 4.402 22.191 565 HB THR 68 HB THR 68 -6.566 2.652 21.827 566 HG1 THR 68 HG1 THR 68 -5.209 1.539 20.322 567 1HG2 THR 68 1HG2 THR 68 -8.313 3.552 20.771 568 2HG2 THR 68 2HG2 THR 68 -7.423 3.763 19.265 569 3HG2 THR 68 3HG2 THR 68 -7.257 4.948 20.559 570 H ALA 69 H ALA 69 -4.298 2.151 22.838 571 HA ALA 69 HA ALA 69 -1.681 1.824 22.845 572 1HB ALA 69 1HB ALA 69 -2.192 -0.082 23.859 573 2HB ALA 69 2HB ALA 69 -2.690 -0.808 22.329 574 3HB ALA 69 3HB ALA 69 -3.854 0.097 23.295 575 H GLY 70 H GLY 70 -3.493 -0.017 20.370 576 1HA GLY 70 1HA GLY 70 -2.967 -0.131 18.075 577 2HA GLY 70 2HA GLY 70 -1.421 0.626 18.413 578 H ASN 71 H ASN 71 -3.097 -2.312 17.955 579 HA ASN 71 HA ASN 71 -0.651 -3.780 17.799 580 1HB ASN 71 1HB ASN 71 -2.415 -4.084 20.180 581 2HB ASN 71 2HB ASN 71 -1.694 -5.540 19.500 582 1HD2 ASN 71 1HD2 ASN 71 0.750 -4.575 18.674 583 2HD2 ASN 71 2HD2 ASN 71 1.673 -4.093 20.052 584 H LEU 72 H LEU 72 -1.078 -6.114 17.218 585 HA LEU 72 HA LEU 72 -3.300 -6.168 15.346 586 1HB LEU 72 1HB LEU 72 -1.271 -8.351 15.743 587 2HB LEU 72 2HB LEU 72 -2.219 -7.999 14.314 588 HG LEU 72 HG LEU 72 -0.167 -7.224 13.655 589 1HD1 LEU 72 1HD1 LEU 72 -1.407 -4.851 15.038 590 2HD1 LEU 72 2HD1 LEU 72 -1.650 -5.367 13.372 591 3HD1 LEU 72 3HD1 LEU 72 -0.080 -4.755 13.884 592 1HD2 LEU 72 1HD2 LEU 72 1.495 -7.235 15.115 593 2HD2 LEU 72 2HD2 LEU 72 0.362 -7.189 16.464 594 3HD2 LEU 72 3HD2 LEU 72 0.932 -5.686 15.738 595 H GLU 73 H GLU 73 -5.198 -7.124 15.767 596 HA GLU 73 HA GLU 73 -5.321 -9.012 18.015 597 1HB GLU 73 1HB GLU 73 -6.739 -7.039 18.260 598 2HB GLU 73 2HB GLU 73 -7.507 -7.387 16.729 599 1HG GLU 73 1HG GLU 73 -8.337 -9.525 17.699 600 2HG GLU 73 2HG GLU 73 -7.718 -8.983 19.260 601 H GLY 74 H GLY 74 -6.712 -10.860 17.823 602 1HA GLY 74 1HA GLY 74 -6.310 -12.846 16.292 603 2HA GLY 74 2HA GLY 74 -7.990 -12.449 16.578 604 H GLY 75 H GLY 75 -6.367 -13.696 14.309 605 1HA GLY 75 1HA GLY 75 -7.162 -13.901 12.078 606 2HA GLY 75 2HA GLY 75 -7.781 -12.258 12.178 607 H ARG 76 H ARG 76 -6.726 -10.887 10.933 608 HA ARG 76 HA ARG 76 -4.027 -11.507 10.066 609 1HB ARG 76 1HB ARG 76 -6.243 -10.027 8.976 610 2HB ARG 76 2HB ARG 76 -4.819 -9.000 9.042 611 1HG ARG 76 1HG ARG 76 -4.697 -11.755 7.875 612 2HG ARG 76 2HG ARG 76 -5.193 -10.358 6.919 613 1HD ARG 76 1HD ARG 76 -3.001 -10.141 6.488 614 2HD ARG 76 2HD ARG 76 -2.926 -9.424 8.096 615 HE ARG 76 HE ARG 76 -2.642 -12.249 8.216 616 1HH1 ARG 76 1HH1 ARG 76 -0.915 -9.323 7.420 617 2HH1 ARG 76 2HH1 ARG 76 0.640 -9.992 7.782 618 1HH2 ARG 76 1HH2 ARG 76 -0.590 -13.133 8.689 619 2HH2 ARG 76 2HH2 ARG 76 0.826 -12.153 8.501 620 H ALA 77 H ALA 77 -5.331 -8.282 10.810 621 HA ALA 77 HA ALA 77 -3.607 -7.986 13.087 622 1HB ALA 77 1HB ALA 77 -2.868 -5.867 11.269 623 2HB ALA 77 2HB ALA 77 -2.469 -7.453 10.614 624 3HB ALA 77 3HB ALA 77 -1.849 -6.972 12.191 625 H ILE 78 H ILE 78 -5.740 -7.569 13.959 626 HA ILE 78 HA ILE 78 -7.122 -5.165 13.112 627 HB ILE 78 HB ILE 78 -7.728 -6.610 15.656 628 1HG1 ILE 78 1HG1 ILE 78 -8.811 -7.476 12.983 629 2HG1 ILE 78 2HG1 ILE 78 -7.484 -8.295 13.795 630 1HG2 ILE 78 1HG2 ILE 78 -8.947 -4.591 15.292 631 2HG2 ILE 78 2HG2 ILE 78 -10.040 -5.962 15.105 632 3HG2 ILE 78 3HG2 ILE 78 -9.426 -5.124 13.680 633 1HD1 ILE 78 1HD1 ILE 78 -9.858 -9.232 14.055 634 2HD1 ILE 78 2HD1 ILE 78 -10.105 -7.891 15.174 635 3HD1 ILE 78 3HD1 ILE 78 -8.848 -9.085 15.494 636 H LEU 79 H LEU 79 -5.746 -3.421 13.530 637 HA LEU 79 HA LEU 79 -4.748 -3.097 16.249 638 1HB LEU 79 1HB LEU 79 -3.489 -1.215 15.441 639 2HB LEU 79 2HB LEU 79 -3.244 -2.576 14.364 640 HG LEU 79 HG LEU 79 -5.217 -1.405 13.031 641 1HD1 LEU 79 1HD1 LEU 79 -4.060 1.150 13.517 642 2HD1 LEU 79 2HD1 LEU 79 -4.641 0.494 15.049 643 3HD1 LEU 79 3HD1 LEU 79 -5.742 0.648 13.678 644 1HD2 LEU 79 1HD2 LEU 79 -2.823 0.079 12.443 645 2HD2 LEU 79 2HD2 LEU 79 -3.597 -1.212 11.524 646 3HD2 LEU 79 3HD2 LEU 79 -2.438 -1.607 12.792 647 H GLN 80 H GLN 80 -4.919 -0.649 17.020 648 HA GLN 80 HA GLN 80 -7.661 0.293 16.530 649 1HB GLN 80 1HB GLN 80 -7.096 -1.214 18.698 650 2HB GLN 80 2HB GLN 80 -6.701 0.372 19.329 651 1HG GLN 80 1HG GLN 80 -9.203 0.528 17.982 652 2HG GLN 80 2HG GLN 80 -9.227 -0.839 19.094 653 1HE2 GLN 80 1HE2 GLN 80 -7.605 0.081 21.096 654 2HE2 GLN 80 2HE2 GLN 80 -8.361 1.419 21.883 655 H GLY 81 H GLY 81 -7.782 2.447 16.285 656 1HA GLY 81 1HA GLY 81 -6.412 4.384 17.729 657 2HA GLY 81 2HA GLY 81 -5.429 4.028 16.322 658 H LYS 82 H LYS 82 -6.351 4.407 14.192 659 HA LYS 82 HA LYS 82 -8.844 5.653 13.805 660 1HB LYS 82 1HB LYS 82 -6.921 7.352 14.949 661 2HB LYS 82 2HB LYS 82 -7.034 7.836 13.264 662 1HG LYS 82 1HG LYS 82 -9.601 7.412 14.639 663 2HG LYS 82 2HG LYS 82 -8.630 8.766 15.220 664 1HD LYS 82 1HD LYS 82 -9.076 9.986 13.404 665 2HD LYS 82 2HD LYS 82 -8.712 8.641 12.321 666 1HE LYS 82 1HE LYS 82 -10.969 9.121 11.924 667 2HE LYS 82 2HE LYS 82 -10.993 7.713 12.985 668 1HZ LYS 82 1HZ LYS 82 -11.015 9.854 14.687 669 2HZ LYS 82 2HZ LYS 82 -12.346 8.898 14.269 670 3HZ LYS 82 3HZ LYS 82 -12.039 10.333 13.427 671 H PHE 83 H PHE 83 -8.154 3.786 12.247 672 HA PHE 83 HA PHE 83 -7.137 5.066 9.795 673 1HB PHE 83 1HB PHE 83 -6.223 2.601 11.113 674 2HB PHE 83 2HB PHE 83 -6.572 2.403 9.404 675 HD1 PHE 83 HD1 PHE 83 -5.645 5.692 9.535 676 HD2 PHE 83 HD2 PHE 83 -3.949 1.818 10.044 677 HE1 PHE 83 HE1 PHE 83 -3.433 6.591 8.972 678 HE2 PHE 83 HE2 PHE 83 -1.731 2.715 9.484 679 HZ PHE 83 HZ PHE 83 -1.468 5.102 8.946 680 H THR 84 H THR 84 -9.782 5.093 10.446 681 HA THR 84 HA THR 84 -11.182 2.881 9.249 682 HB THR 84 HB THR 84 -12.436 5.559 9.728 683 HG1 THR 84 HG1 THR 84 -11.948 3.709 11.810 684 1HG2 THR 84 1HG2 THR 84 -14.254 4.136 10.668 685 2HG2 THR 84 2HG2 THR 84 -13.354 2.727 10.111 686 3HG2 THR 84 3HG2 THR 84 -13.949 3.910 8.947 687 H HIS 85 H HIS 85 -10.000 2.956 7.215 688 HA HIS 85 HA HIS 85 -9.585 3.597 5.054 689 1HB HIS 85 1HB HIS 85 -11.593 3.814 3.706 690 2HB HIS 85 2HB HIS 85 -11.855 2.587 4.940 691 HD2 HIS 85 HD2 HIS 85 -14.505 2.865 5.489 692 HE1 HIS 85 HE1 HIS 85 -14.551 7.078 6.015 693 HE2 HIS 85 HE2 HIS 85 -15.834 4.930 6.315 694 H PHE 86 H PHE 86 -9.086 5.692 6.909 695 HA PHE 86 HA PHE 86 -10.093 8.098 5.614 696 1HB PHE 86 1HB PHE 86 -8.844 7.472 8.218 697 2HB PHE 86 2HB PHE 86 -8.408 9.030 7.520 698 HD1 PHE 86 HD1 PHE 86 -10.063 10.763 7.203 699 HD2 PHE 86 HD2 PHE 86 -11.105 7.008 8.912 700 HE1 PHE 86 HE1 PHE 86 -12.197 11.711 7.975 701 HE2 PHE 86 HE2 PHE 86 -13.241 7.949 9.689 702 HZ PHE 86 HZ PHE 86 -13.789 10.304 9.221 703 H LEU 87 H LEU 87 -6.895 7.605 6.950 704 HA LEU 87 HA LEU 87 -5.649 8.977 4.787 705 1HB LEU 87 1HB LEU 87 -4.895 9.023 7.161 706 2HB LEU 87 2HB LEU 87 -4.397 7.351 6.998 707 HG LEU 87 HG LEU 87 -3.280 9.530 5.253 708 1HD1 LEU 87 1HD1 LEU 87 -1.367 8.822 7.153 709 2HD1 LEU 87 2HD1 LEU 87 -2.848 9.087 8.067 710 3HD1 LEU 87 3HD1 LEU 87 -2.218 10.358 7.020 711 1HD2 LEU 87 1HD2 LEU 87 -1.431 7.502 5.707 712 2HD2 LEU 87 2HD2 LEU 87 -2.359 7.778 4.238 713 3HD2 LEU 87 3HD2 LEU 87 -2.962 6.669 5.468 714 H ILE 88 H ILE 88 -5.674 5.591 5.900 715 HA ILE 88 HA ILE 88 -3.943 4.528 4.000 716 HB ILE 88 HB ILE 88 -6.389 3.124 5.067 717 1HG1 ILE 88 1HG1 ILE 88 -3.681 3.562 6.347 718 2HG1 ILE 88 2HG1 ILE 88 -5.263 3.978 6.994 719 1HG2 ILE 88 1HG2 ILE 88 -4.756 2.238 3.166 720 2HG2 ILE 88 2HG2 ILE 88 -5.478 1.169 4.367 721 3HG2 ILE 88 3HG2 ILE 88 -3.821 1.735 4.575 722 1HD1 ILE 88 1HD1 ILE 88 -5.563 1.949 7.859 723 2HD1 ILE 88 2HD1 ILE 88 -3.826 1.755 7.632 724 3HD1 ILE 88 3HD1 ILE 88 -4.948 1.136 6.424 725 H ASN 89 H ASN 89 -7.487 4.372 3.897 726 HA ASN 89 HA ASN 89 -7.794 3.418 1.338 727 1HB ASN 89 1HB ASN 89 -9.565 3.808 3.129 728 2HB ASN 89 2HB ASN 89 -9.652 5.465 2.540 729 1HD2 ASN 89 1HD2 ASN 89 -11.835 5.069 2.016 730 2HD2 ASN 89 2HD2 ASN 89 -12.263 4.211 0.579 731 H GLU 90 H GLU 90 -7.467 6.807 2.346 732 HA GLU 90 HA GLU 90 -7.938 7.952 -0.176 733 1HB GLU 90 1HB GLU 90 -7.846 9.089 2.113 734 2HB GLU 90 2HB GLU 90 -6.103 9.142 1.890 735 1HG GLU 90 1HG GLU 90 -6.316 10.528 -0.033 736 2HG GLU 90 2HG GLU 90 -8.065 10.311 -0.063 737 H ARG 91 H ARG 91 -4.804 7.329 1.434 738 HA ARG 91 HA ARG 91 -3.191 8.118 -0.704 739 1HB ARG 91 1HB ARG 91 -2.802 6.322 1.645 740 2HB ARG 91 2HB ARG 91 -1.565 6.364 0.399 741 1HG ARG 91 1HG ARG 91 -2.520 8.655 2.100 742 2HG ARG 91 2HG ARG 91 -0.948 7.857 2.156 743 1HD ARG 91 1HD ARG 91 -1.904 9.179 -0.355 744 2HD ARG 91 2HD ARG 91 -1.172 10.123 0.935 745 HE ARG 91 HE ARG 91 0.184 7.933 -0.499 746 1HH1 ARG 91 1HH1 ARG 91 0.280 10.960 1.254 747 2HH1 ARG 91 2HH1 ARG 91 1.969 11.203 0.975 748 1HH2 ARG 91 1HH2 ARG 91 2.405 8.262 -0.855 749 2HH2 ARG 91 2HH2 ARG 91 3.173 9.677 -0.218 750 H ILE 92 H ILE 92 -4.376 4.871 0.158 751 HA ILE 92 HA ILE 92 -3.127 3.450 -1.882 752 HB ILE 92 HB ILE 92 -5.791 2.957 -0.539 753 1HG1 ILE 92 1HG1 ILE 92 -3.032 1.797 -0.109 754 2HG1 ILE 92 2HG1 ILE 92 -3.867 2.913 0.963 755 1HG2 ILE 92 1HG2 ILE 92 -4.738 0.532 -1.486 756 2HG2 ILE 92 2HG2 ILE 92 -4.657 1.663 -2.834 757 3HG2 ILE 92 3HG2 ILE 92 -6.197 1.359 -2.030 758 1HD1 ILE 92 1HD1 ILE 92 -4.914 0.180 0.290 759 2HD1 ILE 92 2HD1 ILE 92 -5.463 1.270 1.563 760 3HD1 ILE 92 3HD1 ILE 92 -3.874 0.518 1.672 761 H GLU 93 H GLU 93 -6.471 4.695 -1.828 762 HA GLU 93 HA GLU 93 -7.228 4.080 -4.406 763 1HB GLU 93 1HB GLU 93 -8.433 5.349 -2.363 764 2HB GLU 93 2HB GLU 93 -8.105 6.728 -3.401 765 1HG GLU 93 1HG GLU 93 -10.106 6.201 -4.264 766 2HG GLU 93 2HG GLU 93 -9.164 5.041 -5.201 767 H ASP 94 H ASP 94 -5.082 6.579 -3.314 768 HA ASP 94 HA ASP 94 -5.135 8.090 -5.752 769 1HB ASP 94 1HB ASP 94 -3.459 8.145 -3.263 770 2HB ASP 94 2HB ASP 94 -2.950 9.049 -4.685 771 H TYR 95 H TYR 95 -3.258 5.434 -4.465 772 HA TYR 95 HA TYR 95 -1.277 5.611 -6.574 773 1HB TYR 95 1HB TYR 95 -1.497 4.269 -4.015 774 2HB TYR 95 2HB TYR 95 -0.966 3.152 -5.268 775 HD1 TYR 95 HD1 TYR 95 0.720 4.780 -6.980 776 HD2 TYR 95 HD2 TYR 95 0.360 4.824 -2.744 777 HE1 TYR 95 HE1 TYR 95 3.012 5.659 -6.795 778 HE2 TYR 95 HE2 TYR 95 2.643 5.697 -2.544 779 HH TYR 95 HH TYR 95 4.815 5.545 -4.166 780 H VAL 96 H VAL 96 -3.708 3.214 -5.531 781 HA VAL 96 HA VAL 96 -3.387 1.512 -7.752 782 HB VAL 96 HB VAL 96 -5.954 1.800 -6.199 783 1HG1 VAL 96 1HG1 VAL 96 -4.953 -0.018 -8.202 784 2HG1 VAL 96 2HG1 VAL 96 -6.574 0.120 -7.521 785 3HG1 VAL 96 3HG1 VAL 96 -5.361 -0.879 -6.718 786 1HG2 VAL 96 1HG2 VAL 96 -5.066 0.167 -4.608 787 2HG2 VAL 96 2HG2 VAL 96 -4.105 1.646 -4.606 788 3HG2 VAL 96 3HG2 VAL 96 -3.508 0.208 -5.431 789 H ASN 97 H ASN 97 -5.559 4.266 -7.166 790 HA ASN 97 HA ASN 97 -6.475 4.023 -9.943 791 1HB ASN 97 1HB ASN 97 -8.181 3.965 -8.034 792 2HB ASN 97 2HB ASN 97 -7.805 5.667 -7.793 793 1HD2 ASN 97 1HD2 ASN 97 -10.172 4.003 -8.845 794 2HD2 ASN 97 2HD2 ASN 97 -10.653 4.861 -10.266 795 H LYS 98 H LYS 98 -3.992 5.064 -9.621 796 HA LYS 98 HA LYS 98 -4.117 7.958 -9.498 797 1HB LYS 98 1HB LYS 98 -1.684 7.804 -10.143 798 2HB LYS 98 2HB LYS 98 -2.110 7.049 -8.620 799 1HG LYS 98 1HG LYS 98 -0.861 5.373 -9.425 800 2HG LYS 98 2HG LYS 98 -2.356 4.936 -10.251 801 1HD LYS 98 1HD LYS 98 -1.395 5.241 -12.233 802 2HD LYS 98 2HD LYS 98 -0.965 6.896 -11.801 803 1HE LYS 98 1HE LYS 98 0.641 4.502 -10.941 804 2HE LYS 98 2HE LYS 98 0.950 5.378 -12.439 805 1HZ LYS 98 1HZ LYS 98 2.220 6.719 -11.240 806 2HZ LYS 98 2HZ LYS 98 1.697 6.049 -9.778 807 3HZ LYS 98 3HZ LYS 98 0.823 7.310 -10.491 808 H PHE 99 H PHE 99 -4.591 5.574 -11.835 809 HA PHE 99 HA PHE 99 -3.622 7.007 -14.084 810 1HB PHE 99 1HB PHE 99 -4.768 5.293 -15.439 811 2HB PHE 99 2HB PHE 99 -3.723 4.607 -14.211 812 HD1 PHE 99 HD1 PHE 99 -5.070 4.070 -11.903 813 HD2 PHE 99 HD2 PHE 99 -6.750 4.266 -15.811 814 HE1 PHE 99 HE1 PHE 99 -6.922 2.621 -11.179 815 HE2 PHE 99 HE2 PHE 99 -8.605 2.825 -15.093 816 HZ PHE 99 HZ PHE 99 -8.697 2.000 -12.776 817 H VAL 100 H VAL 100 -6.936 6.477 -12.807 818 HA VAL 100 HA VAL 100 -7.906 8.420 -14.750 819 HB VAL 100 HB VAL 100 -9.571 6.978 -12.693 820 1HG1 VAL 100 1HG1 VAL 100 -11.119 7.387 -14.890 821 2HG1 VAL 100 2HG1 VAL 100 -10.081 8.811 -14.930 822 3HG1 VAL 100 3HG1 VAL 100 -11.055 8.470 -13.500 823 1HG2 VAL 100 1HG2 VAL 100 -9.775 5.143 -14.034 824 2HG2 VAL 100 2HG2 VAL 100 -8.133 5.617 -14.458 825 3HG2 VAL 100 3HG2 VAL 100 -9.471 6.055 -15.513 826 H ILE 101 H ILE 101 -6.579 8.623 -11.721 827 HA ILE 101 HA ILE 101 -8.306 10.859 -10.926 828 HB ILE 101 HB ILE 101 -7.714 9.021 -9.263 829 1HG1 ILE 101 1HG1 ILE 101 -6.783 11.299 -7.793 830 2HG1 ILE 101 2HG1 ILE 101 -7.997 11.832 -8.951 831 1HG2 ILE 101 1HG2 ILE 101 -5.602 8.895 -8.307 832 2HG2 ILE 101 2HG2 ILE 101 -5.126 10.479 -8.917 833 3HG2 ILE 101 3HG2 ILE 101 -5.258 9.113 -10.020 834 1HD1 ILE 101 1HD1 ILE 101 -9.100 9.556 -7.854 835 2HD1 ILE 101 2HD1 ILE 101 -9.500 11.223 -7.439 836 3HD1 ILE 101 3HD1 ILE 101 -8.303 10.341 -6.491 837 H CYS 102 H CYS 102 -4.883 10.057 -11.475 838 HA CYS 102 HA CYS 102 -4.047 12.788 -11.184 839 1HB CYS 102 1HB CYS 102 -2.613 10.811 -10.608 840 2HB CYS 102 2HB CYS 102 -2.461 10.493 -12.332 841 H HIS 103 H HIS 103 -5.978 11.875 -13.386 842 HA HIS 103 HA HIS 103 -6.480 12.449 -15.520 843 1HB HIS 103 1HB HIS 103 -4.247 14.412 -14.992 844 2HB HIS 103 2HB HIS 103 -5.177 14.405 -16.488 845 HD2 HIS 103 HD2 HIS 103 -7.979 13.754 -14.414 846 HE1 HIS 103 HE1 HIS 103 -7.283 17.865 -13.622 847 HE2 HIS 103 HE2 HIS 103 -8.960 15.985 -13.546 848 H GLU 104 H GLU 104 -4.925 10.184 -15.228 849 HA GLU 104 HA GLU 104 -3.501 8.766 -16.288 850 1HB GLU 104 1HB GLU 104 -5.200 8.955 -17.997 851 2HB GLU 104 2HB GLU 104 -4.451 10.414 -18.635 852 1HG GLU 104 1HG GLU 104 -2.560 9.192 -19.413 853 2HG GLU 104 2HG GLU 104 -3.084 7.735 -18.574 854 H CYS 105 H CYS 105 -1.730 9.883 -15.104 855 HA CYS 105 HA CYS 105 -0.063 11.719 -16.555 856 1HB CYS 105 1HB CYS 105 -0.368 11.133 -13.905 857 2HB CYS 105 2HB CYS 105 1.121 10.269 -14.276 858 H ASN 106 H ASN 106 -0.526 9.341 -18.047 859 HA ASN 106 HA ASN 106 1.704 7.571 -17.826 860 1HB ASN 106 1HB ASN 106 -0.712 7.795 -19.438 861 2HB ASN 106 2HB ASN 106 0.678 7.291 -20.395 862 1HD2 ASN 106 1HD2 ASN 106 1.691 5.341 -19.931 863 2HD2 ASN 106 2HD2 ASN 106 0.931 4.121 -18.972 864 H ARG 107 H ARG 107 0.734 9.583 -20.578 865 HA ARG 107 HA ARG 107 3.398 9.701 -21.601 866 1HB ARG 107 1HB ARG 107 0.722 10.576 -22.438 867 2HB ARG 107 2HB ARG 107 2.021 11.633 -22.971 868 1HG ARG 107 1HG ARG 107 2.901 9.028 -23.494 869 2HG ARG 107 2HG ARG 107 1.209 9.080 -23.994 870 1HD ARG 107 1HD ARG 107 1.707 11.128 -25.296 871 2HD ARG 107 2HD ARG 107 3.408 10.952 -24.868 872 HE ARG 107 HE ARG 107 2.004 9.540 -26.899 873 1HH1 ARG 107 1HH1 ARG 107 4.568 9.208 -24.554 874 2HH1 ARG 107 2HH1 ARG 107 5.396 7.980 -25.449 875 1HH2 ARG 107 1HH2 ARG 107 3.094 7.928 -28.078 876 2HH2 ARG 107 2HH2 ARG 107 4.561 7.254 -27.450 877 HA PRO 108 HA PRO 108 4.957 13.128 -19.250 878 1HB PRO 108 1HB PRO 108 6.476 13.725 -21.735 879 2HB PRO 108 2HB PRO 108 7.062 13.490 -20.085 880 1HG PRO 108 1HG PRO 108 7.403 11.599 -21.924 881 2HG PRO 108 2HG PRO 108 6.994 11.176 -20.250 882 1HD PRO 108 1HD PRO 108 5.245 11.224 -22.675 883 2HD PRO 108 2HD PRO 108 5.271 10.073 -21.323 884 H ASP 109 H ASP 109 2.712 14.057 -19.582 885 HA ASP 109 HA ASP 109 2.670 16.236 -21.546 886 1HB ASP 109 1HB ASP 109 0.744 14.531 -21.253 887 2HB ASP 109 2HB ASP 109 0.355 15.444 -19.798 888 H THR 110 H THR 110 3.200 15.627 -18.252 889 HA THR 110 HA THR 110 2.997 18.497 -17.658 890 HB THR 110 HB THR 110 2.282 17.844 -15.340 891 HG1 THR 110 HG1 THR 110 1.708 15.335 -16.514 892 1HG2 THR 110 1HG2 THR 110 0.034 17.766 -15.812 893 2HG2 THR 110 2HG2 THR 110 0.261 16.739 -17.228 894 3HG2 THR 110 3HG2 THR 110 0.691 18.447 -17.300 895 H ARG 111 H ARG 111 4.185 18.903 -15.420 896 HA ARG 111 HA ARG 111 6.856 17.820 -15.778 897 1HB ARG 111 1HB ARG 111 5.854 20.320 -15.048 898 2HB ARG 111 2HB ARG 111 6.543 19.676 -13.565 899 1HG ARG 111 1HG ARG 111 8.339 20.774 -14.473 900 2HG ARG 111 2HG ARG 111 8.591 19.133 -15.071 901 1HD ARG 111 1HD ARG 111 6.945 20.933 -16.741 902 2HD ARG 111 2HD ARG 111 8.668 21.289 -16.651 903 HE ARG 111 HE ARG 111 8.881 18.800 -17.285 904 1HH1 ARG 111 1HH1 ARG 111 6.401 20.974 -18.449 905 2HH1 ARG 111 2HH1 ARG 111 6.152 20.094 -19.917 906 1HH2 ARG 111 1HH2 ARG 111 8.550 17.653 -19.220 907 2HH2 ARG 111 2HH2 ARG 111 7.369 18.214 -20.356 908 H ILE 112 H ILE 112 6.996 15.826 -14.909 909 HA ILE 112 HA ILE 112 5.952 15.369 -12.213 910 HB ILE 112 HB ILE 112 7.236 13.272 -13.946 911 1HG1 ILE 112 1HG1 ILE 112 4.589 12.838 -14.330 912 2HG1 ILE 112 2HG1 ILE 112 4.605 14.598 -14.261 913 1HG2 ILE 112 1HG2 ILE 112 5.049 13.031 -11.889 914 2HG2 ILE 112 2HG2 ILE 112 6.765 12.863 -11.514 915 3HG2 ILE 112 3HG2 ILE 112 5.990 11.733 -12.625 916 1HD1 ILE 112 1HD1 ILE 112 5.745 12.765 -16.283 917 2HD1 ILE 112 2HD1 ILE 112 6.607 14.268 -15.961 918 3HD1 ILE 112 3HD1 ILE 112 4.924 14.312 -16.484 919 H ILE 113 H ILE 113 7.235 15.310 -10.488 920 HA ILE 113 HA ILE 113 10.105 14.802 -10.821 921 HB ILE 113 HB ILE 113 9.067 17.048 -9.101 922 1HG1 ILE 113 1HG1 ILE 113 10.467 17.395 -11.747 923 2HG1 ILE 113 2HG1 ILE 113 8.712 17.374 -11.612 924 1HG2 ILE 113 1HG2 ILE 113 11.211 16.064 -8.439 925 2HG2 ILE 113 2HG2 ILE 113 11.391 17.729 -8.993 926 3HG2 ILE 113 3HG2 ILE 113 11.850 16.393 -10.050 927 1HD1 ILE 113 1HD1 ILE 113 10.568 19.506 -11.092 928 2HD1 ILE 113 2HD1 ILE 113 9.552 19.192 -9.685 929 3HD1 ILE 113 3HD1 ILE 113 8.812 19.552 -11.245 930 H ARG 114 H ARG 114 10.896 13.464 -9.295 931 HA ARG 114 HA ARG 114 9.442 13.211 -6.763 932 1HB ARG 114 1HB ARG 114 9.682 10.766 -6.813 933 2HB ARG 114 2HB ARG 114 8.694 11.352 -8.142 934 1HG ARG 114 1HG ARG 114 11.558 11.068 -8.733 935 2HG ARG 114 2HG ARG 114 10.689 9.567 -8.408 936 1HD ARG 114 1HD ARG 114 8.984 10.283 -10.089 937 2HD ARG 114 2HD ARG 114 10.029 11.646 -10.487 938 HE ARG 114 HE ARG 114 10.363 8.925 -11.301 939 1HH1 ARG 114 1HH1 ARG 114 12.046 11.902 -10.607 940 2HH1 ARG 114 2HH1 ARG 114 13.408 11.510 -11.602 941 1HH2 ARG 114 1HH2 ARG 114 12.152 8.406 -12.608 942 2HH2 ARG 114 2HH2 ARG 114 13.468 9.525 -12.738 943 H GLU 115 H GLU 115 10.656 12.812 -4.970 944 HA GLU 115 HA GLU 115 13.539 12.391 -5.318 945 1HB GLU 115 1HB GLU 115 13.227 14.808 -5.116 946 2HB GLU 115 2HB GLU 115 12.320 14.584 -3.626 947 1HG GLU 115 1HG GLU 115 14.202 14.013 -2.413 948 2HG GLU 115 2HG GLU 115 15.115 13.559 -3.851 949 H GLY 116 H GLY 116 14.582 11.397 -3.581 950 1HA GLY 116 1HA GLY 116 14.740 10.394 -1.470 951 2HA GLY 116 2HA GLY 116 13.035 10.721 -1.210 952 H ARG 117 H ARG 117 14.539 9.038 -3.944 953 HA ARG 117 HA ARG 117 14.188 6.954 -4.802 954 1HB ARG 117 1HB ARG 117 14.518 6.601 -1.914 955 2HB ARG 117 2HB ARG 117 13.616 5.293 -2.667 956 1HG ARG 117 1HG ARG 117 15.610 5.414 -4.404 957 2HG ARG 117 2HG ARG 117 16.450 6.092 -3.009 958 1HD ARG 117 1HD ARG 117 16.822 3.732 -3.016 959 2HD ARG 117 2HD ARG 117 15.716 4.099 -1.694 960 HE ARG 117 HE ARG 117 14.167 3.470 -3.911 961 1HH1 ARG 117 1HH1 ARG 117 16.489 1.878 -1.844 962 2HH1 ARG 117 2HH1 ARG 117 15.793 0.309 -2.064 963 1HH2 ARG 117 1HH2 ARG 117 13.255 1.409 -4.202 964 2HH2 ARG 117 2HH2 ARG 117 13.958 0.041 -3.405 965 H ILE 118 H ILE 118 12.163 7.971 -5.631 966 HA ILE 118 HA ILE 118 9.916 8.093 -5.954 967 HB ILE 118 HB ILE 118 10.705 5.735 -6.675 968 1HG1 ILE 118 1HG1 ILE 118 8.694 6.961 -7.488 969 2HG1 ILE 118 2HG1 ILE 118 8.508 5.211 -7.491 970 1HG2 ILE 118 1HG2 ILE 118 10.267 5.007 -4.132 971 2HG2 ILE 118 2HG2 ILE 118 10.191 3.898 -5.497 972 3HG2 ILE 118 3HG2 ILE 118 8.710 4.591 -4.840 973 1HD1 ILE 118 1HD1 ILE 118 7.264 7.228 -5.669 974 2HD1 ILE 118 2HD1 ILE 118 7.369 5.525 -5.224 975 3HD1 ILE 118 3HD1 ILE 118 6.486 6.005 -6.674 976 H SER 119 H SER 119 10.209 9.218 -3.641 977 HA SER 119 HA SER 119 8.199 7.987 -1.869 978 1HB SER 119 1HB SER 119 10.521 8.159 -0.915 979 2HB SER 119 2HB SER 119 10.365 9.913 -1.012 980 HG SER 119 HG SER 119 8.735 9.846 0.481 981 H LEU 120 H LEU 120 9.370 10.986 -3.318 982 HA LEU 120 HA LEU 120 6.785 12.244 -2.631 983 1HB LEU 120 1HB LEU 120 9.511 13.536 -2.834 984 2HB LEU 120 2HB LEU 120 8.010 14.430 -2.713 985 HG LEU 120 HG LEU 120 8.988 14.428 -0.558 986 1HD1 LEU 120 1HD1 LEU 120 7.103 13.987 0.524 987 2HD1 LEU 120 2HD1 LEU 120 7.173 12.271 0.122 988 3HD1 LEU 120 3HD1 LEU 120 6.475 13.417 -1.022 989 1HD2 LEU 120 1HD2 LEU 120 9.128 11.431 -0.574 990 2HD2 LEU 120 2HD2 LEU 120 9.839 12.553 0.583 991 3HD2 LEU 120 3HD2 LEU 120 10.481 12.453 -1.056 992 H LEU 121 H LEU 121 5.892 13.665 -4.203 993 HA LEU 121 HA LEU 121 7.150 14.066 -6.735 994 1HB LEU 121 1HB LEU 121 6.295 11.654 -6.778 995 2HB LEU 121 2HB LEU 121 4.686 12.348 -6.799 996 HG LEU 121 HG LEU 121 6.363 13.525 -8.853 997 1HD1 LEU 121 1HD1 LEU 121 7.312 11.775 -9.825 998 2HD1 LEU 121 2HD1 LEU 121 5.785 10.893 -9.833 999 3HD1 LEU 121 3HD1 LEU 121 6.852 10.795 -8.433 1000 1HD2 LEU 121 1HD2 LEU 121 3.648 12.600 -8.444 1001 2HD2 LEU 121 2HD2 LEU 121 4.268 12.139 -10.029 1002 3HD2 LEU 121 3HD2 LEU 121 4.268 13.833 -9.540 1003 H LYS 122 H LYS 122 6.138 15.659 -7.969 1004 HA LYS 122 HA LYS 122 3.674 16.800 -6.811 1005 1HB LYS 122 1HB LYS 122 5.542 18.247 -6.302 1006 2HB LYS 122 2HB LYS 122 6.030 18.267 -7.986 1007 1HG LYS 122 1HG LYS 122 3.405 19.145 -8.040 1008 2HG LYS 122 2HG LYS 122 4.086 19.897 -6.598 1009 1HD LYS 122 1HD LYS 122 4.416 21.358 -8.487 1010 2HD LYS 122 2HD LYS 122 5.978 20.715 -7.973 1011 1HE LYS 122 1HE LYS 122 4.622 19.078 -9.982 1012 2HE LYS 122 2HE LYS 122 5.020 20.702 -10.538 1013 1HZ LYS 122 1HZ LYS 122 6.956 18.816 -9.309 1014 2HZ LYS 122 2HZ LYS 122 7.311 20.335 -9.957 1015 3HZ LYS 122 3HZ LYS 122 6.791 19.084 -10.970 1016 H CYS 123 H CYS 123 2.092 17.559 -8.211 1017 HA CYS 123 HA CYS 123 2.580 17.308 -11.090 1018 1HB CYS 123 1HB CYS 123 0.669 15.709 -9.470 1019 2HB CYS 123 2HB CYS 123 0.095 16.289 -11.027 1020 H GLU 124 H GLU 124 2.475 19.679 -9.728 1021 HA GLU 124 HA GLU 124 0.074 20.957 -9.343 1022 1HB GLU 124 1HB GLU 124 2.789 21.846 -10.159 1023 2HB GLU 124 2HB GLU 124 1.475 22.997 -10.354 1024 1HG GLU 124 1HG GLU 124 1.650 21.609 -7.754 1025 2HG GLU 124 2HG GLU 124 2.913 22.782 -8.122 1026 H ALA 125 H ALA 125 1.565 20.066 -12.363 1027 HA ALA 125 HA ALA 125 0.082 21.792 -14.048 1028 1HB ALA 125 1HB ALA 125 0.674 19.918 -15.770 1029 2HB ALA 125 2HB ALA 125 1.689 19.318 -14.460 1030 3HB ALA 125 3HB ALA 125 1.941 20.943 -15.096 1031 H CYS 126 H CYS 126 -0.252 18.241 -13.975 1032 HA CYS 126 HA CYS 126 -3.014 18.460 -14.790 1033 1HB CYS 126 1HB CYS 126 -2.981 15.995 -14.781 1034 2HB CYS 126 2HB CYS 126 -1.644 16.668 -15.707 1035 H GLY 127 H GLY 127 -2.752 19.731 -12.380 1036 1HA GLY 127 1HA GLY 127 -4.570 19.538 -10.711 1037 2HA GLY 127 2HA GLY 127 -4.065 17.866 -10.505 1038 H ALA 128 H ALA 128 -3.056 17.584 -8.637 1039 HA ALA 128 HA ALA 128 -0.833 19.298 -7.945 1040 1HB ALA 128 1HB ALA 128 -2.976 20.318 -6.971 1041 2HB ALA 128 2HB ALA 128 -1.587 20.111 -5.905 1042 3HB ALA 128 3HB ALA 128 -2.931 18.970 -5.834 1043 H LYS 129 H LYS 129 0.541 18.425 -6.345 1044 HA LYS 129 HA LYS 129 -0.038 15.822 -5.233 1045 1HB LYS 129 1HB LYS 129 1.142 15.842 -7.707 1046 2HB LYS 129 2HB LYS 129 2.531 15.789 -6.642 1047 1HG LYS 129 1HG LYS 129 2.115 13.561 -6.995 1048 2HG LYS 129 2HG LYS 129 1.271 13.861 -5.475 1049 1HD LYS 129 1HD LYS 129 -0.406 12.794 -6.567 1050 2HD LYS 129 2HD LYS 129 -0.713 14.422 -7.174 1051 1HE LYS 129 1HE LYS 129 -0.548 13.544 -9.218 1052 2HE LYS 129 2HE LYS 129 1.185 13.437 -8.916 1053 1HZ LYS 129 1HZ LYS 129 -0.712 11.346 -9.209 1054 2HZ LYS 129 2HZ LYS 129 0.092 11.208 -7.727 1055 3HZ LYS 129 3HZ LYS 129 0.977 11.260 -9.167 1056 H ALA 130 H ALA 130 1.521 15.182 -3.626 1057 HA ALA 130 HA ALA 130 2.638 17.461 -2.269 1058 1HB ALA 130 1HB ALA 130 2.249 16.210 -0.482 1059 2HB ALA 130 2HB ALA 130 3.403 15.000 -1.044 1060 3HB ALA 130 3HB ALA 130 1.713 14.902 -1.536 1061 HA PRO 131 HA PRO 131 6.574 16.816 -4.435 1062 1HB PRO 131 1HB PRO 131 7.689 19.160 -3.632 1063 2HB PRO 131 2HB PRO 131 6.510 19.067 -4.939 1064 1HG PRO 131 1HG PRO 131 6.096 19.802 -2.067 1065 2HG PRO 131 2HG PRO 131 5.469 20.595 -3.524 1066 1HD PRO 131 1HD PRO 131 3.966 18.909 -2.052 1067 2HD PRO 131 2HD PRO 131 3.804 19.030 -3.814 1068 H LEU 132 H LEU 132 8.848 18.053 -3.134 1069 HA LEU 132 HA LEU 132 9.170 16.178 -0.910 1070 1HB LEU 132 1HB LEU 132 11.674 16.802 -1.283 1071 2HB LEU 132 2HB LEU 132 10.885 15.649 -2.336 1072 HG LEU 132 HG LEU 132 12.406 17.370 -3.424 1073 1HD1 LEU 132 1HD1 LEU 132 11.195 17.323 -5.394 1074 2HD1 LEU 132 2HD1 LEU 132 9.644 17.461 -4.570 1075 3HD1 LEU 132 3HD1 LEU 132 10.550 15.951 -4.497 1076 1HD2 LEU 132 1HD2 LEU 132 11.849 19.570 -3.580 1077 2HD2 LEU 132 2HD2 LEU 132 11.183 19.221 -1.988 1078 3HD2 LEU 132 3HD2 LEU 132 10.123 19.270 -3.394 1079 H LYS 133 H LYS 133 11.035 17.059 0.648 1080 HA LYS 133 HA LYS 133 10.009 19.629 1.620 1081 1HB LYS 133 1HB LYS 133 10.409 17.256 2.941 1082 2HB LYS 133 2HB LYS 133 11.853 18.163 3.366 1083 1HG LYS 133 1HG LYS 133 9.338 19.661 3.587 1084 2HG LYS 133 2HG LYS 133 9.506 18.301 4.697 1085 1HD LYS 133 1HD LYS 133 11.947 19.850 4.549 1086 2HD LYS 133 2HD LYS 133 10.571 20.860 4.998 1087 1HE LYS 133 1HE LYS 133 10.372 19.899 7.017 1088 2HE LYS 133 2HE LYS 133 10.661 18.280 6.379 1089 1HZ LYS 133 1HZ LYS 133 12.463 18.721 7.773 1090 2HZ LYS 133 2HZ LYS 133 12.652 20.304 7.208 1091 3HZ LYS 133 3HZ LYS 133 13.073 18.997 6.220 1092 H ASN 134 H ASN 134 11.366 21.324 2.189 1093 HA ASN 134 HA ASN 134 14.173 21.082 1.338 1094 1HB ASN 134 1HB ASN 134 13.985 23.435 0.468 1095 2HB ASN 134 2HB ASN 134 13.072 22.238 -0.446 1096 1HD2 ASN 134 1HD2 ASN 134 12.316 24.682 -0.890 1097 2HD2 ASN 134 2HD2 ASN 134 10.849 25.085 -0.070 1098 H VAL 135 H VAL 135 15.673 22.234 2.501 1099 HA VAL 135 HA VAL 135 14.832 23.064 5.148 1100 HB VAL 135 HB VAL 135 16.820 21.636 4.873 1101 1HG1 VAL 135 1HG1 VAL 135 17.796 23.968 3.269 1102 2HG1 VAL 135 2HG1 VAL 135 17.818 22.251 2.869 1103 3HG1 VAL 135 3HG1 VAL 135 18.931 22.890 4.078 1104 1HG2 VAL 135 1HG2 VAL 135 17.482 22.503 6.804 1105 2HG2 VAL 135 2HG2 VAL 135 16.607 23.990 6.441 1106 3HG2 VAL 135 3HG2 VAL 135 18.292 23.816 5.951 Start of MODEL 16 1 H MET 1 H MET 1 -0.237 -10.161 -11.985 2 HA MET 1 HA MET 1 -1.020 -12.482 -13.598 3 1HB MET 1 1HB MET 1 -0.529 -9.697 -14.056 4 2HB MET 1 2HB MET 1 0.712 -10.625 -14.886 5 1HG MET 1 1HG MET 1 -0.750 -11.536 -16.355 6 2HG MET 1 2HG MET 1 -2.080 -11.542 -15.199 7 1HE MET 1 1HE MET 1 0.335 -9.550 -17.092 8 2HE MET 1 2HE MET 1 -0.236 -7.891 -16.920 9 3HE MET 1 3HE MET 1 -0.727 -8.852 -18.315 10 H ASP 2 H ASP 2 0.305 -13.650 -11.846 11 HA ASP 2 HA ASP 2 2.940 -14.096 -12.934 12 1HB ASP 2 1HB ASP 2 2.582 -12.470 -10.576 13 2HB ASP 2 2HB ASP 2 3.470 -13.934 -10.170 14 H ASP 3 H ASP 3 2.641 -16.211 -13.302 15 HA ASP 3 HA ASP 3 1.127 -17.929 -11.618 16 1HB ASP 3 1HB ASP 3 1.793 -18.113 -14.171 17 2HB ASP 3 2HB ASP 3 3.160 -19.013 -13.525 18 H TYR 4 H TYR 4 4.547 -18.310 -12.489 19 HA TYR 4 HA TYR 4 5.539 -18.299 -9.872 20 1HB TYR 4 1HB TYR 4 4.160 -20.638 -10.357 21 2HB TYR 4 2HB TYR 4 5.837 -21.092 -10.657 22 HD1 TYR 4 HD1 TYR 4 6.680 -22.216 -8.811 23 HD2 TYR 4 HD2 TYR 4 4.229 -18.795 -8.181 24 HE1 TYR 4 HE1 TYR 4 7.074 -22.384 -6.388 25 HE2 TYR 4 HE2 TYR 4 4.615 -18.955 -5.760 26 HH TYR 4 HH TYR 4 6.928 -20.364 -4.355 27 H GLU 5 H GLU 5 5.889 -18.780 -13.228 28 HA GLU 5 HA GLU 5 8.574 -19.658 -13.335 29 1HB GLU 5 1HB GLU 5 6.530 -18.863 -15.184 30 2HB GLU 5 2HB GLU 5 8.033 -18.058 -15.608 31 1HG GLU 5 1HG GLU 5 7.747 -20.187 -16.778 32 2HG GLU 5 2HG GLU 5 9.178 -20.174 -15.748 33 H LYS 6 H LYS 6 7.340 -16.421 -14.197 34 HA LYS 6 HA LYS 6 9.952 -15.289 -13.626 35 1HB LYS 6 1HB LYS 6 8.054 -14.728 -15.523 36 2HB LYS 6 2HB LYS 6 7.791 -13.440 -14.356 37 1HG LYS 6 1HG LYS 6 9.540 -12.335 -15.135 38 2HG LYS 6 2HG LYS 6 10.593 -13.708 -14.798 39 1HD LYS 6 1HD LYS 6 10.800 -14.120 -16.974 40 2HD LYS 6 2HD LYS 6 9.050 -14.272 -17.139 41 1HE LYS 6 1HE LYS 6 9.781 -12.565 -18.640 42 2HE LYS 6 2HE LYS 6 8.927 -11.784 -17.310 43 1HZ LYS 6 1HZ LYS 6 10.718 -10.500 -17.143 44 2HZ LYS 6 2HZ LYS 6 11.651 -11.500 -18.138 45 3HZ LYS 6 3HZ LYS 6 11.523 -11.836 -16.485 46 H LEU 7 H LEU 7 10.459 -14.593 -11.679 47 HA LEU 7 HA LEU 7 8.965 -12.713 -10.244 48 1HB LEU 7 1HB LEU 7 8.664 -14.295 -8.184 49 2HB LEU 7 2HB LEU 7 7.430 -14.185 -9.421 50 HG LEU 7 HG LEU 7 8.681 -16.244 -10.452 51 1HD1 LEU 7 1HD1 LEU 7 9.244 -16.941 -7.629 52 2HD1 LEU 7 2HD1 LEU 7 10.409 -15.910 -8.457 53 3HD1 LEU 7 3HD1 LEU 7 10.019 -17.500 -9.110 54 1HD2 LEU 7 1HD2 LEU 7 6.722 -17.087 -9.902 55 2HD2 LEU 7 2HD2 LEU 7 6.509 -15.884 -8.637 56 3HD2 LEU 7 3HD2 LEU 7 7.322 -17.408 -8.279 57 H LEU 8 H LEU 8 10.155 -11.773 -8.650 58 HA LEU 8 HA LEU 8 12.840 -12.901 -8.251 59 1HB LEU 8 1HB LEU 8 11.808 -10.144 -8.562 60 2HB LEU 8 2HB LEU 8 13.110 -10.359 -7.405 61 HG LEU 8 HG LEU 8 14.446 -11.454 -9.223 62 1HD1 LEU 8 1HD1 LEU 8 13.719 -10.992 -11.549 63 2HD1 LEU 8 2HD1 LEU 8 12.153 -10.487 -10.918 64 3HD1 LEU 8 3HD1 LEU 8 12.694 -12.151 -10.703 65 1HD2 LEU 8 1HD2 LEU 8 14.918 -9.183 -8.656 66 2HD2 LEU 8 2HD2 LEU 8 13.534 -8.607 -9.585 67 3HD2 LEU 8 3HD2 LEU 8 14.922 -9.313 -10.415 68 H GLU 9 H GLU 9 11.641 -14.271 -6.638 69 HA GLU 9 HA GLU 9 11.591 -12.885 -4.042 70 1HB GLU 9 1HB GLU 9 9.552 -14.608 -5.300 71 2HB GLU 9 2HB GLU 9 9.902 -14.973 -3.616 72 1HG GLU 9 1HG GLU 9 8.637 -13.285 -2.966 73 2HG GLU 9 2HG GLU 9 9.640 -12.158 -3.877 74 H ARG 10 H ARG 10 13.633 -14.529 -5.548 75 HA ARG 10 HA ARG 10 13.994 -16.713 -3.610 76 1HB ARG 10 1HB ARG 10 14.022 -16.923 -6.286 77 2HB ARG 10 2HB ARG 10 15.712 -16.514 -6.033 78 1HG ARG 10 1HG ARG 10 15.751 -18.814 -6.010 79 2HG ARG 10 2HG ARG 10 15.658 -18.434 -4.295 80 1HD ARG 10 1HD ARG 10 13.871 -19.744 -4.173 81 2HD ARG 10 2HD ARG 10 13.011 -18.563 -5.159 82 HE ARG 10 HE ARG 10 14.539 -20.774 -6.365 83 1HH1 ARG 10 1HH1 ARG 10 11.570 -18.950 -6.040 84 2HH1 ARG 10 2HH1 ARG 10 10.789 -19.766 -7.349 85 1HH2 ARG 10 1HH2 ARG 10 13.499 -21.843 -8.078 86 2HH2 ARG 10 2HH2 ARG 10 11.878 -21.404 -8.502 87 H ALA 11 H ALA 11 14.508 -14.368 -2.527 88 HA ALA 11 HA ALA 11 17.138 -14.469 -1.620 89 1HB ALA 11 1HB ALA 11 16.769 -12.153 -3.496 90 2HB ALA 11 2HB ALA 11 17.584 -13.645 -3.961 91 3HB ALA 11 3HB ALA 11 18.235 -12.654 -2.657 92 H ILE 12 H ILE 12 14.337 -13.997 -0.799 93 HA ILE 12 HA ILE 12 14.679 -11.396 0.523 94 HB ILE 12 HB ILE 12 12.151 -11.646 0.981 95 1HG1 ILE 12 1HG1 ILE 12 11.116 -12.810 -1.135 96 2HG1 ILE 12 2HG1 ILE 12 12.603 -13.748 -1.117 97 1HG2 ILE 12 1HG2 ILE 12 13.660 -10.443 -1.040 98 2HG2 ILE 12 2HG2 ILE 12 12.037 -10.007 -0.510 99 3HG2 ILE 12 3HG2 ILE 12 12.254 -11.136 -1.846 100 1HD1 ILE 12 1HD1 ILE 12 11.301 -15.106 0.136 101 2HD1 ILE 12 2HD1 ILE 12 10.305 -13.781 0.738 102 3HD1 ILE 12 3HD1 ILE 12 11.903 -14.066 1.425 103 H ASP 13 H ASP 13 15.974 -13.737 1.489 104 HA ASP 13 HA ASP 13 15.345 -13.586 4.204 105 1HB ASP 13 1HB ASP 13 13.693 -15.441 2.731 106 2HB ASP 13 2HB ASP 13 14.657 -16.301 3.927 107 H GLN 14 H GLN 14 16.033 -16.682 2.626 108 HA GLN 14 HA GLN 14 18.662 -16.669 3.901 109 1HB GLN 14 1HB GLN 14 16.897 -18.825 2.788 110 2HB GLN 14 2HB GLN 14 18.607 -19.126 3.062 111 1HG GLN 14 1HG GLN 14 18.403 -19.063 5.328 112 2HG GLN 14 2HG GLN 14 17.034 -17.954 5.286 113 1HE2 GLN 14 1HE2 GLN 14 16.705 -19.872 6.992 114 2HE2 GLN 14 2HE2 GLN 14 15.660 -21.120 6.413 115 H LEU 15 H LEU 15 17.165 -16.983 0.725 116 HA LEU 15 HA LEU 15 19.367 -17.649 -0.822 117 1HB LEU 15 1HB LEU 15 16.798 -16.266 -1.271 118 2HB LEU 15 2HB LEU 15 18.032 -15.980 -2.479 119 HG LEU 15 HG LEU 15 16.477 -17.761 -3.113 120 1HD1 LEU 15 1HD1 LEU 15 18.205 -19.566 -3.535 121 2HD1 LEU 15 2HD1 LEU 15 19.337 -18.526 -2.679 122 3HD1 LEU 15 3HD1 LEU 15 18.558 -17.953 -4.154 123 1HD2 LEU 15 1HD2 LEU 15 15.757 -18.806 -1.189 124 2HD2 LEU 15 2HD2 LEU 15 17.392 -18.988 -0.551 125 3HD2 LEU 15 3HD2 LEU 15 16.849 -20.000 -1.889 126 HA PRO 16 HA PRO 16 22.269 -14.299 -0.749 127 1HB PRO 16 1HB PRO 16 22.606 -13.901 -3.501 128 2HB PRO 16 2HB PRO 16 23.525 -15.016 -2.488 129 1HG PRO 16 1HG PRO 16 21.187 -15.551 -4.258 130 2HG PRO 16 2HG PRO 16 22.605 -16.565 -3.929 131 1HD PRO 16 1HD PRO 16 20.234 -17.093 -2.827 132 2HD PRO 16 2HD PRO 16 21.734 -17.335 -1.912 133 HA PRO 17 HA PRO 17 19.190 -10.978 -1.159 134 1HB PRO 17 1HB PRO 17 20.722 -9.131 0.196 135 2HB PRO 17 2HB PRO 17 19.630 -10.285 0.966 136 1HG PRO 17 1HG PRO 17 22.593 -10.462 0.571 137 2HG PRO 17 2HG PRO 17 21.626 -10.874 2.001 138 1HD PRO 17 1HD PRO 17 22.528 -12.771 0.348 139 2HD PRO 17 2HD PRO 17 20.921 -12.894 1.095 140 H GLU 18 H GLU 18 22.228 -9.206 -1.004 141 HA GLU 18 HA GLU 18 23.336 -7.917 -2.511 142 1HB GLU 18 1HB GLU 18 23.138 -10.227 -3.790 143 2HB GLU 18 2HB GLU 18 22.078 -9.297 -4.839 144 1HG GLU 18 1HG GLU 18 24.770 -8.219 -4.156 145 2HG GLU 18 2HG GLU 18 24.620 -9.496 -5.362 146 H VAL 19 H VAL 19 20.347 -8.631 -4.332 147 HA VAL 19 HA VAL 19 19.970 -5.776 -4.766 148 HB VAL 19 HB VAL 19 18.184 -7.961 -5.819 149 1HG1 VAL 19 1HG1 VAL 19 17.197 -5.883 -6.202 150 2HG1 VAL 19 2HG1 VAL 19 18.038 -6.229 -7.713 151 3HG1 VAL 19 3HG1 VAL 19 18.743 -5.107 -6.550 152 1HG2 VAL 19 1HG2 VAL 19 20.773 -6.959 -7.000 153 2HG2 VAL 19 2HG2 VAL 19 19.584 -7.928 -7.870 154 3HG2 VAL 19 3HG2 VAL 19 20.412 -8.601 -6.466 155 H PHE 20 H PHE 20 18.942 -4.693 -3.218 156 HA PHE 20 HA PHE 20 17.155 -5.912 -1.365 157 1HB PHE 20 1HB PHE 20 17.921 -3.058 -1.945 158 2HB PHE 20 2HB PHE 20 16.678 -3.454 -0.763 159 HD1 PHE 20 HD1 PHE 20 17.739 -5.808 0.558 160 HD2 PHE 20 HD2 PHE 20 19.749 -2.300 -0.767 161 HE1 PHE 20 HE1 PHE 20 19.474 -6.163 2.265 162 HE2 PHE 20 HE2 PHE 20 21.488 -2.647 0.938 163 HZ PHE 20 HZ PHE 20 21.352 -4.581 2.456 164 H GLU 21 H GLU 21 15.290 -6.718 -2.124 165 HA GLU 21 HA GLU 21 13.488 -4.858 -3.509 166 1HB GLU 21 1HB GLU 21 12.651 -6.830 -4.847 167 2HB GLU 21 2HB GLU 21 14.259 -6.257 -5.271 168 1HG GLU 21 1HG GLU 21 14.677 -8.478 -5.221 169 2HG GLU 21 2HG GLU 21 14.979 -8.109 -3.524 170 H THR 22 H THR 22 11.606 -4.664 -2.497 171 HA THR 22 HA THR 22 10.973 -6.287 -0.233 172 HB THR 22 HB THR 22 10.418 -3.868 -0.399 173 HG1 THR 22 HG1 THR 22 8.503 -4.082 0.655 174 1HG2 THR 22 1HG2 THR 22 9.677 -3.601 -2.636 175 2HG2 THR 22 2HG2 THR 22 8.309 -3.260 -1.578 176 3HG2 THR 22 3HG2 THR 22 8.407 -4.804 -2.423 177 H LYS 23 H LYS 23 8.464 -6.947 -0.126 178 HA LYS 23 HA LYS 23 8.217 -9.167 -1.877 179 1HB LYS 23 1HB LYS 23 6.245 -7.933 0.037 180 2HB LYS 23 2HB LYS 23 5.979 -9.450 -0.802 181 1HG LYS 23 1HG LYS 23 8.473 -9.189 0.771 182 2HG LYS 23 2HG LYS 23 6.954 -9.329 1.660 183 1HD LYS 23 1HD LYS 23 6.450 -11.413 0.646 184 2HD LYS 23 2HD LYS 23 7.740 -11.224 -0.542 185 1HE LYS 23 1HE LYS 23 8.075 -11.610 2.429 186 2HE LYS 23 2HE LYS 23 8.402 -12.805 1.173 187 1HZ LYS 23 1HZ LYS 23 10.051 -11.142 0.276 188 2HZ LYS 23 2HZ LYS 23 10.464 -11.884 1.739 189 3HZ LYS 23 3HZ LYS 23 9.874 -10.299 1.734 190 H ARG 24 H ARG 24 6.828 -9.547 -3.566 191 HA ARG 24 HA ARG 24 5.832 -7.162 -4.917 192 1HB ARG 24 1HB ARG 24 7.174 -9.367 -5.835 193 2HB ARG 24 2HB ARG 24 5.515 -9.748 -6.272 194 1HG ARG 24 1HG ARG 24 6.310 -8.645 -8.140 195 2HG ARG 24 2HG ARG 24 5.465 -7.369 -7.261 196 1HD ARG 24 1HD ARG 24 7.454 -6.399 -6.519 197 2HD ARG 24 2HD ARG 24 8.395 -7.848 -6.862 198 HE ARG 24 HE ARG 24 7.345 -5.987 -8.890 199 1HH1 ARG 24 1HH1 ARG 24 9.642 -8.438 -7.904 200 2HH1 ARG 24 2HH1 ARG 24 10.588 -8.295 -9.344 201 1HH2 ARG 24 1HH2 ARG 24 8.589 -5.819 -10.780 202 2HH2 ARG 24 2HH2 ARG 24 9.993 -6.813 -10.974 203 H PHE 25 H PHE 25 4.274 -7.631 -2.763 204 HA PHE 25 HA PHE 25 2.005 -9.268 -3.521 205 1HB PHE 25 1HB PHE 25 3.081 -8.536 -1.104 206 2HB PHE 25 2HB PHE 25 1.669 -7.493 -1.211 207 HD1 PHE 25 HD1 PHE 25 -0.317 -9.154 -2.515 208 HD2 PHE 25 HD2 PHE 25 2.612 -10.209 0.381 209 HE1 PHE 25 HE1 PHE 25 -1.739 -11.012 -1.755 210 HE2 PHE 25 HE2 PHE 25 1.200 -12.065 1.150 211 HZ PHE 25 HZ PHE 25 -0.982 -12.471 0.081 212 H GLU 26 H GLU 26 0.700 -8.479 -5.034 213 HA GLU 26 HA GLU 26 -0.376 -5.775 -4.670 214 1HB GLU 26 1HB GLU 26 1.457 -6.264 -6.610 215 2HB GLU 26 2HB GLU 26 -0.027 -6.637 -7.475 216 1HG GLU 26 1HG GLU 26 -0.550 -4.490 -7.689 217 2HG GLU 26 2HG GLU 26 -0.252 -4.169 -5.983 218 H VAL 27 H VAL 27 -2.536 -5.558 -5.149 219 HA VAL 27 HA VAL 27 -3.994 -7.639 -6.519 220 HB VAL 27 HB VAL 27 -4.492 -7.128 -3.577 221 1HG1 VAL 27 1HG1 VAL 27 -6.017 -8.894 -5.486 222 2HG1 VAL 27 2HG1 VAL 27 -6.591 -7.370 -4.810 223 3HG1 VAL 27 3HG1 VAL 27 -6.299 -8.750 -3.752 224 1HG2 VAL 27 1HG2 VAL 27 -4.041 -9.564 -3.370 225 2HG2 VAL 27 2HG2 VAL 27 -2.639 -8.623 -3.876 226 3HG2 VAL 27 3HG2 VAL 27 -3.540 -9.573 -5.060 227 HA PRO 28 HA PRO 28 -6.397 -4.129 -7.752 228 1HB PRO 28 1HB PRO 28 -8.702 -6.012 -7.714 229 2HB PRO 28 2HB PRO 28 -8.124 -4.961 -9.010 230 1HG PRO 28 1HG PRO 28 -7.686 -7.589 -9.086 231 2HG PRO 28 2HG PRO 28 -6.458 -6.439 -9.648 232 1HD PRO 28 1HD PRO 28 -6.571 -8.004 -7.109 233 2HD PRO 28 2HD PRO 28 -5.168 -7.569 -8.105 234 H LYS 29 H LYS 29 -8.680 -6.135 -5.874 235 HA LYS 29 HA LYS 29 -9.669 -3.818 -4.509 236 1HB LYS 29 1HB LYS 29 -10.288 -6.752 -4.401 237 2HB LYS 29 2HB LYS 29 -10.929 -5.667 -3.175 238 1HG LYS 29 1HG LYS 29 -12.604 -5.169 -4.529 239 2HG LYS 29 2HG LYS 29 -11.452 -4.458 -5.661 240 1HD LYS 29 1HD LYS 29 -12.662 -6.070 -6.895 241 2HD LYS 29 2HD LYS 29 -11.093 -6.804 -6.555 242 1HE LYS 29 1HE LYS 29 -12.354 -8.554 -5.895 243 2HE LYS 29 2HE LYS 29 -12.479 -7.631 -4.399 244 1HZ LYS 29 1HZ LYS 29 -14.663 -8.113 -4.859 245 2HZ LYS 29 2HZ LYS 29 -14.472 -7.980 -6.534 246 3HZ LYS 29 3HZ LYS 29 -14.518 -6.588 -5.575 247 H ALA 30 H ALA 30 -8.163 -2.911 -3.200 248 HA ALA 30 HA ALA 30 -7.321 -4.519 -0.892 249 1HB ALA 30 1HB ALA 30 -5.134 -4.226 -1.232 250 2HB ALA 30 2HB ALA 30 -5.340 -2.532 -1.676 251 3HB ALA 30 3HB ALA 30 -5.575 -3.795 -2.884 252 H TYR 31 H TYR 31 -7.874 -3.602 0.951 253 HA TYR 31 HA TYR 31 -7.481 -0.933 1.653 254 1HB TYR 31 1HB TYR 31 -9.639 0.056 1.575 255 2HB TYR 31 2HB TYR 31 -9.373 -0.635 -0.020 256 HD1 TYR 31 HD1 TYR 31 -11.969 0.067 1.761 257 HD2 TYR 31 HD2 TYR 31 -9.997 -3.504 0.552 258 HE1 TYR 31 HE1 TYR 31 -14.087 -1.165 1.957 259 HE2 TYR 31 HE2 TYR 31 -12.107 -4.742 0.744 260 HH TYR 31 HH TYR 31 -14.473 -4.357 0.753 261 H SER 32 H SER 32 -7.737 -0.653 3.827 262 HA SER 32 HA SER 32 -8.095 -2.981 5.406 263 1HB SER 32 1HB SER 32 -6.596 -1.362 6.227 264 2HB SER 32 2HB SER 32 -7.764 -0.059 6.041 265 HG SER 32 HG SER 32 -8.380 -0.456 7.982 266 H VAL 33 H VAL 33 -9.594 -2.906 7.392 267 HA VAL 33 HA VAL 33 -12.236 -1.878 6.599 268 HB VAL 33 HB VAL 33 -12.899 -4.054 8.114 269 1HG1 VAL 33 1HG1 VAL 33 -12.717 -3.592 5.168 270 2HG1 VAL 33 2HG1 VAL 33 -14.138 -3.623 6.213 271 3HG1 VAL 33 3HG1 VAL 33 -13.314 -5.127 5.797 272 1HG2 VAL 33 1HG2 VAL 33 -10.406 -4.722 6.576 273 2HG2 VAL 33 2HG2 VAL 33 -11.632 -5.940 6.923 274 3HG2 VAL 33 3HG2 VAL 33 -10.817 -5.110 8.243 275 H ILE 34 H ILE 34 -13.626 -1.249 8.234 276 HA ILE 34 HA ILE 34 -12.300 -0.693 10.800 277 HB ILE 34 HB ILE 34 -14.755 0.787 10.127 278 1HG1 ILE 34 1HG1 ILE 34 -13.751 0.657 7.910 279 2HG1 ILE 34 2HG1 ILE 34 -13.589 2.285 8.548 280 1HG2 ILE 34 1HG2 ILE 34 -13.417 1.284 12.102 281 2HG2 ILE 34 2HG2 ILE 34 -13.451 2.658 11.001 282 3HG2 ILE 34 3HG2 ILE 34 -12.022 1.630 11.081 283 1HD1 ILE 34 1HD1 ILE 34 -11.261 1.153 9.366 284 2HD1 ILE 34 2HD1 ILE 34 -11.464 2.089 7.886 285 3HD1 ILE 34 3HD1 ILE 34 -11.541 0.330 7.834 286 H GLN 35 H GLN 35 -13.766 -0.483 12.681 287 HA GLN 35 HA GLN 35 -16.333 -1.581 12.770 288 1HB GLN 35 1HB GLN 35 -14.118 -3.502 12.851 289 2HB GLN 35 2HB GLN 35 -15.251 -3.667 14.185 290 1HG GLN 35 1HG GLN 35 -16.917 -4.407 12.861 291 2HG GLN 35 2HG GLN 35 -16.438 -3.395 11.501 292 1HE2 GLN 35 1HE2 GLN 35 -14.386 -4.062 10.409 293 2HE2 GLN 35 2HE2 GLN 35 -14.112 -5.756 10.204 294 H GLY 36 H GLY 36 -17.128 -0.513 14.457 295 1HA GLY 36 1HA GLY 36 -17.377 0.284 16.600 296 2HA GLY 36 2HA GLY 36 -16.079 -0.797 17.082 297 H ASN 37 H ASN 37 -13.849 -0.049 16.392 298 HA ASN 37 HA ASN 37 -13.350 2.696 15.909 299 1HB ASN 37 1HB ASN 37 -12.597 3.438 18.061 300 2HB ASN 37 2HB ASN 37 -14.215 2.778 18.278 301 1HD2 ASN 37 1HD2 ASN 37 -14.496 0.907 19.451 302 2HD2 ASN 37 2HD2 ASN 37 -13.243 0.207 20.411 303 H ARG 38 H ARG 38 -12.473 -0.035 15.152 304 HA ARG 38 HA ARG 38 -9.597 0.427 15.439 305 1HB ARG 38 1HB ARG 38 -10.686 -2.362 15.667 306 2HB ARG 38 2HB ARG 38 -9.111 -1.753 16.136 307 1HG ARG 38 1HG ARG 38 -9.900 -1.765 18.208 308 2HG ARG 38 2HG ARG 38 -10.785 -0.313 17.746 309 1HD ARG 38 1HD ARG 38 -12.738 -1.356 17.917 310 2HD ARG 38 2HD ARG 38 -12.186 -2.690 16.907 311 HE ARG 38 HE ARG 38 -12.556 -2.791 19.661 312 1HH1 ARG 38 1HH1 ARG 38 -10.105 -3.676 17.326 313 2HH1 ARG 38 2HH1 ARG 38 -9.456 -4.942 18.311 314 1HH2 ARG 38 1HH2 ARG 38 -11.711 -4.472 20.934 315 2HH2 ARG 38 2HH2 ARG 38 -10.370 -5.399 20.348 316 H THR 39 H THR 39 -8.303 -0.684 13.832 317 HA THR 39 HA THR 39 -9.804 -1.080 11.342 318 HB THR 39 HB THR 39 -7.560 0.515 11.989 319 HG1 THR 39 HG1 THR 39 -8.482 -0.055 9.393 320 1HG2 THR 39 1HG2 THR 39 -6.269 -0.272 9.806 321 2HG2 THR 39 2HG2 THR 39 -6.775 -1.849 10.402 322 3HG2 THR 39 3HG2 THR 39 -5.815 -0.787 11.425 323 H PHE 40 H PHE 40 -9.933 -3.034 10.492 324 HA PHE 40 HA PHE 40 -8.280 -5.175 11.585 325 1HB PHE 40 1HB PHE 40 -10.786 -5.130 9.909 326 2HB PHE 40 2HB PHE 40 -9.897 -6.617 10.209 327 HD1 PHE 40 HD1 PHE 40 -10.685 -3.769 12.486 328 HD2 PHE 40 HD2 PHE 40 -11.250 -7.895 11.593 329 HE1 PHE 40 HE1 PHE 40 -11.908 -4.055 14.598 330 HE2 PHE 40 HE2 PHE 40 -12.474 -8.185 13.709 331 HZ PHE 40 HZ PHE 40 -12.804 -6.263 15.213 332 H ILE 41 H ILE 41 -6.309 -4.379 10.434 333 HA ILE 41 HA ILE 41 -6.152 -4.274 7.621 334 HB ILE 41 HB ILE 41 -4.252 -4.094 9.799 335 1HG1 ILE 41 1HG1 ILE 41 -2.987 -2.757 8.145 336 2HG1 ILE 41 2HG1 ILE 41 -4.093 -3.295 6.885 337 1HG2 ILE 41 1HG2 ILE 41 -3.467 -6.294 8.961 338 2HG2 ILE 41 2HG2 ILE 41 -2.276 -5.013 8.761 339 3HG2 ILE 41 3HG2 ILE 41 -3.218 -5.567 7.377 340 1HD1 ILE 41 1HD1 ILE 41 -5.625 -2.204 8.992 341 2HD1 ILE 41 2HD1 ILE 41 -5.424 -1.609 7.351 342 3HD1 ILE 41 3HD1 ILE 41 -4.323 -1.079 8.619 343 H GLN 42 H GLN 42 -6.066 -5.831 6.117 344 HA GLN 42 HA GLN 42 -5.550 -8.598 7.001 345 1HB GLN 42 1HB GLN 42 -7.112 -9.351 5.244 346 2HB GLN 42 2HB GLN 42 -7.905 -8.340 6.445 347 1HG GLN 42 1HG GLN 42 -7.210 -6.477 4.628 348 2HG GLN 42 2HG GLN 42 -7.450 -7.875 3.582 349 1HE2 GLN 42 1HE2 GLN 42 -9.506 -9.004 3.775 350 2HE2 GLN 42 2HE2 GLN 42 -10.925 -8.099 4.164 351 H ASN 43 H ASN 43 -5.351 -6.269 4.365 352 HA ASN 43 HA ASN 43 -3.391 -7.960 2.997 353 1HB ASN 43 1HB ASN 43 -5.161 -5.699 2.154 354 2HB ASN 43 2HB ASN 43 -3.679 -6.002 1.252 355 1HD2 ASN 43 1HD2 ASN 43 -5.764 -6.225 -0.225 356 2HD2 ASN 43 2HD2 ASN 43 -6.240 -7.863 -0.500 357 H PHE 44 H PHE 44 -2.482 -6.901 5.358 358 HA PHE 44 HA PHE 44 -1.335 -4.429 5.455 359 1HB PHE 44 1HB PHE 44 0.589 -5.634 6.708 360 2HB PHE 44 2HB PHE 44 -1.038 -5.725 7.374 361 HD1 PHE 44 HD1 PHE 44 -1.876 -7.778 7.973 362 HD2 PHE 44 HD2 PHE 44 1.238 -7.582 5.082 363 HE1 PHE 44 HE1 PHE 44 -1.760 -10.236 7.939 364 HE2 PHE 44 HE2 PHE 44 1.363 -10.039 5.042 365 HZ PHE 44 HZ PHE 44 -0.139 -11.369 6.471 366 H ARG 45 H ARG 45 -0.403 -7.073 3.395 367 HA ARG 45 HA ARG 45 2.159 -5.920 2.766 368 1HB ARG 45 1HB ARG 45 0.991 -8.447 2.494 369 2HB ARG 45 2HB ARG 45 1.241 -7.874 0.849 370 1HG ARG 45 1HG ARG 45 3.324 -8.071 3.008 371 2HG ARG 45 2HG ARG 45 3.168 -9.117 1.598 372 1HD ARG 45 1HD ARG 45 3.904 -7.490 0.142 373 2HD ARG 45 2HD ARG 45 3.423 -6.175 1.209 374 HE ARG 45 HE ARG 45 5.621 -7.894 2.054 375 1HH1 ARG 45 1HH1 ARG 45 4.551 -4.799 0.827 376 2HH1 ARG 45 2HH1 ARG 45 6.061 -4.018 1.150 377 1HH2 ARG 45 1HH2 ARG 45 7.601 -6.874 2.445 378 2HH2 ARG 45 2HH2 ARG 45 7.792 -5.194 2.069 379 H GLU 46 H GLU 46 -0.853 -6.477 0.970 380 HA GLU 46 HA GLU 46 -0.022 -4.934 -1.274 381 1HB GLU 46 1HB GLU 46 -1.983 -6.767 -0.846 382 2HB GLU 46 2HB GLU 46 -2.911 -5.273 -0.844 383 1HG GLU 46 1HG GLU 46 -1.138 -6.320 -3.028 384 2HG GLU 46 2HG GLU 46 -2.891 -6.146 -3.059 385 H VAL 47 H VAL 47 -2.075 -4.320 1.529 386 HA VAL 47 HA VAL 47 -2.891 -1.727 0.756 387 HB VAL 47 HB VAL 47 -2.624 -2.624 3.621 388 1HG1 VAL 47 1HG1 VAL 47 -4.929 -1.069 2.625 389 2HG1 VAL 47 2HG1 VAL 47 -3.373 -0.242 2.643 390 3HG1 VAL 47 3HG1 VAL 47 -4.027 -0.921 4.133 391 1HG2 VAL 47 1HG2 VAL 47 -5.246 -3.061 2.487 392 2HG2 VAL 47 2HG2 VAL 47 -4.221 -4.163 3.408 393 3HG2 VAL 47 3HG2 VAL 47 -4.023 -4.026 1.662 394 H ALA 48 H ALA 48 -0.165 -2.933 2.697 395 HA ALA 48 HA ALA 48 0.715 -0.376 3.469 396 1HB ALA 48 1HB ALA 48 2.451 -2.812 3.234 397 2HB ALA 48 2HB ALA 48 1.391 -2.470 4.603 398 3HB ALA 48 3HB ALA 48 2.726 -1.384 4.232 399 H ASP 49 H ASP 49 1.254 -2.267 0.589 400 HA ASP 49 HA ASP 49 3.517 -0.769 -0.303 401 1HB ASP 49 1HB ASP 49 2.529 -3.078 -1.150 402 2HB ASP 49 2HB ASP 49 1.680 -2.034 -2.286 403 H ALA 50 H ALA 50 0.235 -0.805 -1.692 404 HA ALA 50 HA ALA 50 0.469 1.489 -3.180 405 1HB ALA 50 1HB ALA 50 -2.126 1.588 -2.717 406 2HB ALA 50 2HB ALA 50 -1.814 -0.021 -2.063 407 3HB ALA 50 3HB ALA 50 -1.398 0.349 -3.736 408 H LEU 51 H LEU 51 -0.533 1.270 0.220 409 HA LEU 51 HA LEU 51 -1.183 4.031 0.409 410 1HB LEU 51 1HB LEU 51 -2.273 2.827 2.035 411 2HB LEU 51 2HB LEU 51 -0.905 1.773 2.328 412 HG LEU 51 HG LEU 51 0.214 3.488 3.599 413 1HD1 LEU 51 1HD1 LEU 51 -0.430 5.665 3.777 414 2HD1 LEU 51 2HD1 LEU 51 -2.127 5.306 3.463 415 3HD1 LEU 51 3HD1 LEU 51 -0.967 5.301 2.141 416 1HD2 LEU 51 1HD2 LEU 51 -2.112 2.179 4.386 417 2HD2 LEU 51 2HD2 LEU 51 -2.327 3.840 4.934 418 3HD2 LEU 51 3HD2 LEU 51 -0.916 2.922 5.444 419 H ASN 52 H ASN 52 1.713 2.149 0.735 420 HA ASN 52 HA ASN 52 3.403 4.366 0.495 421 1HB ASN 52 1HB ASN 52 2.604 3.677 3.226 422 2HB ASN 52 2HB ASN 52 4.339 3.735 2.999 423 1HD2 ASN 52 1HD2 ASN 52 2.487 5.455 4.495 424 2HD2 ASN 52 2HD2 ASN 52 2.763 7.056 3.908 425 H ARG 53 H ARG 53 4.570 3.157 -0.929 426 HA ARG 53 HA ARG 53 5.280 0.635 -1.173 427 1HB ARG 53 1HB ARG 53 6.235 2.706 -2.375 428 2HB ARG 53 2HB ARG 53 7.517 2.647 -1.175 429 1HG ARG 53 1HG ARG 53 7.133 0.047 -2.312 430 2HG ARG 53 2HG ARG 53 7.343 1.238 -3.591 431 1HD ARG 53 1HD ARG 53 9.209 0.506 -1.365 432 2HD ARG 53 2HD ARG 53 9.516 0.521 -3.098 433 HE ARG 53 HE ARG 53 10.035 2.612 -1.335 434 1HH1 ARG 53 1HH1 ARG 53 8.523 2.162 -4.460 435 2HH1 ARG 53 2HH1 ARG 53 8.862 3.775 -4.984 436 1HH2 ARG 53 1HH2 ARG 53 10.516 4.709 -2.062 437 2HH2 ARG 53 2HH2 ARG 53 10.000 5.208 -3.638 438 H ASP 54 H ASP 54 7.568 2.622 0.675 439 HA ASP 54 HA ASP 54 8.615 0.349 2.061 440 1HB ASP 54 1HB ASP 54 9.364 3.083 1.618 441 2HB ASP 54 2HB ASP 54 9.412 2.754 3.347 442 HA PRO 55 HA PRO 55 5.796 0.423 5.482 443 1HB PRO 55 1HB PRO 55 7.240 -0.950 7.306 444 2HB PRO 55 2HB PRO 55 6.518 -1.728 5.892 445 1HG PRO 55 1HG PRO 55 9.340 -0.823 6.323 446 2HG PRO 55 2HG PRO 55 8.746 -2.329 5.598 447 1HD PRO 55 1HD PRO 55 9.609 -0.211 4.125 448 2HD PRO 55 2HD PRO 55 8.362 -1.340 3.557 449 H GLN 56 H GLN 56 8.716 2.122 5.449 450 HA GLN 56 HA GLN 56 8.959 2.924 8.138 451 1HB GLN 56 1HB GLN 56 10.071 3.716 5.550 452 2HB GLN 56 2HB GLN 56 9.918 5.058 6.676 453 1HG GLN 56 1HG GLN 56 12.116 3.914 6.735 454 2HG GLN 56 2HG GLN 56 11.282 3.963 8.288 455 1HE2 GLN 56 1HE2 GLN 56 11.590 2.168 9.372 456 2HE2 GLN 56 2HE2 GLN 56 11.626 0.569 8.718 457 H HIS 57 H HIS 57 7.266 4.393 5.401 458 HA HIS 57 HA HIS 57 6.330 6.600 6.963 459 1HB HIS 57 1HB HIS 57 4.746 6.306 4.616 460 2HB HIS 57 2HB HIS 57 5.971 7.506 4.966 461 HD2 HIS 57 HD2 HIS 57 8.686 6.482 4.227 462 HE1 HIS 57 HE1 HIS 57 7.005 4.234 1.049 463 HE2 HIS 57 HE2 HIS 57 9.135 5.042 2.126 464 H LEU 58 H LEU 58 4.610 3.874 5.399 465 HA LEU 58 HA LEU 58 2.081 4.219 6.344 466 1HB LEU 58 1HB LEU 58 3.515 2.117 5.216 467 2HB LEU 58 2HB LEU 58 2.901 1.457 6.718 468 HG LEU 58 HG LEU 58 0.830 2.896 5.311 469 1HD1 LEU 58 1HD1 LEU 58 1.885 2.356 3.273 470 2HD1 LEU 58 2HD1 LEU 58 0.623 1.161 3.495 471 3HD1 LEU 58 3HD1 LEU 58 2.306 0.745 3.834 472 1HD2 LEU 58 1HD2 LEU 58 1.139 0.005 6.112 473 2HD2 LEU 58 2HD2 LEU 58 -0.364 0.782 5.610 474 3HD2 LEU 58 3HD2 LEU 58 0.436 1.284 7.101 475 H LEU 59 H LEU 59 4.763 2.732 8.083 476 HA LEU 59 HA LEU 59 3.346 2.037 10.408 477 1HB LEU 59 1HB LEU 59 5.749 1.427 9.535 478 2HB LEU 59 2HB LEU 59 6.228 2.802 10.509 479 HG LEU 59 HG LEU 59 4.591 1.263 12.177 480 1HD1 LEU 59 1HD1 LEU 59 5.905 -0.400 10.190 481 2HD1 LEU 59 2HD1 LEU 59 4.676 -0.817 11.382 482 3HD1 LEU 59 3HD1 LEU 59 6.380 -0.811 11.837 483 1HD2 LEU 59 1HD2 LEU 59 6.802 0.783 13.300 484 2HD2 LEU 59 2HD2 LEU 59 6.436 2.483 13.011 485 3HD2 LEU 59 3HD2 LEU 59 7.568 1.634 11.959 486 H LYS 60 H LYS 60 5.475 4.825 9.754 487 HA LYS 60 HA LYS 60 5.129 6.124 12.182 488 1HB LYS 60 1HB LYS 60 6.293 6.723 9.654 489 2HB LYS 60 2HB LYS 60 5.296 8.095 10.119 490 1HG LYS 60 1HG LYS 60 6.480 8.300 12.211 491 2HG LYS 60 2HG LYS 60 7.418 6.848 11.856 492 1HD LYS 60 1HD LYS 60 7.484 9.048 9.863 493 2HD LYS 60 2HD LYS 60 8.347 9.297 11.383 494 1HE LYS 60 1HE LYS 60 10.043 8.161 10.495 495 2HE LYS 60 2HE LYS 60 9.036 6.718 10.603 496 1HZ LYS 60 1HZ LYS 60 9.251 6.616 8.406 497 2HZ LYS 60 2HZ LYS 60 9.867 8.188 8.291 498 3HZ LYS 60 3HZ LYS 60 8.195 7.935 8.316 499 H PHE 61 H PHE 61 3.173 6.298 9.235 500 HA PHE 61 HA PHE 61 1.392 8.287 10.196 501 1HB PHE 61 1HB PHE 61 1.554 6.495 7.853 502 2HB PHE 61 2HB PHE 61 -0.064 7.015 8.301 503 HD1 PHE 61 HD1 PHE 61 3.058 7.961 6.791 504 HD2 PHE 61 HD2 PHE 61 -0.586 9.454 8.402 505 HE1 PHE 61 HE1 PHE 61 3.436 10.106 5.646 506 HE2 PHE 61 HE2 PHE 61 -0.216 11.602 7.258 507 HZ PHE 61 HZ PHE 61 1.798 11.930 5.879 508 H LEU 62 H LEU 62 1.404 4.767 10.320 509 HA LEU 62 HA LEU 62 -1.229 4.323 11.119 510 1HB LEU 62 1HB LEU 62 1.160 2.817 10.895 511 2HB LEU 62 2HB LEU 62 0.550 2.549 12.515 512 HG LEU 62 HG LEU 62 -1.666 2.282 10.783 513 1HD1 LEU 62 1HD1 LEU 62 -1.012 1.272 8.914 514 2HD1 LEU 62 2HD1 LEU 62 0.053 0.179 9.798 515 3HD1 LEU 62 3HD1 LEU 62 0.633 1.770 9.305 516 1HD2 LEU 62 1HD2 LEU 62 -0.102 0.641 12.661 517 2HD2 LEU 62 2HD2 LEU 62 -1.057 -0.251 11.477 518 3HD2 LEU 62 3HD2 LEU 62 -1.841 0.902 12.554 519 H LEU 63 H LEU 63 1.619 4.397 13.276 520 HA LEU 63 HA LEU 63 0.058 4.645 15.619 521 1HB LEU 63 1HB LEU 63 2.793 4.319 14.970 522 2HB LEU 63 2HB LEU 63 2.678 5.716 16.026 523 HG LEU 63 HG LEU 63 1.234 3.233 16.819 524 1HD1 LEU 63 1HD1 LEU 63 4.187 3.549 16.678 525 2HD1 LEU 63 2HD1 LEU 63 3.190 2.110 16.455 526 3HD1 LEU 63 3HD1 LEU 63 3.488 2.734 18.077 527 1HD2 LEU 63 1HD2 LEU 63 2.037 4.060 19.067 528 2HD2 LEU 63 2HD2 LEU 63 0.894 5.102 18.220 529 3HD2 LEU 63 3HD2 LEU 63 2.611 5.503 18.229 530 H ARG 64 H ARG 64 1.277 6.987 13.355 531 HA ARG 64 HA ARG 64 1.316 9.277 14.947 532 1HB ARG 64 1HB ARG 64 2.117 9.062 12.563 533 2HB ARG 64 2HB ARG 64 0.440 9.204 12.060 534 1HG ARG 64 1HG ARG 64 1.193 11.363 11.847 535 2HG ARG 64 2HG ARG 64 0.493 11.390 13.467 536 1HD ARG 64 1HD ARG 64 2.669 11.106 14.461 537 2HD ARG 64 2HD ARG 64 3.409 10.911 12.873 538 HE ARG 64 HE ARG 64 2.038 13.409 13.178 539 1HH1 ARG 64 1HH1 ARG 64 5.038 11.713 13.732 540 2HH1 ARG 64 2HH1 ARG 64 5.986 13.160 13.807 541 1HH2 ARG 64 1HH2 ARG 64 3.284 15.311 13.286 542 2HH2 ARG 64 2HH2 ARG 64 4.991 15.201 13.559 543 H GLU 65 H GLU 65 -1.346 8.051 12.916 544 HA GLU 65 HA GLU 65 -3.184 9.964 14.067 545 1HB GLU 65 1HB GLU 65 -3.079 8.344 11.703 546 2HB GLU 65 2HB GLU 65 -4.594 8.040 12.544 547 1HG GLU 65 1HG GLU 65 -4.450 10.754 12.643 548 2HG GLU 65 2HG GLU 65 -3.683 10.410 11.094 549 H LEU 66 H LEU 66 -2.412 6.576 14.396 550 HA LEU 66 HA LEU 66 -4.697 5.644 15.696 551 1HB LEU 66 1HB LEU 66 -1.859 4.843 15.544 552 2HB LEU 66 2HB LEU 66 -2.738 4.233 16.926 553 HG LEU 66 HG LEU 66 -4.182 2.951 15.597 554 1HD1 LEU 66 1HD1 LEU 66 -4.451 3.135 13.222 555 2HD1 LEU 66 2HD1 LEU 66 -3.169 4.336 13.120 556 3HD1 LEU 66 3HD1 LEU 66 -4.679 4.730 13.930 557 1HD2 LEU 66 1HD2 LEU 66 -2.614 1.455 15.165 558 2HD2 LEU 66 2HD2 LEU 66 -1.395 2.715 15.331 559 3HD2 LEU 66 3HD2 LEU 66 -2.087 2.363 13.749 560 H GLY 67 H GLY 67 -5.564 6.967 17.260 561 1HA GLY 67 1HA GLY 67 -3.926 8.151 19.311 562 2HA GLY 67 2HA GLY 67 -5.682 8.187 19.229 563 H THR 68 H THR 68 -4.952 5.035 18.862 564 HA THR 68 HA THR 68 -5.112 4.521 21.755 565 HB THR 68 HB THR 68 -6.566 2.758 21.379 566 HG1 THR 68 HG1 THR 68 -5.459 1.537 19.925 567 1HG2 THR 68 1HG2 THR 68 -8.121 3.382 19.432 568 2HG2 THR 68 2HG2 THR 68 -7.091 4.798 19.258 569 3HG2 THR 68 3HG2 THR 68 -7.949 4.512 20.770 570 H ALA 69 H ALA 69 -4.271 2.285 22.355 571 HA ALA 69 HA ALA 69 -1.611 2.048 22.194 572 1HB ALA 69 1HB ALA 69 -2.055 -0.537 22.291 573 2HB ALA 69 2HB ALA 69 -3.734 -0.021 22.447 574 3HB ALA 69 3HB ALA 69 -2.533 0.517 23.622 575 H GLY 70 H GLY 70 -3.582 -0.083 20.117 576 1HA GLY 70 1HA GLY 70 -3.312 -0.393 17.794 577 2HA GLY 70 2HA GLY 70 -1.783 0.469 17.880 578 H ASN 71 H ASN 71 -3.223 -2.527 17.581 579 HA ASN 71 HA ASN 71 -0.700 -3.864 17.531 580 1HB ASN 71 1HB ASN 71 -2.112 -3.866 20.007 581 2HB ASN 71 2HB ASN 71 -2.197 -5.491 19.334 582 1HD2 ASN 71 1HD2 ASN 71 -0.284 -6.639 18.969 583 2HD2 ASN 71 2HD2 ASN 71 1.194 -6.207 19.751 584 H LEU 72 H LEU 72 -1.072 -6.298 17.184 585 HA LEU 72 HA LEU 72 -3.154 -6.528 15.169 586 1HB LEU 72 1HB LEU 72 -1.024 -8.536 15.893 587 2HB LEU 72 2HB LEU 72 -1.974 -8.482 14.420 588 HG LEU 72 HG LEU 72 0.122 -7.672 13.768 589 1HD1 LEU 72 1HD1 LEU 72 -1.686 -6.207 13.024 590 2HD1 LEU 72 2HD1 LEU 72 -0.189 -5.315 13.257 591 3HD1 LEU 72 3HD1 LEU 72 -1.478 -5.211 14.456 592 1HD2 LEU 72 1HD2 LEU 72 0.568 -7.173 16.402 593 2HD2 LEU 72 2HD2 LEU 72 0.449 -5.540 15.749 594 3HD2 LEU 72 3HD2 LEU 72 1.632 -6.669 15.088 595 H GLU 73 H GLU 73 -5.101 -7.273 15.743 596 HA GLU 73 HA GLU 73 -5.304 -9.140 18.008 597 1HB GLU 73 1HB GLU 73 -6.705 -6.823 17.527 598 2HB GLU 73 2HB GLU 73 -7.805 -8.047 16.917 599 1HG GLU 73 1HG GLU 73 -6.815 -8.903 19.439 600 2HG GLU 73 2HG GLU 73 -7.378 -7.238 19.581 601 H GLY 74 H GLY 74 -6.735 -10.966 17.827 602 1HA GLY 74 1HA GLY 74 -7.481 -12.861 16.765 603 2HA GLY 74 2HA GLY 74 -8.080 -11.771 15.525 604 H GLY 75 H GLY 75 -7.467 -13.958 14.408 605 1HA GLY 75 1HA GLY 75 -4.851 -14.708 13.895 606 2HA GLY 75 2HA GLY 75 -6.178 -14.907 12.760 607 H ARG 76 H ARG 76 -6.715 -12.093 12.457 608 HA ARG 76 HA ARG 76 -4.585 -11.489 10.578 609 1HB ARG 76 1HB ARG 76 -7.113 -9.911 11.064 610 2HB ARG 76 2HB ARG 76 -6.066 -9.848 9.653 611 1HG ARG 76 1HG ARG 76 -7.166 -12.499 10.240 612 2HG ARG 76 2HG ARG 76 -8.358 -11.273 9.806 613 1HD ARG 76 1HD ARG 76 -7.825 -11.964 7.712 614 2HD ARG 76 2HD ARG 76 -6.552 -10.766 7.916 615 HE ARG 76 HE ARG 76 -5.070 -12.627 8.537 616 1HH1 ARG 76 1HH1 ARG 76 -7.983 -13.367 6.744 617 2HH1 ARG 76 2HH1 ARG 76 -7.353 -14.844 6.103 618 1HH2 ARG 76 1HH2 ARG 76 -4.254 -14.567 7.685 619 2HH2 ARG 76 2HH2 ARG 76 -5.244 -15.525 6.635 620 H ALA 77 H ALA 77 -4.839 -8.681 10.533 621 HA ALA 77 HA ALA 77 -3.380 -8.001 12.986 622 1HB ALA 77 1HB ALA 77 -2.721 -7.712 10.311 623 2HB ALA 77 2HB ALA 77 -1.907 -6.958 11.677 624 3HB ALA 77 3HB ALA 77 -3.177 -6.089 10.822 625 H ILE 78 H ILE 78 -5.647 -7.805 13.910 626 HA ILE 78 HA ILE 78 -7.165 -5.478 13.115 627 HB ILE 78 HB ILE 78 -7.523 -7.399 15.398 628 1HG1 ILE 78 1HG1 ILE 78 -9.549 -7.361 13.332 629 2HG1 ILE 78 2HG1 ILE 78 -7.963 -7.756 12.689 630 1HG2 ILE 78 1HG2 ILE 78 -8.528 -5.309 16.020 631 2HG2 ILE 78 2HG2 ILE 78 -9.806 -6.444 15.584 632 3HG2 ILE 78 3HG2 ILE 78 -9.324 -5.181 14.452 633 1HD1 ILE 78 1HD1 ILE 78 -8.469 -9.210 15.116 634 2HD1 ILE 78 2HD1 ILE 78 -8.085 -9.808 13.501 635 3HD1 ILE 78 3HD1 ILE 78 -9.759 -9.467 13.942 636 H LEU 79 H LEU 79 -5.903 -3.691 13.528 637 HA LEU 79 HA LEU 79 -4.939 -3.278 16.255 638 1HB LEU 79 1HB LEU 79 -3.685 -1.430 15.366 639 2HB LEU 79 2HB LEU 79 -3.422 -2.845 14.361 640 HG LEU 79 HG LEU 79 -5.535 -1.632 13.105 641 1HD1 LEU 79 1HD1 LEU 79 -5.413 0.339 14.480 642 2HD1 LEU 79 2HD1 LEU 79 -4.848 0.730 12.854 643 3HD1 LEU 79 3HD1 LEU 79 -3.688 0.493 14.158 644 1HD2 LEU 79 1HD2 LEU 79 -2.772 -0.851 12.340 645 2HD2 LEU 79 2HD2 LEU 79 -4.089 -1.458 11.340 646 3HD2 LEU 79 3HD2 LEU 79 -3.183 -2.564 12.369 647 H GLN 80 H GLN 80 -5.076 -0.768 16.826 648 HA GLN 80 HA GLN 80 -7.791 0.183 16.268 649 1HB GLN 80 1HB GLN 80 -7.847 -1.111 18.372 650 2HB GLN 80 2HB GLN 80 -6.607 -0.057 19.038 651 1HG GLN 80 1HG GLN 80 -8.138 1.850 18.779 652 2HG GLN 80 2HG GLN 80 -9.383 0.747 18.215 653 1HE2 GLN 80 1HE2 GLN 80 -8.913 -1.381 19.963 654 2HE2 GLN 80 2HE2 GLN 80 -9.346 -0.886 21.560 655 H GLY 81 H GLY 81 -8.048 2.376 16.278 656 1HA GLY 81 1HA GLY 81 -6.495 4.320 17.443 657 2HA GLY 81 2HA GLY 81 -5.689 3.947 15.928 658 H LYS 82 H LYS 82 -6.401 4.857 14.109 659 HA LYS 82 HA LYS 82 -9.101 5.861 13.878 660 1HB LYS 82 1HB LYS 82 -7.042 7.571 14.772 661 2HB LYS 82 2HB LYS 82 -7.366 8.016 13.103 662 1HG LYS 82 1HG LYS 82 -8.887 9.345 14.112 663 2HG LYS 82 2HG LYS 82 -9.876 7.890 13.965 664 1HD LYS 82 1HD LYS 82 -8.675 7.395 16.317 665 2HD LYS 82 2HD LYS 82 -8.698 9.157 16.361 666 1HE LYS 82 1HE LYS 82 -11.080 9.187 16.060 667 2HE LYS 82 2HE LYS 82 -11.113 7.442 15.804 668 1HZ LYS 82 1HZ LYS 82 -10.085 8.582 18.323 669 2HZ LYS 82 2HZ LYS 82 -10.685 7.029 18.029 670 3HZ LYS 82 3HZ LYS 82 -11.744 8.346 18.095 671 H PHE 83 H PHE 83 -6.967 4.052 12.515 672 HA PHE 83 HA PHE 83 -6.705 5.261 9.903 673 1HB PHE 83 1HB PHE 83 -5.656 2.901 11.281 674 2HB PHE 83 2HB PHE 83 -6.077 2.583 9.602 675 HD1 PHE 83 HD1 PHE 83 -3.695 2.126 9.190 676 HD2 PHE 83 HD2 PHE 83 -5.039 5.959 10.460 677 HE1 PHE 83 HE1 PHE 83 -1.572 3.118 8.440 678 HE2 PHE 83 HE2 PHE 83 -2.919 6.955 9.713 679 HZ PHE 83 HZ PHE 83 -1.183 5.532 8.701 680 H THR 84 H THR 84 -9.282 5.357 10.454 681 HA THR 84 HA THR 84 -10.729 3.070 9.507 682 HB THR 84 HB THR 84 -11.518 5.895 10.230 683 HG1 THR 84 HG1 THR 84 -12.664 4.565 11.885 684 1HG2 THR 84 1HG2 THR 84 -13.364 5.603 9.008 685 2HG2 THR 84 2HG2 THR 84 -13.848 4.511 10.305 686 3HG2 THR 84 3HG2 THR 84 -13.100 3.872 8.844 687 H HIS 85 H HIS 85 -9.472 2.958 7.490 688 HA HIS 85 HA HIS 85 -9.026 3.415 5.284 689 1HB HIS 85 1HB HIS 85 -11.098 3.572 3.913 690 2HB HIS 85 2HB HIS 85 -11.157 2.272 5.101 691 HD2 HIS 85 HD2 HIS 85 -13.506 2.245 6.424 692 HE1 HIS 85 HE1 HIS 85 -14.498 6.350 6.007 693 HE2 HIS 85 HE2 HIS 85 -15.146 4.147 7.046 694 H PHE 86 H PHE 86 -8.622 5.650 6.948 695 HA PHE 86 HA PHE 86 -9.674 7.929 5.472 696 1HB PHE 86 1HB PHE 86 -8.566 7.500 8.145 697 2HB PHE 86 2HB PHE 86 -7.940 8.948 7.361 698 HD1 PHE 86 HD1 PHE 86 -10.120 9.993 5.858 699 HD2 PHE 86 HD2 PHE 86 -10.179 8.104 9.670 700 HE1 PHE 86 HE1 PHE 86 -12.193 11.191 6.414 701 HE2 PHE 86 HE2 PHE 86 -12.254 9.299 10.235 702 HZ PHE 86 HZ PHE 86 -13.266 10.845 8.604 703 H LEU 87 H LEU 87 -6.448 7.491 6.836 704 HA LEU 87 HA LEU 87 -5.203 8.817 4.649 705 1HB LEU 87 1HB LEU 87 -4.109 7.228 6.964 706 2HB LEU 87 2HB LEU 87 -3.086 8.019 5.780 707 HG LEU 87 HG LEU 87 -5.098 9.758 7.051 708 1HD1 LEU 87 1HD1 LEU 87 -2.799 8.603 8.619 709 2HD1 LEU 87 2HD1 LEU 87 -4.517 8.440 8.980 710 3HD1 LEU 87 3HD1 LEU 87 -3.736 10.017 9.097 711 1HD2 LEU 87 1HD2 LEU 87 -2.408 10.667 7.249 712 2HD2 LEU 87 2HD2 LEU 87 -3.709 11.274 6.224 713 3HD2 LEU 87 3HD2 LEU 87 -2.653 9.987 5.641 714 H ILE 88 H ILE 88 -5.411 5.427 5.686 715 HA ILE 88 HA ILE 88 -3.701 4.343 3.755 716 HB ILE 88 HB ILE 88 -6.154 2.946 4.804 717 1HG1 ILE 88 1HG1 ILE 88 -3.465 3.313 6.166 718 2HG1 ILE 88 2HG1 ILE 88 -5.033 3.850 6.750 719 1HG2 ILE 88 1HG2 ILE 88 -3.916 2.175 3.181 720 2HG2 ILE 88 2HG2 ILE 88 -5.371 1.270 3.594 721 3HG2 ILE 88 3HG2 ILE 88 -3.967 1.211 4.658 722 1HD1 ILE 88 1HD1 ILE 88 -5.469 1.882 7.678 723 2HD1 ILE 88 2HD1 ILE 88 -3.762 1.516 7.425 724 3HD1 ILE 88 3HD1 ILE 88 -4.959 0.996 6.242 725 H ASN 89 H ASN 89 -7.256 4.266 3.717 726 HA ASN 89 HA ASN 89 -7.587 3.331 1.146 727 1HB ASN 89 1HB ASN 89 -9.275 3.986 3.131 728 2HB ASN 89 2HB ASN 89 -9.548 5.355 2.058 729 1HD2 ASN 89 1HD2 ASN 89 -10.366 2.194 2.751 730 2HD2 ASN 89 2HD2 ASN 89 -11.205 1.815 1.289 731 H GLU 90 H GLU 90 -7.319 6.709 2.198 732 HA GLU 90 HA GLU 90 -7.764 7.849 -0.340 733 1HB GLU 90 1HB GLU 90 -7.554 8.850 2.147 734 2HB GLU 90 2HB GLU 90 -5.965 9.275 1.531 735 1HG GLU 90 1HG GLU 90 -8.124 9.911 -0.316 736 2HG GLU 90 2HG GLU 90 -8.266 10.734 1.236 737 H ARG 91 H ARG 91 -4.772 6.973 1.354 738 HA ARG 91 HA ARG 91 -2.987 7.950 -0.590 739 1HB ARG 91 1HB ARG 91 -2.713 5.768 1.467 740 2HB ARG 91 2HB ARG 91 -1.377 6.309 0.460 741 1HG ARG 91 1HG ARG 91 -2.624 8.567 1.710 742 2HG ARG 91 2HG ARG 91 -2.221 7.352 2.922 743 1HD ARG 91 1HD ARG 91 0.053 7.412 2.407 744 2HD ARG 91 2HD ARG 91 -0.227 8.173 0.841 745 HE ARG 91 HE ARG 91 -1.036 9.790 3.076 746 1HH1 ARG 91 1HH1 ARG 91 1.649 8.881 1.045 747 2HH1 ARG 91 2HH1 ARG 91 2.509 10.362 1.302 748 1HH2 ARG 91 1HH2 ARG 91 0.097 11.735 3.426 749 2HH2 ARG 91 2HH2 ARG 91 1.629 11.981 2.657 750 H ILE 92 H ILE 92 -4.271 4.669 -0.064 751 HA ILE 92 HA ILE 92 -2.934 3.369 -2.128 752 HB ILE 92 HB ILE 92 -5.736 2.815 -1.128 753 1HG1 ILE 92 1HG1 ILE 92 -3.066 1.719 -0.221 754 2HG1 ILE 92 2HG1 ILE 92 -4.081 2.835 0.677 755 1HG2 ILE 92 1HG2 ILE 92 -5.237 0.480 -1.860 756 2HG2 ILE 92 2HG2 ILE 92 -3.805 1.099 -2.669 757 3HG2 ILE 92 3HG2 ILE 92 -5.398 1.639 -3.179 758 1HD1 ILE 92 1HD1 ILE 92 -4.816 0.985 1.686 759 2HD1 ILE 92 2HD1 ILE 92 -4.285 -0.063 0.371 760 3HD1 ILE 92 3HD1 ILE 92 -5.814 0.806 0.244 761 H GLU 93 H GLU 93 -6.238 4.708 -2.161 762 HA GLU 93 HA GLU 93 -6.691 4.324 -4.911 763 1HB GLU 93 1HB GLU 93 -7.958 6.265 -2.972 764 2HB GLU 93 2HB GLU 93 -8.567 5.933 -4.588 765 1HG GLU 93 1HG GLU 93 -8.608 3.467 -3.785 766 2HG GLU 93 2HG GLU 93 -8.554 4.178 -2.173 767 H ASP 94 H ASP 94 -4.968 6.783 -3.183 768 HA ASP 94 HA ASP 94 -5.145 8.891 -5.035 769 1HB ASP 94 1HB ASP 94 -4.253 9.065 -2.695 770 2HB ASP 94 2HB ASP 94 -2.786 8.268 -3.249 771 H TYR 95 H TYR 95 -2.544 6.496 -4.602 772 HA TYR 95 HA TYR 95 -1.347 7.247 -7.129 773 1HB TYR 95 1HB TYR 95 -0.455 4.887 -5.511 774 2HB TYR 95 2HB TYR 95 0.505 5.992 -6.490 775 HD1 TYR 95 HD1 TYR 95 0.316 4.968 -3.346 776 HD2 TYR 95 HD2 TYR 95 -0.149 8.609 -5.486 777 HE1 TYR 95 HE1 TYR 95 0.901 6.224 -1.314 778 HE2 TYR 95 HE2 TYR 95 0.438 9.881 -3.464 779 HH TYR 95 HH TYR 95 1.897 8.552 -0.823 780 H VAL 96 H VAL 96 -2.583 4.228 -5.696 781 HA VAL 96 HA VAL 96 -2.436 2.607 -7.920 782 HB VAL 96 HB VAL 96 -4.694 2.532 -5.914 783 1HG1 VAL 96 1HG1 VAL 96 -3.434 0.294 -7.488 784 2HG1 VAL 96 2HG1 VAL 96 -4.910 1.131 -7.968 785 3HG1 VAL 96 3HG1 VAL 96 -4.867 0.209 -6.464 786 1HG2 VAL 96 1HG2 VAL 96 -3.239 0.912 -4.691 787 2HG2 VAL 96 2HG2 VAL 96 -2.639 2.568 -4.671 788 3HG2 VAL 96 3HG2 VAL 96 -1.910 1.381 -5.750 789 H ASN 97 H ASN 97 -5.113 4.778 -6.978 790 HA ASN 97 HA ASN 97 -6.259 4.377 -9.654 791 1HB ASN 97 1HB ASN 97 -7.550 3.905 -7.373 792 2HB ASN 97 2HB ASN 97 -7.839 5.640 -7.460 793 1HD2 ASN 97 1HD2 ASN 97 -9.382 6.368 -8.759 794 2HD2 ASN 97 2HD2 ASN 97 -10.299 5.412 -9.858 795 H LYS 98 H LYS 98 -4.145 6.064 -9.610 796 HA LYS 98 HA LYS 98 -5.008 8.789 -9.145 797 1HB LYS 98 1HB LYS 98 -2.627 7.897 -8.861 798 2HB LYS 98 2HB LYS 98 -2.520 7.934 -10.615 799 1HG LYS 98 1HG LYS 98 -3.193 10.380 -10.441 800 2HG LYS 98 2HG LYS 98 -2.847 10.229 -8.717 801 1HD LYS 98 1HD LYS 98 -0.573 9.672 -9.146 802 2HD LYS 98 2HD LYS 98 -0.878 9.504 -10.877 803 1HE LYS 98 1HE LYS 98 -1.523 12.109 -9.618 804 2HE LYS 98 2HE LYS 98 0.176 11.696 -9.807 805 1HZ LYS 98 1HZ LYS 98 -1.655 11.433 -12.091 806 2HZ LYS 98 2HZ LYS 98 0.018 11.681 -12.087 807 3HZ LYS 98 3HZ LYS 98 -1.025 12.950 -11.685 808 H PHE 99 H PHE 99 -5.303 6.569 -11.695 809 HA PHE 99 HA PHE 99 -5.172 8.438 -13.856 810 1HB PHE 99 1HB PHE 99 -6.462 5.708 -13.838 811 2HB PHE 99 2HB PHE 99 -5.909 6.615 -15.244 812 HD1 PHE 99 HD1 PHE 99 -4.990 4.345 -12.610 813 HD2 PHE 99 HD2 PHE 99 -3.459 7.011 -15.552 814 HE1 PHE 99 HE1 PHE 99 -2.783 3.273 -12.426 815 HE2 PHE 99 HE2 PHE 99 -1.250 5.943 -15.376 816 HZ PHE 99 HZ PHE 99 -0.910 4.071 -13.811 817 H VAL 100 H VAL 100 -7.891 6.675 -12.358 818 HA VAL 100 HA VAL 100 -9.823 8.293 -13.743 819 HB VAL 100 HB VAL 100 -10.338 6.368 -11.475 820 1HG1 VAL 100 1HG1 VAL 100 -12.558 6.271 -12.210 821 2HG1 VAL 100 2HG1 VAL 100 -12.176 7.042 -13.749 822 3HG1 VAL 100 3HG1 VAL 100 -12.156 7.985 -12.260 823 1HG2 VAL 100 1HG2 VAL 100 -10.781 5.446 -14.227 824 2HG2 VAL 100 2HG2 VAL 100 -10.123 4.588 -12.835 825 3HG2 VAL 100 3HG2 VAL 100 -9.090 5.660 -13.779 826 H ILE 101 H ILE 101 -7.898 8.976 -11.151 827 HA ILE 101 HA ILE 101 -9.948 10.656 -9.858 828 HB ILE 101 HB ILE 101 -7.318 9.698 -8.722 829 1HG1 ILE 101 1HG1 ILE 101 -8.949 7.916 -8.906 830 2HG1 ILE 101 2HG1 ILE 101 -8.742 8.361 -7.216 831 1HG2 ILE 101 1HG2 ILE 101 -9.278 10.771 -6.857 832 2HG2 ILE 101 2HG2 ILE 101 -8.708 11.973 -8.014 833 3HG2 ILE 101 3HG2 ILE 101 -7.553 11.104 -7.003 834 1HD1 ILE 101 1HD1 ILE 101 -10.822 9.936 -7.887 835 2HD1 ILE 101 2HD1 ILE 101 -10.986 8.311 -7.222 836 3HD1 ILE 101 3HD1 ILE 101 -11.094 8.565 -8.963 837 H CYS 102 H CYS 102 -6.526 10.632 -10.865 838 HA CYS 102 HA CYS 102 -6.321 13.487 -10.564 839 1HB CYS 102 1HB CYS 102 -4.426 11.826 -10.210 840 2HB CYS 102 2HB CYS 102 -4.335 11.707 -11.965 841 H HIS 103 H HIS 103 -8.002 11.849 -12.727 842 HA HIS 103 HA HIS 103 -8.849 12.304 -14.775 843 1HB HIS 103 1HB HIS 103 -7.332 14.907 -14.499 844 2HB HIS 103 2HB HIS 103 -8.581 14.570 -15.693 845 HD2 HIS 103 HD2 HIS 103 -11.169 13.915 -14.334 846 HE1 HIS 103 HE1 HIS 103 -10.212 16.512 -11.117 847 HE2 HIS 103 HE2 HIS 103 -12.054 15.297 -12.335 848 H GLU 104 H GLU 104 -6.901 10.571 -14.911 849 HA GLU 104 HA GLU 104 -5.173 9.691 -16.123 850 1HB GLU 104 1HB GLU 104 -6.986 9.673 -17.757 851 2HB GLU 104 2HB GLU 104 -6.572 11.306 -18.261 852 1HG GLU 104 1HG GLU 104 -5.445 10.247 -19.881 853 2HG GLU 104 2HG GLU 104 -4.206 10.075 -18.640 854 H CYS 105 H CYS 105 -3.731 11.170 -14.816 855 HA CYS 105 HA CYS 105 -2.649 13.479 -16.122 856 1HB CYS 105 1HB CYS 105 -2.719 12.774 -13.557 857 2HB CYS 105 2HB CYS 105 -1.144 12.094 -13.955 858 H ASN 106 H ASN 106 -2.384 11.956 -18.113 859 HA ASN 106 HA ASN 106 -0.110 10.243 -18.144 860 1HB ASN 106 1HB ASN 106 -2.301 10.629 -19.768 861 2HB ASN 106 2HB ASN 106 -0.994 11.269 -20.750 862 1HD2 ASN 106 1HD2 ASN 106 -1.009 9.660 -22.238 863 2HD2 ASN 106 2HD2 ASN 106 -0.533 8.036 -21.890 864 H ARG 107 H ARG 107 -0.123 12.536 -20.770 865 HA ARG 107 HA ARG 107 2.433 13.595 -19.785 866 1HB ARG 107 1HB ARG 107 1.394 13.474 -22.621 867 2HB ARG 107 2HB ARG 107 2.977 14.054 -22.126 868 1HG ARG 107 1HG ARG 107 2.459 11.381 -21.149 869 2HG ARG 107 2HG ARG 107 2.317 11.485 -22.905 870 1HD ARG 107 1HD ARG 107 4.536 12.546 -22.998 871 2HD ARG 107 2HD ARG 107 4.675 12.380 -21.248 872 HE ARG 107 HE ARG 107 5.152 10.363 -23.195 873 1HH1 ARG 107 1HH1 ARG 107 3.951 10.875 -19.959 874 2HH1 ARG 107 2HH1 ARG 107 4.341 9.274 -19.426 875 1HH2 ARG 107 1HH2 ARG 107 5.673 8.259 -22.495 876 2HH2 ARG 107 2HH2 ARG 107 5.320 7.790 -20.865 877 HA PRO 108 HA PRO 108 -0.821 17.083 -19.729 878 1HB PRO 108 1HB PRO 108 0.823 17.725 -17.330 879 2HB PRO 108 2HB PRO 108 -0.925 17.829 -17.558 880 1HG PRO 108 1HG PRO 108 0.144 15.846 -16.135 881 2HG PRO 108 2HG PRO 108 -1.245 15.565 -17.200 882 1HD PRO 108 1HD PRO 108 1.624 14.849 -17.603 883 2HD PRO 108 2HD PRO 108 0.154 13.988 -18.094 884 H ASP 109 H ASP 109 -0.434 19.062 -20.576 885 HA ASP 109 HA ASP 109 2.242 19.646 -21.500 886 1HB ASP 109 1HB ASP 109 -0.448 20.335 -22.258 887 2HB ASP 109 2HB ASP 109 0.508 21.804 -22.096 888 H THR 110 H THR 110 2.080 19.717 -18.723 889 HA THR 110 HA THR 110 2.583 22.553 -18.189 890 HB THR 110 HB THR 110 1.719 21.819 -15.789 891 HG1 THR 110 HG1 THR 110 -0.282 20.450 -16.566 892 1HG2 THR 110 1HG2 THR 110 0.545 23.177 -17.994 893 2HG2 THR 110 2HG2 THR 110 0.232 23.387 -16.272 894 3HG2 THR 110 3HG2 THR 110 -0.701 22.214 -17.201 895 H ARG 111 H ARG 111 3.696 22.672 -15.899 896 HA ARG 111 HA ARG 111 6.068 21.014 -16.139 897 1HB ARG 111 1HB ARG 111 5.905 23.599 -15.679 898 2HB ARG 111 2HB ARG 111 5.707 23.084 -14.010 899 1HG ARG 111 1HG ARG 111 7.946 23.249 -13.985 900 2HG ARG 111 2HG ARG 111 7.860 21.630 -14.683 901 1HD ARG 111 1HD ARG 111 7.607 23.322 -16.860 902 2HD ARG 111 2HD ARG 111 8.815 24.110 -15.846 903 HE ARG 111 HE ARG 111 9.734 21.618 -15.875 904 1HH1 ARG 111 1HH1 ARG 111 8.561 23.609 -18.495 905 2HH1 ARG 111 2HH1 ARG 111 9.568 22.853 -19.681 906 1HH2 ARG 111 1HH2 ARG 111 11.060 20.633 -17.434 907 2HH2 ARG 111 2HH2 ARG 111 10.986 21.165 -19.081 908 H ILE 112 H ILE 112 5.666 19.033 -15.349 909 HA ILE 112 HA ILE 112 4.481 18.748 -12.682 910 HB ILE 112 HB ILE 112 5.188 16.522 -14.584 911 1HG1 ILE 112 1HG1 ILE 112 2.517 17.909 -14.305 912 2HG1 ILE 112 2HG1 ILE 112 3.621 18.114 -15.664 913 1HG2 ILE 112 1HG2 ILE 112 3.443 16.729 -12.145 914 2HG2 ILE 112 2HG2 ILE 112 4.857 15.703 -12.395 915 3HG2 ILE 112 3HG2 ILE 112 3.361 15.373 -13.270 916 1HD1 ILE 112 1HD1 ILE 112 2.135 15.635 -14.857 917 2HD1 ILE 112 2HD1 ILE 112 3.433 15.644 -16.051 918 3HD1 ILE 112 3HD1 ILE 112 1.966 16.576 -16.337 919 H ILE 113 H ILE 113 5.512 17.565 -11.061 920 HA ILE 113 HA ILE 113 8.302 16.809 -11.514 921 HB ILE 113 HB ILE 113 7.417 18.604 -9.248 922 1HG1 ILE 113 1HG1 ILE 113 7.562 19.725 -11.469 923 2HG1 ILE 113 2HG1 ILE 113 8.729 20.338 -10.302 924 1HG2 ILE 113 1HG2 ILE 113 9.230 16.933 -8.735 925 2HG2 ILE 113 2HG2 ILE 113 9.666 18.625 -8.504 926 3HG2 ILE 113 3HG2 ILE 113 10.221 17.759 -9.936 927 1HD1 ILE 113 1HD1 ILE 113 10.051 18.286 -11.640 928 2HD1 ILE 113 2HD1 ILE 113 10.289 20.022 -11.836 929 3HD1 ILE 113 3HD1 ILE 113 9.164 19.162 -12.886 930 H ARG 114 H ARG 114 9.074 15.205 -10.132 931 HA ARG 114 HA ARG 114 7.305 14.187 -8.059 932 1HB ARG 114 1HB ARG 114 7.162 13.012 -10.523 933 2HB ARG 114 2HB ARG 114 8.406 12.037 -9.749 934 1HG ARG 114 1HG ARG 114 6.955 11.347 -8.034 935 2HG ARG 114 2HG ARG 114 5.781 12.593 -8.422 936 1HD ARG 114 1HD ARG 114 6.399 10.087 -9.936 937 2HD ARG 114 2HD ARG 114 4.868 10.584 -9.224 938 HE ARG 114 HE ARG 114 4.854 12.374 -10.970 939 1HH1 ARG 114 1HH1 ARG 114 6.630 9.407 -11.479 940 2HH1 ARG 114 2HH1 ARG 114 6.511 9.490 -13.201 941 1HH2 ARG 114 1HH2 ARG 114 4.689 12.468 -13.239 942 2HH2 ARG 114 2HH2 ARG 114 5.411 11.221 -14.199 943 H GLU 115 H GLU 115 8.426 13.602 -6.298 944 HA GLU 115 HA GLU 115 11.272 12.930 -6.635 945 1HB GLU 115 1HB GLU 115 10.887 15.274 -5.786 946 2HB GLU 115 2HB GLU 115 10.176 14.559 -4.345 947 1HG GLU 115 1HG GLU 115 12.165 14.134 -3.455 948 2HG GLU 115 2HG GLU 115 12.767 13.421 -4.951 949 H GLY 116 H GLY 116 12.079 11.311 -5.394 950 1HA GLY 116 1HA GLY 116 12.111 9.802 -3.581 951 2HA GLY 116 2HA GLY 116 10.432 10.198 -3.250 952 H ARG 117 H ARG 117 11.492 9.425 -6.483 953 HA ARG 117 HA ARG 117 10.812 7.791 -7.919 954 1HB ARG 117 1HB ARG 117 12.048 6.532 -5.624 955 2HB ARG 117 2HB ARG 117 10.860 5.465 -6.358 956 1HG ARG 117 1HG ARG 117 13.083 5.088 -7.274 957 2HG ARG 117 2HG ARG 117 11.971 5.673 -8.512 958 1HD ARG 117 1HD ARG 117 13.798 7.517 -6.996 959 2HD ARG 117 2HD ARG 117 14.313 6.689 -8.465 960 HE ARG 117 HE ARG 117 12.081 7.854 -9.307 961 1HH1 ARG 117 1HH1 ARG 117 14.774 9.125 -7.486 962 2HH1 ARG 117 2HH1 ARG 117 14.488 10.763 -7.968 963 1HH2 ARG 117 1HH2 ARG 117 11.692 10.011 -9.927 964 2HH2 ARG 117 2HH2 ARG 117 12.736 11.267 -9.351 965 H ILE 118 H ILE 118 8.659 8.820 -7.791 966 HA ILE 118 HA ILE 118 6.395 8.612 -7.842 967 HB ILE 118 HB ILE 118 6.767 5.723 -7.050 968 1HG1 ILE 118 1HG1 ILE 118 6.682 6.856 -9.852 969 2HG1 ILE 118 2HG1 ILE 118 8.169 6.399 -9.028 970 1HG2 ILE 118 1HG2 ILE 118 4.468 6.662 -6.956 971 2HG2 ILE 118 2HG2 ILE 118 4.652 5.364 -8.133 972 3HG2 ILE 118 3HG2 ILE 118 4.594 7.041 -8.672 973 1HD1 ILE 118 1HD1 ILE 118 5.896 4.592 -9.805 974 2HD1 ILE 118 2HD1 ILE 118 7.280 4.093 -8.833 975 3HD1 ILE 118 3HD1 ILE 118 7.519 4.632 -10.494 976 H SER 119 H SER 119 7.393 9.734 -5.622 977 HA SER 119 HA SER 119 5.738 8.609 -3.458 978 1HB SER 119 1HB SER 119 8.438 9.947 -3.334 979 2HB SER 119 2HB SER 119 7.392 9.828 -1.919 980 HG SER 119 HG SER 119 7.560 7.642 -1.969 981 H LEU 120 H LEU 120 7.154 11.616 -4.724 982 HA LEU 120 HA LEU 120 4.753 13.044 -3.786 983 1HB LEU 120 1HB LEU 120 7.645 13.792 -3.604 984 2HB LEU 120 2HB LEU 120 6.425 15.042 -3.711 985 HG LEU 120 HG LEU 120 6.894 14.811 -1.427 986 1HD1 LEU 120 1HD1 LEU 120 4.810 13.786 -0.470 987 2HD1 LEU 120 2HD1 LEU 120 4.385 13.309 -2.111 988 3HD1 LEU 120 3HD1 LEU 120 4.557 15.016 -1.708 989 1HD2 LEU 120 1HD2 LEU 120 6.408 11.860 -1.477 990 2HD2 LEU 120 2HD2 LEU 120 7.216 12.835 -0.249 991 3HD2 LEU 120 3HD2 LEU 120 8.004 12.538 -1.798 992 H LEU 121 H LEU 121 4.113 14.884 -5.054 993 HA LEU 121 HA LEU 121 5.425 15.610 -7.443 994 1HB LEU 121 1HB LEU 121 3.793 14.734 -9.066 995 2HB LEU 121 2HB LEU 121 4.719 13.480 -8.277 996 HG LEU 121 HG LEU 121 2.098 14.141 -7.082 997 1HD1 LEU 121 1HD1 LEU 121 2.468 12.924 -9.787 998 2HD1 LEU 121 2HD1 LEU 121 1.293 14.131 -9.257 999 3HD1 LEU 121 3HD1 LEU 121 1.121 12.451 -8.755 1000 1HD2 LEU 121 1HD2 LEU 121 3.666 12.396 -6.213 1001 2HD2 LEU 121 2HD2 LEU 121 3.380 11.491 -7.698 1002 3HD2 LEU 121 3HD2 LEU 121 2.047 11.816 -6.593 1003 H LYS 122 H LYS 122 4.264 17.186 -8.710 1004 HA LYS 122 HA LYS 122 2.054 18.424 -7.202 1005 1HB LYS 122 1HB LYS 122 4.428 19.582 -7.451 1006 2HB LYS 122 2HB LYS 122 3.736 20.098 -8.986 1007 1HG LYS 122 1HG LYS 122 2.134 21.396 -7.991 1008 2HG LYS 122 2HG LYS 122 2.132 20.444 -6.505 1009 1HD LYS 122 1HD LYS 122 3.189 22.382 -5.830 1010 2HD LYS 122 2HD LYS 122 4.557 21.348 -6.244 1011 1HE LYS 122 1HE LYS 122 3.413 23.034 -8.398 1012 2HE LYS 122 2HE LYS 122 4.329 23.848 -7.130 1013 1HZ LYS 122 1HZ LYS 122 5.593 23.050 -9.168 1014 2HZ LYS 122 2HZ LYS 122 5.412 21.489 -8.541 1015 3HZ LYS 122 3HZ LYS 122 6.249 22.664 -7.656 1016 H CYS 123 H CYS 123 0.308 19.254 -8.321 1017 HA CYS 123 HA CYS 123 0.259 18.887 -11.232 1018 1HB CYS 123 1HB CYS 123 -1.690 17.730 -9.249 1019 2HB CYS 123 2HB CYS 123 -2.158 18.048 -10.911 1020 H GLU 124 H GLU 124 0.655 21.312 -10.364 1021 HA GLU 124 HA GLU 124 -1.478 22.865 -9.489 1022 1HB GLU 124 1HB GLU 124 0.967 23.529 -9.784 1023 2HB GLU 124 2HB GLU 124 0.581 23.807 -11.476 1024 1HG GLU 124 1HG GLU 124 -1.172 25.414 -10.738 1025 2HG GLU 124 2HG GLU 124 -0.577 25.219 -9.090 1026 H ALA 125 H ALA 125 -0.796 21.531 -12.622 1027 HA ALA 125 HA ALA 125 -2.511 23.208 -14.139 1028 1HB ALA 125 1HB ALA 125 -2.133 21.705 -15.930 1029 2HB ALA 125 2HB ALA 125 -1.680 20.404 -14.828 1030 3HB ALA 125 3HB ALA 125 -0.628 21.804 -15.015 1031 H CYS 126 H CYS 126 -2.953 19.711 -13.640 1032 HA CYS 126 HA CYS 126 -5.799 19.981 -13.956 1033 1HB CYS 126 1HB CYS 126 -5.822 17.523 -13.626 1034 2HB CYS 126 2HB CYS 126 -4.682 18.023 -14.870 1035 H GLY 127 H GLY 127 -5.111 21.530 -11.840 1036 1HA GLY 127 1HA GLY 127 -6.441 21.771 -9.848 1037 2HA GLY 127 2HA GLY 127 -6.270 20.042 -9.584 1038 H ALA 128 H ALA 128 -4.879 19.471 -8.071 1039 HA ALA 128 HA ALA 128 -2.381 20.891 -7.724 1040 1HB ALA 128 1HB ALA 128 -3.989 20.593 -5.234 1041 2HB ALA 128 2HB ALA 128 -4.308 21.962 -6.299 1042 3HB ALA 128 3HB ALA 128 -2.699 21.733 -5.615 1043 H LYS 129 H LYS 129 -0.862 19.749 -6.442 1044 HA LYS 129 HA LYS 129 -1.591 17.047 -5.592 1045 1HB LYS 129 1HB LYS 129 -0.602 17.253 -8.034 1046 2HB LYS 129 2HB LYS 129 0.911 17.361 -7.169 1047 1HG LYS 129 1HG LYS 129 0.859 15.140 -7.465 1048 2HG LYS 129 2HG LYS 129 -0.060 15.213 -5.962 1049 1HD LYS 129 1HD LYS 129 -1.613 15.520 -8.447 1050 2HD LYS 129 2HD LYS 129 -0.892 13.931 -8.186 1051 1HE LYS 129 1HE LYS 129 -2.325 13.438 -6.539 1052 2HE LYS 129 2HE LYS 129 -2.163 15.033 -5.804 1053 1HZ LYS 129 1HZ LYS 129 -4.424 14.426 -6.706 1054 2HZ LYS 129 2HZ LYS 129 -3.759 14.580 -8.253 1055 3HZ LYS 129 3HZ LYS 129 -3.796 15.913 -7.213 1056 H ALA 130 H ALA 130 -0.060 16.098 -4.137 1057 HA ALA 130 HA ALA 130 1.253 18.080 -2.488 1058 1HB ALA 130 1HB ALA 130 1.452 16.359 -0.857 1059 2HB ALA 130 2HB ALA 130 1.153 15.102 -2.058 1060 3HB ALA 130 3HB ALA 130 -0.144 16.200 -1.590 1061 HA PRO 131 HA PRO 131 5.102 17.052 -4.754 1062 1HB PRO 131 1HB PRO 131 6.403 19.330 -4.162 1063 2HB PRO 131 2HB PRO 131 5.170 19.262 -5.427 1064 1HG PRO 131 1HG PRO 131 4.911 20.192 -2.586 1065 2HG PRO 131 2HG PRO 131 4.325 20.969 -4.070 1066 1HD PRO 131 1HD PRO 131 2.707 19.497 -2.483 1067 2HD PRO 131 2HD PRO 131 2.517 19.556 -4.246 1068 H LEU 132 H LEU 132 4.427 17.655 -1.450 1069 HA LEU 132 HA LEU 132 6.915 16.317 -0.692 1070 1HB LEU 132 1HB LEU 132 7.398 18.647 -0.333 1071 2HB LEU 132 2HB LEU 132 5.885 18.876 0.523 1072 HG LEU 132 HG LEU 132 7.780 16.883 1.647 1073 1HD1 LEU 132 1HD1 LEU 132 9.294 18.382 2.513 1074 2HD1 LEU 132 2HD1 LEU 132 8.212 19.760 2.307 1075 3HD1 LEU 132 3HD1 LEU 132 9.021 19.056 0.906 1076 1HD2 LEU 132 1HD2 LEU 132 5.626 17.283 2.703 1077 2HD2 LEU 132 2HD2 LEU 132 5.993 19.001 2.838 1078 3HD2 LEU 132 3HD2 LEU 132 6.936 17.824 3.750 1079 H LYS 133 H LYS 133 6.791 15.154 1.285 1080 HA LYS 133 HA LYS 133 4.047 14.429 1.987 1081 1HB LYS 133 1HB LYS 133 5.021 12.451 3.032 1082 2HB LYS 133 2HB LYS 133 5.583 12.616 1.375 1083 1HG LYS 133 1HG LYS 133 7.719 12.823 1.991 1084 2HG LYS 133 2HG LYS 133 7.328 13.887 3.342 1085 1HD LYS 133 1HD LYS 133 6.375 11.670 4.388 1086 2HD LYS 133 2HD LYS 133 7.488 10.913 3.248 1087 1HE LYS 133 1HE LYS 133 8.570 13.145 4.851 1088 2HE LYS 133 2HE LYS 133 8.186 11.667 5.733 1089 1HZ LYS 133 1HZ LYS 133 10.420 11.499 5.036 1090 2HZ LYS 133 2HZ LYS 133 10.056 11.977 3.455 1091 3HZ LYS 133 3HZ LYS 133 9.540 10.469 4.023 1092 H ASN 134 H ASN 134 3.160 14.780 3.953 1093 HA ASN 134 HA ASN 134 4.799 16.273 5.878 1094 1HB ASN 134 1HB ASN 134 2.556 16.974 6.823 1095 2HB ASN 134 2HB ASN 134 2.928 17.576 5.209 1096 1HD2 ASN 134 1HD2 ASN 134 0.866 17.845 4.523 1097 2HD2 ASN 134 2HD2 ASN 134 -0.244 16.543 4.278 1098 H VAL 135 H VAL 135 4.310 15.940 8.174 1099 HA VAL 135 HA VAL 135 3.958 13.080 8.721 1100 HB VAL 135 HB VAL 135 5.040 13.558 10.894 1101 1HG1 VAL 135 1HG1 VAL 135 6.217 13.144 8.536 1102 2HG1 VAL 135 2HG1 VAL 135 7.129 13.359 10.031 1103 3HG1 VAL 135 3HG1 VAL 135 6.919 14.715 8.922 1104 1HG2 VAL 135 1HG2 VAL 135 4.859 16.336 9.874 1105 2HG2 VAL 135 2HG2 VAL 135 6.313 15.894 10.767 1106 3HG2 VAL 135 3HG2 VAL 135 4.729 15.723 11.520 Start of MODEL 17 1 H MET 1 H MET 1 -8.513 -8.866 -13.018 2 HA MET 1 HA MET 1 -10.776 -8.757 -11.330 3 1HB MET 1 1HB MET 1 -10.127 -8.003 -14.181 4 2HB MET 1 2HB MET 1 -11.679 -7.657 -13.430 5 1HG MET 1 1HG MET 1 -10.876 -5.908 -12.310 6 2HG MET 1 2HG MET 1 -9.423 -6.775 -11.819 7 1HE MET 1 1HE MET 1 -9.416 -4.068 -12.032 8 2HE MET 1 2HE MET 1 -9.360 -3.223 -13.578 9 3HE MET 1 3HE MET 1 -7.868 -3.799 -12.834 10 H ASP 2 H ASP 2 -9.777 -11.010 -13.791 11 HA ASP 2 HA ASP 2 -12.226 -11.898 -14.756 12 1HB ASP 2 1HB ASP 2 -9.520 -12.753 -14.881 13 2HB ASP 2 2HB ASP 2 -10.479 -14.149 -14.404 14 H ASP 3 H ASP 3 -12.439 -14.597 -14.169 15 HA ASP 3 HA ASP 3 -13.771 -14.463 -11.605 16 1HB ASP 3 1HB ASP 3 -14.650 -15.593 -13.762 17 2HB ASP 3 2HB ASP 3 -13.581 -16.923 -13.327 18 H TYR 4 H TYR 4 -11.217 -16.419 -13.098 19 HA TYR 4 HA TYR 4 -9.568 -16.553 -10.871 20 1HB TYR 4 1HB TYR 4 -11.456 -17.857 -9.875 21 2HB TYR 4 2HB TYR 4 -11.253 -19.054 -11.148 22 HD1 TYR 4 HD1 TYR 4 -9.281 -20.511 -11.177 23 HD2 TYR 4 HD2 TYR 4 -9.914 -17.716 -8.034 24 HE1 TYR 4 HE1 TYR 4 -7.604 -21.678 -9.812 25 HE2 TYR 4 HE2 TYR 4 -8.238 -18.875 -6.658 26 HH TYR 4 HH TYR 4 -6.769 -20.547 -6.548 27 H GLU 5 H GLU 5 -8.176 -16.210 -12.680 28 HA GLU 5 HA GLU 5 -7.926 -18.110 -14.778 29 1HB GLU 5 1HB GLU 5 -5.908 -16.068 -13.824 30 2HB GLU 5 2HB GLU 5 -5.870 -16.916 -15.363 31 1HG GLU 5 1HG GLU 5 -7.582 -15.679 -16.244 32 2HG GLU 5 2HG GLU 5 -8.272 -15.306 -14.665 33 H LYS 6 H LYS 6 -5.300 -17.268 -12.540 34 HA LYS 6 HA LYS 6 -4.993 -19.814 -11.397 35 1HB LYS 6 1HB LYS 6 -3.103 -20.695 -12.606 36 2HB LYS 6 2HB LYS 6 -4.417 -20.417 -13.740 37 1HG LYS 6 1HG LYS 6 -2.312 -18.332 -13.353 38 2HG LYS 6 2HG LYS 6 -1.999 -19.735 -14.374 39 1HD LYS 6 1HD LYS 6 -4.559 -18.350 -14.845 40 2HD LYS 6 2HD LYS 6 -3.109 -17.442 -15.263 41 1HE LYS 6 1HE LYS 6 -3.408 -18.539 -17.229 42 2HE LYS 6 2HE LYS 6 -2.453 -19.759 -16.385 43 1HZ LYS 6 1HZ LYS 6 -4.914 -20.127 -17.509 44 2HZ LYS 6 2HZ LYS 6 -5.250 -20.019 -15.855 45 3HZ LYS 6 3HZ LYS 6 -4.151 -21.172 -16.419 46 H LEU 7 H LEU 7 -2.976 -20.010 -10.160 47 HA LEU 7 HA LEU 7 -1.524 -17.488 -9.815 48 1HB LEU 7 1HB LEU 7 -1.664 -18.033 -7.274 49 2HB LEU 7 2HB LEU 7 -2.975 -17.179 -8.064 50 HG LEU 7 HG LEU 7 -3.414 -20.038 -8.155 51 1HD1 LEU 7 1HD1 LEU 7 -3.967 -19.722 -5.492 52 2HD1 LEU 7 2HD1 LEU 7 -2.395 -18.941 -5.651 53 3HD1 LEU 7 3HD1 LEU 7 -2.602 -20.618 -6.157 54 1HD2 LEU 7 1HD2 LEU 7 -5.369 -18.956 -8.421 55 2HD2 LEU 7 2HD2 LEU 7 -4.841 -17.553 -7.490 56 3HD2 LEU 7 3HD2 LEU 7 -5.411 -18.999 -6.658 57 H LEU 8 H LEU 8 0.548 -17.696 -8.870 58 HA LEU 8 HA LEU 8 1.640 -20.413 -9.089 59 1HB LEU 8 1HB LEU 8 2.489 -18.292 -10.416 60 2HB LEU 8 2HB LEU 8 3.369 -17.989 -8.930 61 HG LEU 8 HG LEU 8 4.480 -20.165 -9.123 62 1HD1 LEU 8 1HD1 LEU 8 2.890 -20.407 -11.672 63 2HD1 LEU 8 2HD1 LEU 8 2.781 -21.441 -10.247 64 3HD1 LEU 8 3HD1 LEU 8 4.245 -21.446 -11.231 65 1HD2 LEU 8 1HD2 LEU 8 5.566 -19.624 -11.471 66 2HD2 LEU 8 2HD2 LEU 8 5.843 -18.596 -10.065 67 3HD2 LEU 8 3HD2 LEU 8 4.652 -18.127 -11.280 68 H GLU 9 H GLU 9 1.579 -21.354 -7.145 69 HA GLU 9 HA GLU 9 2.330 -19.802 -4.781 70 1HB GLU 9 1HB GLU 9 1.699 -22.302 -3.835 71 2HB GLU 9 2HB GLU 9 0.595 -20.940 -3.925 72 1HG GLU 9 1HG GLU 9 -0.508 -22.818 -4.852 73 2HG GLU 9 2HG GLU 9 -0.089 -21.744 -6.185 74 H ARG 10 H ARG 10 3.743 -21.842 -7.031 75 HA ARG 10 HA ARG 10 5.612 -23.105 -5.215 76 1HB ARG 10 1HB ARG 10 4.829 -24.307 -7.212 77 2HB ARG 10 2HB ARG 10 5.527 -23.061 -8.238 78 1HG ARG 10 1HG ARG 10 7.754 -23.641 -7.150 79 2HG ARG 10 2HG ARG 10 6.940 -25.080 -6.533 80 1HD ARG 10 1HD ARG 10 6.233 -25.109 -9.173 81 2HD ARG 10 2HD ARG 10 7.865 -24.450 -9.238 82 HE ARG 10 HE ARG 10 8.699 -26.479 -8.527 83 1HH1 ARG 10 1HH1 ARG 10 5.214 -26.488 -8.297 84 2HH1 ARG 10 2HH1 ARG 10 5.114 -28.196 -8.033 85 1HH2 ARG 10 1HH2 ARG 10 8.564 -28.721 -8.174 86 2HH2 ARG 10 2HH2 ARG 10 7.014 -29.463 -7.961 87 H ALA 11 H ALA 11 7.402 -22.160 -4.516 88 HA ALA 11 HA ALA 11 9.190 -20.772 -4.339 89 1HB ALA 11 1HB ALA 11 9.218 -20.199 -7.256 90 2HB ALA 11 2HB ALA 11 9.494 -21.858 -6.723 91 3HB ALA 11 3HB ALA 11 10.551 -20.563 -6.161 92 H ILE 12 H ILE 12 6.439 -19.714 -4.295 93 HA ILE 12 HA ILE 12 6.597 -17.088 -5.466 94 HB ILE 12 HB ILE 12 4.476 -18.554 -4.954 95 1HG1 ILE 12 1HG1 ILE 12 4.571 -16.300 -6.041 96 2HG1 ILE 12 2HG1 ILE 12 3.106 -16.590 -5.112 97 1HG2 ILE 12 1HG2 ILE 12 4.709 -16.967 -2.400 98 2HG2 ILE 12 2HG2 ILE 12 4.845 -18.720 -2.545 99 3HG2 ILE 12 3HG2 ILE 12 3.316 -17.921 -2.910 100 1HD1 ILE 12 1HD1 ILE 12 3.529 -14.549 -4.299 101 2HD1 ILE 12 2HD1 ILE 12 5.242 -14.626 -4.713 102 3HD1 ILE 12 3HD1 ILE 12 4.654 -15.405 -3.246 103 H ASP 13 H ASP 13 7.623 -18.556 -2.555 104 HA ASP 13 HA ASP 13 8.851 -16.180 -1.633 105 1HB ASP 13 1HB ASP 13 6.213 -16.291 -0.884 106 2HB ASP 13 2HB ASP 13 7.015 -17.024 0.502 107 H GLN 14 H GLN 14 7.678 -19.412 -0.760 108 HA GLN 14 HA GLN 14 9.649 -19.811 1.262 109 1HB GLN 14 1HB GLN 14 7.552 -21.449 -0.032 110 2HB GLN 14 2HB GLN 14 8.909 -22.333 0.652 111 1HG GLN 14 1HG GLN 14 7.644 -20.250 2.335 112 2HG GLN 14 2HG GLN 14 6.745 -21.739 2.056 113 1HE2 GLN 14 1HE2 GLN 14 10.240 -21.364 2.312 114 2HE2 GLN 14 2HE2 GLN 14 10.420 -22.319 3.737 115 H LEU 15 H LEU 15 9.336 -20.994 -2.084 116 HA LEU 15 HA LEU 15 12.031 -22.088 -1.978 117 1HB LEU 15 1HB LEU 15 9.835 -22.996 -3.213 118 2HB LEU 15 2HB LEU 15 10.487 -22.020 -4.511 119 HG LEU 15 HG LEU 15 12.694 -23.432 -3.804 120 1HD1 LEU 15 1HD1 LEU 15 12.275 -25.421 -2.879 121 2HD1 LEU 15 2HD1 LEU 15 10.824 -25.671 -3.849 122 3HD1 LEU 15 3HD1 LEU 15 10.742 -24.712 -2.371 123 1HD2 LEU 15 1HD2 LEU 15 10.981 -24.882 -5.677 124 2HD2 LEU 15 2HD2 LEU 15 12.558 -24.132 -5.926 125 3HD2 LEU 15 3HD2 LEU 15 11.094 -23.153 -6.004 126 HA PRO 16 HA PRO 16 13.969 -18.348 -3.419 127 1HB PRO 16 1HB PRO 16 16.022 -19.641 -4.819 128 2HB PRO 16 2HB PRO 16 16.075 -19.131 -3.130 129 1HG PRO 16 1HG PRO 16 15.478 -21.814 -4.285 130 2HG PRO 16 2HG PRO 16 16.357 -21.397 -2.802 131 1HD PRO 16 1HD PRO 16 13.852 -22.322 -2.704 132 2HD PRO 16 2HD PRO 16 14.397 -21.045 -1.595 133 HA PRO 17 HA PRO 17 11.855 -18.415 -7.430 134 1HB PRO 17 1HB PRO 17 12.275 -15.718 -7.882 135 2HB PRO 17 2HB PRO 17 10.890 -16.392 -7.020 136 1HG PRO 17 1HG PRO 17 13.398 -15.189 -5.936 137 2HG PRO 17 2HG PRO 17 11.733 -15.039 -5.345 138 1HD PRO 17 1HD PRO 17 13.514 -16.654 -4.151 139 2HD PRO 17 2HD PRO 17 11.795 -17.088 -4.270 140 H GLU 18 H GLU 18 14.816 -16.498 -6.894 141 HA GLU 18 HA GLU 18 16.821 -16.513 -7.992 142 1HB GLU 18 1HB GLU 18 16.251 -19.015 -8.325 143 2HB GLU 18 2HB GLU 18 15.789 -18.543 -9.954 144 1HG GLU 18 1HG GLU 18 18.077 -17.570 -10.224 145 2HG GLU 18 2HG GLU 18 18.498 -18.299 -8.676 146 H VAL 19 H VAL 19 13.869 -16.510 -9.898 147 HA VAL 19 HA VAL 19 15.061 -14.996 -12.053 148 HB VAL 19 HB VAL 19 12.112 -15.446 -11.682 149 1HG1 VAL 19 1HG1 VAL 19 12.587 -14.006 -13.485 150 2HG1 VAL 19 2HG1 VAL 19 12.270 -15.585 -14.206 151 3HG1 VAL 19 3HG1 VAL 19 13.928 -15.010 -14.036 152 1HG2 VAL 19 1HG2 VAL 19 14.191 -17.431 -12.543 153 2HG2 VAL 19 2HG2 VAL 19 12.531 -17.532 -13.128 154 3HG2 VAL 19 3HG2 VAL 19 12.864 -17.638 -11.400 155 H PHE 20 H PHE 20 14.327 -12.885 -12.679 156 HA PHE 20 HA PHE 20 13.580 -11.247 -10.364 157 1HB PHE 20 1HB PHE 20 14.401 -9.337 -11.773 158 2HB PHE 20 2HB PHE 20 15.633 -10.530 -11.372 159 HD1 PHE 20 HD1 PHE 20 16.883 -11.542 -13.049 160 HD2 PHE 20 HD2 PHE 20 13.287 -9.506 -14.061 161 HE1 PHE 20 HE1 PHE 20 17.418 -11.794 -15.437 162 HE2 PHE 20 HE2 PHE 20 13.814 -9.755 -16.451 163 HZ PHE 20 HZ PHE 20 15.880 -10.900 -17.142 164 H GLU 21 H GLU 21 11.702 -12.832 -12.052 165 HA GLU 21 HA GLU 21 10.235 -11.220 -13.795 166 1HB GLU 21 1HB GLU 21 8.361 -12.785 -13.349 167 2HB GLU 21 2HB GLU 21 9.874 -13.605 -13.709 168 1HG GLU 21 1HG GLU 21 9.812 -14.694 -11.786 169 2HG GLU 21 2HG GLU 21 9.642 -13.190 -10.883 170 H THR 22 H THR 22 7.757 -10.808 -13.209 171 HA THR 22 HA THR 22 7.833 -8.785 -11.148 172 HB THR 22 HB THR 22 6.735 -8.418 -13.369 173 HG1 THR 22 HG1 THR 22 4.915 -7.371 -12.440 174 1HG2 THR 22 1HG2 THR 22 5.482 -10.194 -14.021 175 2HG2 THR 22 2HG2 THR 22 4.229 -9.225 -13.249 176 3HG2 THR 22 3HG2 THR 22 4.957 -10.575 -12.382 177 H LYS 23 H LYS 23 6.416 -8.646 -9.405 178 HA LYS 23 HA LYS 23 5.779 -11.205 -8.213 179 1HB LYS 23 1HB LYS 23 5.135 -9.737 -6.237 180 2HB LYS 23 2HB LYS 23 6.822 -9.699 -6.725 181 1HG LYS 23 1HG LYS 23 5.873 -7.642 -8.180 182 2HG LYS 23 2HG LYS 23 4.778 -7.585 -6.805 183 1HD LYS 23 1HD LYS 23 6.457 -6.270 -5.993 184 2HD LYS 23 2HD LYS 23 7.049 -7.844 -5.459 185 1HE LYS 23 1HE LYS 23 7.997 -7.517 -8.079 186 2HE LYS 23 2HE LYS 23 8.240 -5.963 -7.283 187 1HZ LYS 23 1HZ LYS 23 9.377 -8.591 -6.602 188 2HZ LYS 23 2HZ LYS 23 9.213 -7.412 -5.400 189 3HZ LYS 23 3HZ LYS 23 10.157 -7.098 -6.768 190 H ARG 24 H ARG 24 3.682 -11.629 -7.204 191 HA ARG 24 HA ARG 24 1.531 -10.840 -8.976 192 1HB ARG 24 1HB ARG 24 2.008 -13.013 -7.047 193 2HB ARG 24 2HB ARG 24 0.347 -12.443 -7.110 194 1HG ARG 24 1HG ARG 24 1.840 -13.171 -9.602 195 2HG ARG 24 2HG ARG 24 1.008 -14.385 -8.627 196 1HD ARG 24 1HD ARG 24 -0.676 -13.847 -10.065 197 2HD ARG 24 2HD ARG 24 -0.976 -12.648 -8.812 198 HE ARG 24 HE ARG 24 0.085 -11.005 -10.211 199 1HH1 ARG 24 1HH1 ARG 24 -0.659 -14.042 -11.782 200 2HH1 ARG 24 2HH1 ARG 24 -0.588 -13.370 -13.373 201 1HH2 ARG 24 1HH2 ARG 24 0.181 -10.136 -12.305 202 2HH2 ARG 24 2HH2 ARG 24 -0.111 -11.159 -13.673 203 H PHE 25 H PHE 25 2.104 -8.573 -7.867 204 HA PHE 25 HA PHE 25 0.545 -8.195 -5.433 205 1HB PHE 25 1HB PHE 25 2.643 -6.691 -6.854 206 2HB PHE 25 2HB PHE 25 1.377 -5.689 -6.151 207 HD1 PHE 25 HD1 PHE 25 0.713 -7.078 -3.691 208 HD2 PHE 25 HD2 PHE 25 4.504 -6.454 -5.517 209 HE1 PHE 25 HE1 PHE 25 1.801 -7.255 -1.490 210 HE2 PHE 25 HE2 PHE 25 5.599 -6.637 -3.325 211 HZ PHE 25 HZ PHE 25 4.247 -7.037 -1.307 212 H GLU 26 H GLU 26 -1.541 -8.581 -6.243 213 HA GLU 26 HA GLU 26 -2.743 -6.269 -7.503 214 1HB GLU 26 1HB GLU 26 -2.158 -8.672 -8.992 215 2HB GLU 26 2HB GLU 26 -3.894 -8.415 -8.918 216 1HG GLU 26 1HG GLU 26 -3.404 -6.032 -9.673 217 2HG GLU 26 2HG GLU 26 -1.787 -6.616 -10.062 218 H VAL 27 H VAL 27 -4.414 -5.818 -6.235 219 HA VAL 27 HA VAL 27 -6.314 -7.899 -5.523 220 HB VAL 27 HB VAL 27 -5.185 -6.148 -3.346 221 1HG1 VAL 27 1HG1 VAL 27 -7.144 -8.416 -3.423 222 2HG1 VAL 27 2HG1 VAL 27 -7.357 -6.792 -2.769 223 3HG1 VAL 27 3HG1 VAL 27 -6.318 -7.947 -1.936 224 1HG2 VAL 27 1HG2 VAL 27 -4.268 -8.438 -2.535 225 2HG2 VAL 27 2HG2 VAL 27 -3.367 -7.521 -3.744 226 3HG2 VAL 27 3HG2 VAL 27 -4.373 -8.882 -4.238 227 HA PRO 28 HA PRO 28 -8.836 -4.393 -6.805 228 1HB PRO 28 1HB PRO 28 -10.936 -6.149 -5.628 229 2HB PRO 28 2HB PRO 28 -10.892 -5.346 -7.202 230 1HG PRO 28 1HG PRO 28 -10.452 -7.963 -7.000 231 2HG PRO 28 2HG PRO 28 -9.524 -6.969 -8.139 232 1HD PRO 28 1HD PRO 28 -8.704 -8.103 -5.503 233 2HD PRO 28 2HD PRO 28 -7.751 -7.884 -6.985 234 H LYS 29 H LYS 29 -9.211 -2.598 -5.681 235 HA LYS 29 HA LYS 29 -9.651 -1.152 -3.991 236 1HB LYS 29 1HB LYS 29 -11.737 -2.760 -4.001 237 2HB LYS 29 2HB LYS 29 -11.095 -3.270 -2.450 238 1HG LYS 29 1HG LYS 29 -12.106 -1.553 -1.508 239 2HG LYS 29 2HG LYS 29 -11.068 -0.463 -2.425 240 1HD LYS 29 1HD LYS 29 -13.251 -1.516 -4.024 241 2HD LYS 29 2HD LYS 29 -13.827 -0.663 -2.591 242 1HE LYS 29 1HE LYS 29 -13.618 1.154 -3.896 243 2HE LYS 29 2HE LYS 29 -11.917 1.042 -3.443 244 1HZ LYS 29 1HZ LYS 29 -12.739 -0.531 -5.746 245 2HZ LYS 29 2HZ LYS 29 -11.326 0.364 -5.493 246 3HZ LYS 29 3HZ LYS 29 -12.751 1.149 -5.955 247 H ALA 30 H ALA 30 -9.626 -4.050 -1.946 248 HA ALA 30 HA ALA 30 -8.401 -4.592 -0.113 249 1HB ALA 30 1HB ALA 30 -6.336 -5.159 -0.718 250 2HB ALA 30 2HB ALA 30 -5.874 -3.486 -1.031 251 3HB ALA 30 3HB ALA 30 -6.706 -4.419 -2.275 252 H TYR 31 H TYR 31 -9.485 -3.019 1.217 253 HA TYR 31 HA TYR 31 -7.634 -0.946 2.153 254 1HB TYR 31 1HB TYR 31 -9.441 0.651 2.445 255 2HB TYR 31 2HB TYR 31 -9.371 0.137 0.763 256 HD1 TYR 31 HD1 TYR 31 -11.001 -1.698 0.031 257 HD2 TYR 31 HD2 TYR 31 -11.447 0.510 3.634 258 HE1 TYR 31 HE1 TYR 31 -13.385 -2.302 0.095 259 HE2 TYR 31 HE2 TYR 31 -13.831 -0.087 3.716 260 HH TYR 31 HH TYR 31 -15.443 -1.395 2.826 261 H SER 32 H SER 32 -8.370 -0.097 4.342 262 HA SER 32 HA SER 32 -8.543 -2.296 6.123 263 1HB SER 32 1HB SER 32 -9.112 0.437 7.132 264 2HB SER 32 2HB SER 32 -8.001 -0.791 7.746 265 HG SER 32 HG SER 32 -7.621 1.063 5.665 266 H VAL 33 H VAL 33 -10.172 -2.048 8.074 267 HA VAL 33 HA VAL 33 -12.848 -1.493 7.000 268 HB VAL 33 HB VAL 33 -12.915 -3.747 8.815 269 1HG1 VAL 33 1HG1 VAL 33 -14.057 -4.735 6.730 270 2HG1 VAL 33 2HG1 VAL 33 -13.876 -3.118 6.049 271 3HG1 VAL 33 3HG1 VAL 33 -14.810 -3.352 7.526 272 1HG2 VAL 33 1HG2 VAL 33 -10.635 -4.081 7.742 273 2HG2 VAL 33 2HG2 VAL 33 -11.497 -4.311 6.221 274 3HG2 VAL 33 3HG2 VAL 33 -11.785 -5.407 7.572 275 H ILE 34 H ILE 34 -14.260 -0.583 8.355 276 HA ILE 34 HA ILE 34 -13.263 0.353 10.905 277 HB ILE 34 HB ILE 34 -15.987 0.866 9.723 278 1HG1 ILE 34 1HG1 ILE 34 -13.368 2.260 9.192 279 2HG1 ILE 34 2HG1 ILE 34 -14.451 1.532 8.017 280 1HG2 ILE 34 1HG2 ILE 34 -15.622 1.424 12.107 281 2HG2 ILE 34 2HG2 ILE 34 -15.976 2.833 11.106 282 3HG2 ILE 34 3HG2 ILE 34 -14.321 2.510 11.617 283 1HD1 ILE 34 1HD1 ILE 34 -14.479 4.027 8.090 284 2HD1 ILE 34 2HD1 ILE 34 -15.190 3.911 9.699 285 3HD1 ILE 34 3HD1 ILE 34 -16.052 3.261 8.304 286 H GLN 35 H GLN 35 -13.387 -1.057 12.553 287 HA GLN 35 HA GLN 35 -15.932 -2.497 12.927 288 1HB GLN 35 1HB GLN 35 -13.305 -3.539 12.704 289 2HB GLN 35 2HB GLN 35 -13.803 -3.753 14.376 290 1HG GLN 35 1HG GLN 35 -15.737 -4.991 13.712 291 2HG GLN 35 2HG GLN 35 -15.446 -4.627 12.012 292 1HE2 GLN 35 1HE2 GLN 35 -13.151 -5.619 14.505 293 2HE2 GLN 35 2HE2 GLN 35 -12.676 -7.090 13.736 294 H GLY 36 H GLY 36 -16.865 -0.939 14.240 295 1HA GLY 36 1HA GLY 36 -17.428 -0.037 16.280 296 2HA GLY 36 2HA GLY 36 -16.231 -1.099 17.006 297 H ASN 37 H ASN 37 -13.903 -0.391 16.568 298 HA ASN 37 HA ASN 37 -13.430 2.402 16.148 299 1HB ASN 37 1HB ASN 37 -14.103 1.604 18.775 300 2HB ASN 37 2HB ASN 37 -12.366 1.894 18.776 301 1HD2 ASN 37 1HD2 ASN 37 -11.604 3.941 18.580 302 2HD2 ASN 37 2HD2 ASN 37 -12.614 5.342 18.546 303 H ARG 38 H ARG 38 -12.532 -0.251 15.223 304 HA ARG 38 HA ARG 38 -9.663 0.227 15.465 305 1HB ARG 38 1HB ARG 38 -9.510 -2.413 15.563 306 2HB ARG 38 2HB ARG 38 -9.642 -1.451 17.027 307 1HG ARG 38 1HG ARG 38 -12.219 -1.840 16.636 308 2HG ARG 38 2HG ARG 38 -11.632 -3.235 15.731 309 1HD ARG 38 1HD ARG 38 -11.915 -4.091 17.867 310 2HD ARG 38 2HD ARG 38 -10.197 -3.696 17.830 311 HE ARG 38 HE ARG 38 -10.592 -2.272 19.557 312 1HH1 ARG 38 1HH1 ARG 38 -13.552 -2.612 17.741 313 2HH1 ARG 38 2HH1 ARG 38 -14.457 -1.562 18.776 314 1HH2 ARG 38 1HH2 ARG 38 -11.784 -0.894 20.929 315 2HH2 ARG 38 2HH2 ARG 38 -13.455 -0.589 20.590 316 H THR 39 H THR 39 -8.409 -0.799 13.777 317 HA THR 39 HA THR 39 -10.026 -1.270 11.368 318 HB THR 39 HB THR 39 -7.828 0.451 11.845 319 HG1 THR 39 HG1 THR 39 -8.791 -0.186 9.283 320 1HG2 THR 39 1HG2 THR 39 -6.157 -0.093 10.327 321 2HG2 THR 39 2HG2 THR 39 -7.120 -1.375 9.594 322 3HG2 THR 39 3HG2 THR 39 -6.436 -1.599 11.200 323 H PHE 40 H PHE 40 -10.042 -3.219 10.474 324 HA PHE 40 HA PHE 40 -8.201 -5.258 11.486 325 1HB PHE 40 1HB PHE 40 -10.784 -5.468 11.377 326 2HB PHE 40 2HB PHE 40 -10.525 -5.775 9.668 327 HD1 PHE 40 HD1 PHE 40 -8.240 -7.512 9.541 328 HD2 PHE 40 HD2 PHE 40 -11.369 -7.380 12.418 329 HE1 PHE 40 HE1 PHE 40 -7.897 -9.895 10.030 330 HE2 PHE 40 HE2 PHE 40 -11.025 -9.760 12.912 331 HZ PHE 40 HZ PHE 40 -9.285 -11.025 11.716 332 H ILE 41 H ILE 41 -6.416 -4.350 10.148 333 HA ILE 41 HA ILE 41 -6.548 -4.319 7.341 334 HB ILE 41 HB ILE 41 -4.463 -4.019 9.345 335 1HG1 ILE 41 1HG1 ILE 41 -3.633 -2.385 7.802 336 2HG1 ILE 41 2HG1 ILE 41 -4.527 -3.108 6.468 337 1HG2 ILE 41 1HG2 ILE 41 -3.837 -6.159 7.782 338 2HG2 ILE 41 2HG2 ILE 41 -2.662 -5.074 8.506 339 3HG2 ILE 41 3HG2 ILE 41 -3.171 -4.834 6.836 340 1HD1 ILE 41 1HD1 ILE 41 -6.539 -2.525 8.184 341 2HD1 ILE 41 2HD1 ILE 41 -5.988 -1.466 6.889 342 3HD1 ILE 41 3HD1 ILE 41 -5.403 -1.224 8.535 343 H GLN 42 H GLN 42 -6.774 -5.950 5.972 344 HA GLN 42 HA GLN 42 -5.959 -8.645 6.837 345 1HB GLN 42 1HB GLN 42 -7.576 -9.212 4.792 346 2HB GLN 42 2HB GLN 42 -8.170 -8.999 6.432 347 1HG GLN 42 1HG GLN 42 -8.825 -6.735 5.949 348 2HG GLN 42 2HG GLN 42 -8.114 -6.840 4.339 349 1HE2 GLN 42 1HE2 GLN 42 -10.530 -6.067 4.198 350 2HE2 GLN 42 2HE2 GLN 42 -11.646 -7.321 3.786 351 H ASN 43 H ASN 43 -5.703 -6.206 4.386 352 HA ASN 43 HA ASN 43 -3.948 -7.959 2.809 353 1HB ASN 43 1HB ASN 43 -5.364 -5.421 1.966 354 2HB ASN 43 2HB ASN 43 -4.363 -6.433 0.929 355 1HD2 ASN 43 1HD2 ASN 43 -5.209 -8.247 0.050 356 2HD2 ASN 43 2HD2 ASN 43 -6.858 -8.731 0.232 357 H PHE 44 H PHE 44 -2.952 -6.867 5.155 358 HA PHE 44 HA PHE 44 -1.750 -4.426 5.162 359 1HB PHE 44 1HB PHE 44 -1.611 -6.202 6.959 360 2HB PHE 44 2HB PHE 44 -0.315 -6.937 6.027 361 HD1 PHE 44 HD1 PHE 44 1.584 -6.648 7.318 362 HD2 PHE 44 HD2 PHE 44 -1.013 -3.343 6.654 363 HE1 PHE 44 HE1 PHE 44 3.219 -5.153 8.387 364 HE2 PHE 44 HE2 PHE 44 0.617 -1.841 7.721 365 HZ PHE 44 HZ PHE 44 2.734 -2.751 8.585 366 H ARG 45 H ARG 45 -0.962 -7.088 3.078 367 HA ARG 45 HA ARG 45 1.649 -6.113 2.398 368 1HB ARG 45 1HB ARG 45 0.392 -8.520 2.135 369 2HB ARG 45 2HB ARG 45 0.324 -7.910 0.488 370 1HG ARG 45 1HG ARG 45 2.302 -9.177 0.645 371 2HG ARG 45 2HG ARG 45 2.797 -7.483 0.668 372 1HD ARG 45 1HD ARG 45 3.687 -7.669 2.704 373 2HD ARG 45 2HD ARG 45 2.269 -8.504 3.330 374 HE ARG 45 HE ARG 45 4.469 -9.840 1.889 375 1HH1 ARG 45 1HH1 ARG 45 1.990 -9.834 4.360 376 2HH1 ARG 45 2HH1 ARG 45 2.373 -11.427 4.913 377 1HH2 ARG 45 1HH2 ARG 45 4.962 -11.931 2.624 378 2HH2 ARG 45 2HH2 ARG 45 4.056 -12.617 3.932 379 H GLU 46 H GLU 46 -1.466 -6.258 0.679 380 HA GLU 46 HA GLU 46 -0.505 -4.638 -1.483 381 1HB GLU 46 1HB GLU 46 -2.379 -6.370 -1.605 382 2HB GLU 46 2HB GLU 46 -3.393 -5.152 -0.849 383 1HG GLU 46 1HG GLU 46 -3.608 -5.229 -3.307 384 2HG GLU 46 2HG GLU 46 -3.096 -3.659 -2.696 385 H VAL 47 H VAL 47 -2.509 -4.119 1.367 386 HA VAL 47 HA VAL 47 -3.191 -1.436 0.833 387 HB VAL 47 HB VAL 47 -2.862 -2.624 3.586 388 1HG1 VAL 47 1HG1 VAL 47 -4.409 -0.335 2.438 389 2HG1 VAL 47 2HG1 VAL 47 -3.326 -0.366 3.829 390 3HG1 VAL 47 3HG1 VAL 47 -4.919 -1.113 3.936 391 1HG2 VAL 47 1HG2 VAL 47 -5.557 -2.746 2.568 392 2HG2 VAL 47 2HG2 VAL 47 -4.564 -4.017 3.281 393 3HG2 VAL 47 3HG2 VAL 47 -4.455 -3.678 1.554 394 H ALA 48 H ALA 48 -0.531 -2.907 2.675 395 HA ALA 48 HA ALA 48 0.576 -0.512 3.588 396 1HB ALA 48 1HB ALA 48 1.897 -3.163 3.122 397 2HB ALA 48 2HB ALA 48 1.181 -2.577 4.627 398 3HB ALA 48 3HB ALA 48 2.634 -1.812 3.980 399 H ASP 49 H ASP 49 1.069 -2.293 0.607 400 HA ASP 49 HA ASP 49 3.341 -0.769 -0.237 401 1HB ASP 49 1HB ASP 49 2.568 -3.085 -1.082 402 2HB ASP 49 2HB ASP 49 1.479 -2.181 -2.131 403 H ALA 50 H ALA 50 0.080 -0.858 -1.683 404 HA ALA 50 HA ALA 50 0.226 1.351 -3.247 405 1HB ALA 50 1HB ALA 50 -2.184 1.499 -3.141 406 2HB ALA 50 2HB ALA 50 -2.197 0.510 -1.677 407 3HB ALA 50 3HB ALA 50 -1.665 -0.186 -3.208 408 H LEU 51 H LEU 51 -0.947 1.448 0.144 409 HA LEU 51 HA LEU 51 -1.271 4.244 0.178 410 1HB LEU 51 1HB LEU 51 -2.456 3.278 1.887 411 2HB LEU 51 2HB LEU 51 -1.216 2.087 2.222 412 HG LEU 51 HG LEU 51 0.112 3.772 3.376 413 1HD1 LEU 51 1HD1 LEU 51 -2.103 5.727 3.230 414 2HD1 LEU 51 2HD1 LEU 51 -0.967 5.596 1.892 415 3HD1 LEU 51 3HD1 LEU 51 -0.379 5.983 3.505 416 1HD2 LEU 51 1HD2 LEU 51 -1.844 4.417 5.108 417 2HD2 LEU 51 2HD2 LEU 51 -1.109 2.818 5.035 418 3HD2 LEU 51 3HD2 LEU 51 -2.632 3.114 4.225 419 H ASN 52 H ASN 52 1.497 2.175 0.685 420 HA ASN 52 HA ASN 52 3.275 4.367 0.429 421 1HB ASN 52 1HB ASN 52 2.367 3.834 3.072 422 2HB ASN 52 2HB ASN 52 4.054 3.347 2.978 423 1HD2 ASN 52 1HD2 ASN 52 2.118 5.807 3.772 424 2HD2 ASN 52 2HD2 ASN 52 3.163 7.146 3.456 425 H ARG 53 H ARG 53 4.456 3.279 -1.032 426 HA ARG 53 HA ARG 53 5.033 0.670 -1.338 427 1HB ARG 53 1HB ARG 53 5.811 2.570 -2.785 428 2HB ARG 53 2HB ARG 53 7.133 2.816 -1.652 429 1HG ARG 53 1HG ARG 53 7.382 0.166 -2.191 430 2HG ARG 53 2HG ARG 53 6.779 0.783 -3.729 431 1HD ARG 53 1HD ARG 53 8.770 1.642 -4.220 432 2HD ARG 53 2HD ARG 53 8.796 2.544 -2.705 433 HE ARG 53 HE ARG 53 10.240 0.170 -3.299 434 1HH1 ARG 53 1HH1 ARG 53 8.625 1.863 -0.714 435 2HH1 ARG 53 2HH1 ARG 53 9.572 1.120 0.530 436 1HH2 ARG 53 1HH2 ARG 53 11.497 -0.795 -1.659 437 2HH2 ARG 53 2HH2 ARG 53 11.205 -0.378 -0.004 438 H ASP 54 H ASP 54 6.616 2.820 0.965 439 HA ASP 54 HA ASP 54 8.245 0.593 1.948 440 1HB ASP 54 1HB ASP 54 9.171 2.517 3.467 441 2HB ASP 54 2HB ASP 54 9.657 2.433 1.779 442 HA PRO 55 HA PRO 55 5.357 -0.034 5.263 443 1HB PRO 55 1HB PRO 55 6.869 -1.634 6.834 444 2HB PRO 55 2HB PRO 55 6.147 -2.196 5.323 445 1HG PRO 55 1HG PRO 55 8.947 -1.288 5.861 446 2HG PRO 55 2HG PRO 55 8.384 -2.673 4.908 447 1HD PRO 55 1HD PRO 55 9.166 -0.330 3.780 448 2HD PRO 55 2HD PRO 55 7.927 -1.378 3.061 449 H GLN 56 H GLN 56 8.477 1.409 5.669 450 HA GLN 56 HA GLN 56 8.423 1.931 8.434 451 1HB GLN 56 1HB GLN 56 9.873 3.057 6.084 452 2HB GLN 56 2HB GLN 56 9.920 3.952 7.596 453 1HG GLN 56 1HG GLN 56 10.824 1.990 8.732 454 2HG GLN 56 2HG GLN 56 10.772 1.092 7.215 455 1HE2 GLN 56 1HE2 GLN 56 13.113 1.323 8.582 456 2HE2 GLN 56 2HE2 GLN 56 14.203 2.351 7.721 457 H HIS 57 H HIS 57 7.184 3.735 5.680 458 HA HIS 57 HA HIS 57 6.401 6.012 7.236 459 1HB HIS 57 1HB HIS 57 6.834 5.705 4.615 460 2HB HIS 57 2HB HIS 57 5.096 5.454 4.621 461 HD2 HIS 57 HD2 HIS 57 5.400 8.016 7.210 462 HE1 HIS 57 HE1 HIS 57 5.493 10.233 3.591 463 HE2 HIS 57 HE2 HIS 57 5.339 10.355 6.104 464 H LEU 58 H LEU 58 4.525 3.561 5.494 465 HA LEU 58 HA LEU 58 2.007 4.149 6.324 466 1HB LEU 58 1HB LEU 58 3.026 2.174 4.890 467 2HB LEU 58 2HB LEU 58 2.796 1.283 6.384 468 HG LEU 58 HG LEU 58 0.442 2.812 5.702 469 1HD1 LEU 58 1HD1 LEU 58 1.078 2.574 3.427 470 2HD1 LEU 58 2HD1 LEU 58 -0.176 1.370 3.749 471 3HD1 LEU 58 3HD1 LEU 58 1.521 0.890 3.670 472 1HD2 LEU 58 1HD2 LEU 58 -0.259 1.156 7.018 473 2HD2 LEU 58 2HD2 LEU 58 1.190 0.197 6.719 474 3HD2 LEU 58 3HD2 LEU 58 -0.167 0.120 5.594 475 H LEU 59 H LEU 59 4.368 2.199 8.113 476 HA LEU 59 HA LEU 59 2.640 1.590 10.278 477 1HB LEU 59 1HB LEU 59 5.333 1.045 9.529 478 2HB LEU 59 2HB LEU 59 5.347 1.661 11.168 479 HG LEU 59 HG LEU 59 3.607 -0.085 11.725 480 1HD1 LEU 59 1HD1 LEU 59 2.649 -1.086 9.981 481 2HD1 LEU 59 2HD1 LEU 59 4.135 -2.026 9.843 482 3HD1 LEU 59 3HD1 LEU 59 3.921 -0.567 8.876 483 1HD2 LEU 59 1HD2 LEU 59 5.231 -1.820 12.020 484 2HD2 LEU 59 2HD2 LEU 59 6.040 -0.268 12.240 485 3HD2 LEU 59 3HD2 LEU 59 6.242 -1.162 10.733 486 H LYS 60 H LYS 60 5.110 4.061 9.784 487 HA LYS 60 HA LYS 60 5.017 5.273 12.283 488 1HB LYS 60 1HB LYS 60 5.909 6.020 9.574 489 2HB LYS 60 2HB LYS 60 5.526 7.377 10.625 490 1HG LYS 60 1HG LYS 60 7.195 6.830 12.148 491 2HG LYS 60 2HG LYS 60 7.317 5.171 11.561 492 1HD LYS 60 1HD LYS 60 7.873 7.003 9.422 493 2HD LYS 60 2HD LYS 60 8.881 7.393 10.816 494 1HE LYS 60 1HE LYS 60 8.831 4.558 10.466 495 2HE LYS 60 2HE LYS 60 9.226 5.318 8.926 496 1HZ LYS 60 1HZ LYS 60 10.632 5.721 11.510 497 2HZ LYS 60 2HZ LYS 60 10.969 6.583 10.094 498 3HZ LYS 60 3HZ LYS 60 11.229 4.912 10.149 499 H PHE 61 H PHE 61 3.042 5.826 9.400 500 HA PHE 61 HA PHE 61 1.563 7.998 10.488 501 1HB PHE 61 1HB PHE 61 1.862 7.052 7.993 502 2HB PHE 61 2HB PHE 61 0.324 6.296 8.392 503 HD1 PHE 61 HD1 PHE 61 -0.836 8.449 10.121 504 HD2 PHE 61 HD2 PHE 61 1.229 8.644 6.407 505 HE1 PHE 61 HE1 PHE 61 -1.994 10.551 9.597 506 HE2 PHE 61 HE2 PHE 61 0.074 10.750 5.874 507 HZ PHE 61 HZ PHE 61 -1.540 11.706 7.470 508 H LEU 62 H LEU 62 1.098 4.506 10.420 509 HA LEU 62 HA LEU 62 -1.552 4.369 11.258 510 1HB LEU 62 1HB LEU 62 0.192 2.519 10.573 511 2HB LEU 62 2HB LEU 62 0.474 2.430 12.301 512 HG LEU 62 HG LEU 62 -2.153 2.175 12.386 513 1HD1 LEU 62 1HD1 LEU 62 -2.399 0.516 10.217 514 2HD1 LEU 62 2HD1 LEU 62 -1.510 1.890 9.558 515 3HD1 LEU 62 3HD1 LEU 62 -3.065 2.144 10.350 516 1HD2 LEU 62 1HD2 LEU 62 -1.291 -0.392 11.572 517 2HD2 LEU 62 2HD2 LEU 62 -1.468 0.232 13.211 518 3HD2 LEU 62 3HD2 LEU 62 0.073 0.392 12.369 519 H LEU 63 H LEU 63 1.401 4.279 13.276 520 HA LEU 63 HA LEU 63 -0.049 4.395 15.728 521 1HB LEU 63 1HB LEU 63 2.857 5.047 15.252 522 2HB LEU 63 2HB LEU 63 2.115 4.627 16.783 523 HG LEU 63 HG LEU 63 2.344 2.764 14.417 524 1HD1 LEU 63 1HD1 LEU 63 3.853 1.694 16.417 525 2HD1 LEU 63 2HD1 LEU 63 4.181 3.417 16.598 526 3HD1 LEU 63 3HD1 LEU 63 4.484 2.620 15.054 527 1HD2 LEU 63 1HD2 LEU 63 0.615 1.814 15.524 528 2HD2 LEU 63 2HD2 LEU 63 1.016 2.601 17.051 529 3HD2 LEU 63 3HD2 LEU 63 1.916 1.176 16.530 530 H ARG 64 H ARG 64 1.371 6.783 13.616 531 HA ARG 64 HA ARG 64 1.424 8.965 15.393 532 1HB ARG 64 1HB ARG 64 2.113 8.599 12.754 533 2HB ARG 64 2HB ARG 64 0.749 9.698 12.642 534 1HG ARG 64 1HG ARG 64 2.416 11.216 12.848 535 2HG ARG 64 2HG ARG 64 2.074 10.954 14.558 536 1HD ARG 64 1HD ARG 64 4.014 9.800 14.908 537 2HD ARG 64 2HD ARG 64 4.057 9.167 13.262 538 HE ARG 64 HE ARG 64 5.387 11.468 14.193 539 1HH1 ARG 64 1HH1 ARG 64 3.537 10.322 11.472 540 2HH1 ARG 64 2HH1 ARG 64 4.317 11.366 10.336 541 1HH2 ARG 64 1HH2 ARG 64 6.420 12.857 12.698 542 2HH2 ARG 64 2HH2 ARG 64 5.955 12.806 11.030 543 H GLU 65 H GLU 65 -1.187 7.547 13.559 544 HA GLU 65 HA GLU 65 -2.991 9.704 14.398 545 1HB GLU 65 1HB GLU 65 -2.864 7.921 12.108 546 2HB GLU 65 2HB GLU 65 -4.457 7.925 12.844 547 1HG GLU 65 1HG GLU 65 -3.197 10.556 12.394 548 2HG GLU 65 2HG GLU 65 -3.709 9.661 10.965 549 H LEU 66 H LEU 66 -2.344 6.294 14.784 550 HA LEU 66 HA LEU 66 -4.730 5.464 15.957 551 1HB LEU 66 1HB LEU 66 -2.002 4.483 15.760 552 2HB LEU 66 2HB LEU 66 -2.736 4.052 17.290 553 HG LEU 66 HG LEU 66 -4.569 2.945 16.130 554 1HD1 LEU 66 1HD1 LEU 66 -3.702 4.493 13.924 555 2HD1 LEU 66 2HD1 LEU 66 -5.109 3.438 14.046 556 3HD1 LEU 66 3HD1 LEU 66 -3.567 2.791 13.485 557 1HD2 LEU 66 1HD2 LEU 66 -1.819 2.142 16.025 558 2HD2 LEU 66 2HD2 LEU 66 -2.699 1.488 14.644 559 3HD2 LEU 66 3HD2 LEU 66 -3.264 1.165 16.283 560 H GLY 67 H GLY 67 -5.574 6.974 17.382 561 1HA GLY 67 1HA GLY 67 -4.042 8.046 19.558 562 2HA GLY 67 2HA GLY 67 -5.774 8.216 19.318 563 H THR 68 H THR 68 -5.211 4.998 19.107 564 HA THR 68 HA THR 68 -5.722 4.605 21.971 565 HB THR 68 HB THR 68 -7.281 3.001 21.527 566 HG1 THR 68 HG1 THR 68 -5.519 2.191 19.628 567 1HG2 THR 68 1HG2 THR 68 -8.314 3.407 19.135 568 2HG2 THR 68 2HG2 THR 68 -7.299 4.845 19.218 569 3HG2 THR 68 3HG2 THR 68 -8.517 4.554 20.458 570 H ALA 69 H ALA 69 -5.113 2.317 22.682 571 HA ALA 69 HA ALA 69 -2.586 1.881 23.119 572 1HB ALA 69 1HB ALA 69 -4.282 -0.402 22.126 573 2HB ALA 69 2HB ALA 69 -4.404 0.314 23.734 574 3HB ALA 69 3HB ALA 69 -2.916 -0.491 23.238 575 H GLY 70 H GLY 70 -3.939 0.493 20.113 576 1HA GLY 70 1HA GLY 70 -2.970 0.359 18.014 577 2HA GLY 70 2HA GLY 70 -1.582 1.235 18.639 578 H ASN 71 H ASN 71 -2.957 -1.862 17.975 579 HA ASN 71 HA ASN 71 -0.379 -3.105 18.044 580 1HB ASN 71 1HB ASN 71 -1.439 -3.101 20.483 581 2HB ASN 71 2HB ASN 71 -2.323 -4.482 19.840 582 1HD2 ASN 71 1HD2 ASN 71 0.086 -3.898 21.748 583 2HD2 ASN 71 2HD2 ASN 71 1.202 -5.146 21.322 584 H LEU 72 H LEU 72 -0.571 -5.483 17.496 585 HA LEU 72 HA LEU 72 -2.600 -5.748 15.428 586 1HB LEU 72 1HB LEU 72 -1.079 -8.064 15.354 587 2HB LEU 72 2HB LEU 72 -0.896 -6.660 14.325 588 HG LEU 72 HG LEU 72 0.648 -5.840 16.327 589 1HD1 LEU 72 1HD1 LEU 72 1.082 -8.806 16.432 590 2HD1 LEU 72 2HD1 LEU 72 0.065 -7.960 17.599 591 3HD1 LEU 72 3HD1 LEU 72 1.776 -7.555 17.462 592 1HD2 LEU 72 1HD2 LEU 72 2.310 -7.618 14.925 593 2HD2 LEU 72 2HD2 LEU 72 2.039 -5.904 14.611 594 3HD2 LEU 72 3HD2 LEU 72 1.045 -7.116 13.804 595 H GLU 73 H GLU 73 -4.457 -6.725 15.828 596 HA GLU 73 HA GLU 73 -4.606 -8.656 18.036 597 1HB GLU 73 1HB GLU 73 -6.329 -6.542 17.131 598 2HB GLU 73 2HB GLU 73 -7.198 -8.065 17.078 599 1HG GLU 73 1HG GLU 73 -5.664 -7.272 19.513 600 2HG GLU 73 2HG GLU 73 -7.276 -6.626 19.209 601 H GLY 74 H GLY 74 -5.796 -10.610 17.755 602 1HA GLY 74 1HA GLY 74 -6.303 -12.548 16.641 603 2HA GLY 74 2HA GLY 74 -6.928 -11.508 15.371 604 H GLY 75 H GLY 75 -5.943 -13.755 14.466 605 1HA GLY 75 1HA GLY 75 -3.190 -13.982 14.053 606 2HA GLY 75 2HA GLY 75 -4.424 -14.645 12.993 607 H ARG 76 H ARG 76 -5.439 -11.768 12.660 608 HA ARG 76 HA ARG 76 -3.623 -11.118 10.458 609 1HB ARG 76 1HB ARG 76 -6.410 -11.120 10.713 610 2HB ARG 76 2HB ARG 76 -5.967 -9.420 10.662 611 1HG ARG 76 1HG ARG 76 -5.410 -9.502 8.499 612 2HG ARG 76 2HG ARG 76 -4.623 -11.074 8.652 613 1HD ARG 76 1HD ARG 76 -7.564 -10.507 8.345 614 2HD ARG 76 2HD ARG 76 -6.508 -11.339 7.212 615 HE ARG 76 HE ARG 76 -7.482 -12.407 9.769 616 1HH1 ARG 76 1HH1 ARG 76 -5.913 -12.898 6.684 617 2HH1 ARG 76 2HH1 ARG 76 -5.957 -14.622 6.803 618 1HH2 ARG 76 1HH2 ARG 76 -7.521 -14.670 9.924 619 2HH2 ARG 76 2HH2 ARG 76 -6.866 -15.629 8.638 620 H ALA 77 H ALA 77 -4.350 -8.354 10.237 621 HA ALA 77 HA ALA 77 -2.829 -7.295 12.524 622 1HB ALA 77 1HB ALA 77 -2.653 -6.865 9.679 623 2HB ALA 77 2HB ALA 77 -1.535 -6.393 10.958 624 3HB ALA 77 3HB ALA 77 -2.883 -5.339 10.533 625 H ILE 78 H ILE 78 -4.966 -7.369 13.662 626 HA ILE 78 HA ILE 78 -6.851 -5.295 12.866 627 HB ILE 78 HB ILE 78 -7.072 -6.920 15.376 628 1HG1 ILE 78 1HG1 ILE 78 -8.317 -7.847 12.818 629 2HG1 ILE 78 2HG1 ILE 78 -6.658 -8.301 13.189 630 1HG2 ILE 78 1HG2 ILE 78 -8.737 -5.342 15.397 631 2HG2 ILE 78 2HG2 ILE 78 -9.552 -6.688 14.603 632 3HG2 ILE 78 3HG2 ILE 78 -8.915 -5.354 13.642 633 1HD1 ILE 78 1HD1 ILE 78 -8.122 -8.841 15.505 634 2HD1 ILE 78 2HD1 ILE 78 -7.453 -9.995 14.353 635 3HD1 ILE 78 3HD1 ILE 78 -9.106 -9.416 14.161 636 H LEU 79 H LEU 79 -5.667 -3.409 13.218 637 HA LEU 79 HA LEU 79 -4.536 -2.871 15.825 638 1HB LEU 79 1HB LEU 79 -3.821 -0.764 14.881 639 2HB LEU 79 2HB LEU 79 -3.421 -2.078 13.788 640 HG LEU 79 HG LEU 79 -5.813 -1.364 12.786 641 1HD1 LEU 79 1HD1 LEU 79 -6.316 0.451 14.171 642 2HD1 LEU 79 2HD1 LEU 79 -5.721 1.174 12.676 643 3HD1 LEU 79 3HD1 LEU 79 -4.669 1.080 14.089 644 1HD2 LEU 79 1HD2 LEU 79 -3.944 0.396 11.602 645 2HD2 LEU 79 2HD2 LEU 79 -4.472 -1.187 11.029 646 3HD2 LEU 79 3HD2 LEU 79 -3.072 -1.056 12.093 647 H GLN 80 H GLN 80 -5.015 -0.478 16.601 648 HA GLN 80 HA GLN 80 -7.885 0.085 16.492 649 1HB GLN 80 1HB GLN 80 -7.717 0.490 19.048 650 2HB GLN 80 2HB GLN 80 -7.908 -1.159 18.465 651 1HG GLN 80 1HG GLN 80 -5.205 -0.936 18.546 652 2HG GLN 80 2HG GLN 80 -5.684 0.107 19.881 653 1HE2 GLN 80 1HE2 GLN 80 -6.238 -0.789 21.754 654 2HE2 GLN 80 2HE2 GLN 80 -6.445 -2.482 22.025 655 H GLY 81 H GLY 81 -8.096 2.165 15.964 656 1HA GLY 81 1HA GLY 81 -6.954 4.282 17.404 657 2HA GLY 81 2HA GLY 81 -5.963 4.001 15.990 658 H LYS 82 H LYS 82 -6.418 5.221 14.330 659 HA LYS 82 HA LYS 82 -9.208 5.877 13.745 660 1HB LYS 82 1HB LYS 82 -7.924 7.734 15.032 661 2HB LYS 82 2HB LYS 82 -7.097 7.998 13.506 662 1HG LYS 82 1HG LYS 82 -8.765 9.291 12.848 663 2HG LYS 82 2HG LYS 82 -9.853 7.905 12.927 664 1HD LYS 82 1HD LYS 82 -9.505 8.765 15.578 665 2HD LYS 82 2HD LYS 82 -9.730 10.228 14.619 666 1HE LYS 82 1HE LYS 82 -11.848 9.263 15.490 667 2HE LYS 82 2HE LYS 82 -11.799 9.406 13.733 668 1HZ LYS 82 1HZ LYS 82 -10.805 6.895 14.330 669 2HZ LYS 82 2HZ LYS 82 -12.306 7.264 13.647 670 3HZ LYS 82 3HZ LYS 82 -12.161 7.090 15.323 671 H PHE 83 H PHE 83 -6.951 4.148 12.645 672 HA PHE 83 HA PHE 83 -6.627 5.310 9.982 673 1HB PHE 83 1HB PHE 83 -5.103 3.460 11.610 674 2HB PHE 83 2HB PHE 83 -5.424 2.772 10.019 675 HD1 PHE 83 HD1 PHE 83 -3.909 3.196 8.380 676 HD2 PHE 83 HD2 PHE 83 -4.367 6.031 11.508 677 HE1 PHE 83 HE1 PHE 83 -2.120 4.556 7.392 678 HE2 PHE 83 HE2 PHE 83 -2.575 7.403 10.525 679 HZ PHE 83 HZ PHE 83 -1.457 6.666 8.465 680 H THR 84 H THR 84 -9.201 4.767 10.554 681 HA THR 84 HA THR 84 -10.034 2.172 9.690 682 HB THR 84 HB THR 84 -12.292 3.458 9.555 683 HG1 THR 84 HG1 THR 84 -11.056 5.315 11.225 684 1HG2 THR 84 1HG2 THR 84 -11.652 1.981 11.430 685 2HG2 THR 84 2HG2 THR 84 -12.624 3.368 11.930 686 3HG2 THR 84 3HG2 THR 84 -10.883 3.366 12.206 687 H HIS 85 H HIS 85 -8.640 2.290 7.736 688 HA HIS 85 HA HIS 85 -8.227 2.656 5.515 689 1HB HIS 85 1HB HIS 85 -10.035 1.981 4.086 690 2HB HIS 85 2HB HIS 85 -10.162 1.046 5.572 691 HD2 HIS 85 HD2 HIS 85 -12.598 1.202 6.794 692 HE1 HIS 85 HE1 HIS 85 -14.111 4.508 4.602 693 HE2 HIS 85 HE2 HIS 85 -14.607 2.776 6.366 694 H PHE 86 H PHE 86 -8.464 5.036 6.993 695 HA PHE 86 HA PHE 86 -9.931 6.874 5.279 696 1HB PHE 86 1HB PHE 86 -9.126 6.862 8.032 697 2HB PHE 86 2HB PHE 86 -8.478 8.300 7.248 698 HD1 PHE 86 HD1 PHE 86 -11.665 6.371 7.017 699 HD2 PHE 86 HD2 PHE 86 -9.785 10.146 7.582 700 HE1 PHE 86 HE1 PHE 86 -13.874 7.444 7.160 701 HE2 PHE 86 HE2 PHE 86 -11.989 11.227 7.729 702 HZ PHE 86 HZ PHE 86 -14.038 9.875 7.517 703 H LEU 87 H LEU 87 -6.778 7.258 6.808 704 HA LEU 87 HA LEU 87 -5.713 8.787 4.685 705 1HB LEU 87 1HB LEU 87 -4.517 7.413 7.078 706 2HB LEU 87 2HB LEU 87 -3.490 8.183 5.887 707 HG LEU 87 HG LEU 87 -3.897 9.611 7.851 708 1HD1 LEU 87 1HD1 LEU 87 -4.929 11.579 6.474 709 2HD1 LEU 87 2HD1 LEU 87 -4.762 10.450 5.130 710 3HD1 LEU 87 3HD1 LEU 87 -3.344 10.925 6.065 711 1HD2 LEU 87 1HD2 LEU 87 -6.748 9.188 7.082 712 2HD2 LEU 87 2HD2 LEU 87 -6.265 10.704 7.831 713 3HD2 LEU 87 3HD2 LEU 87 -5.998 9.179 8.677 714 H ILE 88 H ILE 88 -5.748 5.382 5.435 715 HA ILE 88 HA ILE 88 -3.689 4.515 3.743 716 HB ILE 88 HB ILE 88 -6.186 2.999 4.496 717 1HG1 ILE 88 1HG1 ILE 88 -3.584 3.397 5.998 718 2HG1 ILE 88 2HG1 ILE 88 -5.216 3.768 6.541 719 1HG2 ILE 88 1HG2 ILE 88 -3.941 2.307 2.890 720 2HG2 ILE 88 2HG2 ILE 88 -5.339 1.325 3.327 721 3HG2 ILE 88 3HG2 ILE 88 -3.910 1.334 4.360 722 1HD1 ILE 88 1HD1 ILE 88 -4.241 0.978 5.982 723 2HD1 ILE 88 2HD1 ILE 88 -5.747 1.458 6.759 724 3HD1 ILE 88 3HD1 ILE 88 -4.213 1.736 7.571 725 H ASN 89 H ASN 89 -7.192 4.257 3.181 726 HA ASN 89 HA ASN 89 -7.056 3.453 0.535 727 1HB ASN 89 1HB ASN 89 -9.080 3.784 2.260 728 2HB ASN 89 2HB ASN 89 -9.314 5.232 1.286 729 1HD2 ASN 89 1HD2 ASN 89 -8.186 2.010 0.367 730 2HD2 ASN 89 2HD2 ASN 89 -9.444 1.705 -0.773 731 H GLU 90 H GLU 90 -7.253 6.768 1.809 732 HA GLU 90 HA GLU 90 -7.582 8.137 -0.570 733 1HB GLU 90 1HB GLU 90 -7.698 9.207 1.618 734 2HB GLU 90 2HB GLU 90 -5.975 8.954 1.850 735 1HG GLU 90 1HG GLU 90 -5.494 10.440 -0.022 736 2HG GLU 90 2HG GLU 90 -7.222 10.695 -0.267 737 H ARG 91 H ARG 91 -4.458 7.459 1.038 738 HA ARG 91 HA ARG 91 -2.837 8.451 -1.022 739 1HB ARG 91 1HB ARG 91 -2.387 7.413 1.465 740 2HB ARG 91 2HB ARG 91 -1.769 6.135 0.431 741 1HG ARG 91 1HG ARG 91 0.119 7.264 0.254 742 2HG ARG 91 2HG ARG 91 -0.755 8.510 -0.637 743 1HD ARG 91 1HD ARG 91 -1.415 9.267 1.818 744 2HD ARG 91 2HD ARG 91 0.093 8.441 2.211 745 HE ARG 91 HE ARG 91 1.177 10.257 1.383 746 1HH1 ARG 91 1HH1 ARG 91 -1.929 10.040 -0.192 747 2HH1 ARG 91 2HH1 ARG 91 -1.684 11.462 -1.148 748 1HH2 ARG 91 1HH2 ARG 91 1.500 12.131 0.125 749 2HH2 ARG 91 2HH2 ARG 91 0.262 12.648 -0.969 750 H ILE 92 H ILE 92 -4.037 5.175 -0.390 751 HA ILE 92 HA ILE 92 -2.709 3.779 -2.381 752 HB ILE 92 HB ILE 92 -5.480 3.414 -1.243 753 1HG1 ILE 92 1HG1 ILE 92 -2.974 1.816 -0.756 754 2HG1 ILE 92 2HG1 ILE 92 -3.428 3.201 0.220 755 1HG2 ILE 92 1HG2 ILE 92 -5.663 1.280 -2.229 756 2HG2 ILE 92 2HG2 ILE 92 -4.001 1.319 -2.807 757 3HG2 ILE 92 3HG2 ILE 92 -5.209 2.372 -3.536 758 1HD1 ILE 92 1HD1 ILE 92 -5.035 0.681 -0.116 759 2HD1 ILE 92 2HD1 ILE 92 -5.480 2.070 0.880 760 3HD1 ILE 92 3HD1 ILE 92 -4.052 1.114 1.285 761 H GLU 93 H GLU 93 -5.984 5.162 -2.591 762 HA GLU 93 HA GLU 93 -6.393 4.697 -5.311 763 1HB GLU 93 1HB GLU 93 -8.115 5.408 -3.612 764 2HB GLU 93 2HB GLU 93 -7.498 7.047 -3.772 765 1HG GLU 93 1HG GLU 93 -7.973 6.738 -6.286 766 2HG GLU 93 2HG GLU 93 -8.981 5.387 -5.767 767 H ASP 94 H ASP 94 -4.619 7.225 -3.700 768 HA ASP 94 HA ASP 94 -4.504 9.092 -5.792 769 1HB ASP 94 1HB ASP 94 -3.316 8.761 -3.214 770 2HB ASP 94 2HB ASP 94 -2.043 9.164 -4.363 771 H TYR 95 H TYR 95 -2.232 6.495 -4.912 772 HA TYR 95 HA TYR 95 -0.706 6.955 -7.323 773 1HB TYR 95 1HB TYR 95 -0.050 5.996 -4.819 774 2HB TYR 95 2HB TYR 95 -0.047 4.541 -5.811 775 HD1 TYR 95 HD1 TYR 95 0.785 6.103 -8.381 776 HD2 TYR 95 HD2 TYR 95 2.345 5.929 -4.428 777 HE1 TYR 95 HE1 TYR 95 3.007 6.693 -9.242 778 HE2 TYR 95 HE2 TYR 95 4.576 6.523 -5.280 779 HH TYR 95 HH TYR 95 5.611 7.545 -7.161 780 H VAL 96 H VAL 96 -2.327 4.097 -5.910 781 HA VAL 96 HA VAL 96 -2.163 2.441 -8.119 782 HB VAL 96 HB VAL 96 -4.451 2.556 -6.148 783 1HG1 VAL 96 1HG1 VAL 96 -3.587 0.019 -7.406 784 2HG1 VAL 96 2HG1 VAL 96 -4.472 1.153 -8.425 785 3HG1 VAL 96 3HG1 VAL 96 -5.196 0.560 -6.931 786 1HG2 VAL 96 1HG2 VAL 96 -3.208 0.828 -4.922 787 2HG2 VAL 96 2HG2 VAL 96 -2.310 2.343 -5.012 788 3HG2 VAL 96 3HG2 VAL 96 -1.870 0.994 -6.059 789 H ASN 97 H ASN 97 -4.670 4.839 -7.334 790 HA ASN 97 HA ASN 97 -5.769 4.442 -10.026 791 1HB ASN 97 1HB ASN 97 -7.131 5.722 -7.655 792 2HB ASN 97 2HB ASN 97 -7.859 5.354 -9.214 793 1HD2 ASN 97 1HD2 ASN 97 -8.145 3.152 -9.795 794 2HD2 ASN 97 2HD2 ASN 97 -8.292 1.936 -8.577 795 H LYS 98 H LYS 98 -3.518 5.868 -10.014 796 HA LYS 98 HA LYS 98 -4.073 8.684 -9.737 797 1HB LYS 98 1HB LYS 98 -1.823 9.047 -10.096 798 2HB LYS 98 2HB LYS 98 -1.800 7.426 -9.422 799 1HG LYS 98 1HG LYS 98 -1.895 7.765 -12.387 800 2HG LYS 98 2HG LYS 98 -0.380 8.022 -11.529 801 1HD LYS 98 1HD LYS 98 -1.872 5.567 -10.845 802 2HD LYS 98 2HD LYS 98 -1.170 5.630 -12.458 803 1HE LYS 98 1HE LYS 98 0.794 6.594 -10.684 804 2HE LYS 98 2HE LYS 98 0.112 5.148 -9.944 805 1HZ LYS 98 1HZ LYS 98 1.733 5.411 -12.323 806 2HZ LYS 98 2HZ LYS 98 0.427 4.347 -12.474 807 3HZ LYS 98 3HZ LYS 98 1.576 4.107 -11.256 808 H PHE 99 H PHE 99 -4.711 6.361 -12.081 809 HA PHE 99 HA PHE 99 -4.301 7.965 -14.395 810 1HB PHE 99 1HB PHE 99 -5.756 6.214 -15.526 811 2HB PHE 99 2HB PHE 99 -4.257 5.651 -14.806 812 HD1 PHE 99 HD1 PHE 99 -4.366 4.465 -12.573 813 HD2 PHE 99 HD2 PHE 99 -7.813 5.310 -14.917 814 HE1 PHE 99 HE1 PHE 99 -5.617 2.732 -11.354 815 HE2 PHE 99 HE2 PHE 99 -9.072 3.587 -13.695 816 HZ PHE 99 HZ PHE 99 -7.974 2.294 -11.911 817 H VAL 100 H VAL 100 -7.287 7.008 -12.653 818 HA VAL 100 HA VAL 100 -8.822 8.901 -14.211 819 HB VAL 100 HB VAL 100 -9.693 7.259 -11.827 820 1HG1 VAL 100 1HG1 VAL 100 -11.814 7.922 -13.619 821 2HG1 VAL 100 2HG1 VAL 100 -10.976 9.401 -13.160 822 3HG1 VAL 100 3HG1 VAL 100 -11.632 8.339 -11.916 823 1HG2 VAL 100 1HG2 VAL 100 -9.660 5.513 -13.198 824 2HG2 VAL 100 2HG2 VAL 100 -9.168 6.527 -14.554 825 3HG2 VAL 100 3HG2 VAL 100 -10.879 6.313 -14.188 826 H ILE 101 H ILE 101 -7.033 8.973 -11.300 827 HA ILE 101 HA ILE 101 -8.523 11.242 -10.236 828 HB ILE 101 HB ILE 101 -6.310 9.529 -9.145 829 1HG1 ILE 101 1HG1 ILE 101 -7.969 9.337 -7.253 830 2HG1 ILE 101 2HG1 ILE 101 -9.104 10.252 -8.237 831 1HG2 ILE 101 1HG2 ILE 101 -6.859 11.244 -7.093 832 2HG2 ILE 101 2HG2 ILE 101 -6.861 12.327 -8.483 833 3HG2 ILE 101 3HG2 ILE 101 -5.443 11.334 -8.140 834 1HD1 ILE 101 1HD1 ILE 101 -8.570 8.341 -9.982 835 2HD1 ILE 101 2HD1 ILE 101 -9.781 8.143 -8.720 836 3HD1 ILE 101 3HD1 ILE 101 -8.170 7.455 -8.514 837 H CYS 102 H CYS 102 -5.189 10.496 -11.291 838 HA CYS 102 HA CYS 102 -4.487 13.307 -11.197 839 1HB CYS 102 1HB CYS 102 -2.904 11.422 -10.575 840 2HB CYS 102 2HB CYS 102 -2.794 11.067 -12.295 841 H HIS 103 H HIS 103 -6.400 11.869 -13.247 842 HA HIS 103 HA HIS 103 -7.031 12.199 -15.398 843 1HB HIS 103 1HB HIS 103 -5.162 14.561 -15.160 844 2HB HIS 103 2HB HIS 103 -6.286 14.305 -16.491 845 HD2 HIS 103 HD2 HIS 103 -8.949 13.548 -14.736 846 HE1 HIS 103 HE1 HIS 103 -8.271 17.298 -12.870 847 HE2 HIS 103 HE2 HIS 103 -9.964 15.501 -13.377 848 H GLU 104 H GLU 104 -5.166 10.244 -15.119 849 HA GLU 104 HA GLU 104 -3.522 9.051 -16.158 850 1HB GLU 104 1HB GLU 104 -5.485 9.792 -17.990 851 2HB GLU 104 2HB GLU 104 -3.973 10.124 -18.826 852 1HG GLU 104 1HG GLU 104 -3.236 7.834 -18.402 853 2HG GLU 104 2HG GLU 104 -4.754 7.503 -17.568 854 H CYS 105 H CYS 105 -1.886 10.397 -15.082 855 HA CYS 105 HA CYS 105 -0.641 12.537 -16.509 856 1HB CYS 105 1HB CYS 105 -0.643 11.799 -13.917 857 2HB CYS 105 2HB CYS 105 0.889 11.097 -14.420 858 H ASN 106 H ASN 106 -0.689 10.707 -18.421 859 HA ASN 106 HA ASN 106 1.582 8.985 -18.451 860 1HB ASN 106 1HB ASN 106 -0.749 9.056 -19.852 861 2HB ASN 106 2HB ASN 106 0.358 9.730 -21.038 862 1HD2 ASN 106 1HD2 ASN 106 0.800 8.190 -22.422 863 2HD2 ASN 106 2HD2 ASN 106 1.284 6.579 -22.027 864 H ARG 107 H ARG 107 1.032 11.197 -21.132 865 HA ARG 107 HA ARG 107 3.767 12.195 -20.779 866 1HB ARG 107 1HB ARG 107 3.521 12.799 -23.260 867 2HB ARG 107 2HB ARG 107 3.737 11.110 -22.834 868 1HG ARG 107 1HG ARG 107 1.984 10.719 -24.149 869 2HG ARG 107 2HG ARG 107 0.999 11.384 -22.849 870 1HD ARG 107 1HD ARG 107 1.825 13.643 -24.128 871 2HD ARG 107 2HD ARG 107 1.679 12.509 -25.468 872 HE ARG 107 HE ARG 107 -0.447 13.700 -23.992 873 1HH1 ARG 107 1HH1 ARG 107 0.472 10.807 -25.716 874 2HH1 ARG 107 2HH1 ARG 107 -1.159 10.356 -26.083 875 1HH2 ARG 107 1HH2 ARG 107 -2.595 13.112 -24.478 876 2HH2 ARG 107 2HH2 ARG 107 -2.902 11.666 -25.381 877 HA PRO 108 HA PRO 108 0.596 15.768 -20.162 878 1HB PRO 108 1HB PRO 108 2.541 16.266 -17.965 879 2HB PRO 108 2HB PRO 108 0.784 16.447 -17.976 880 1HG PRO 108 1HG PRO 108 1.969 14.384 -16.751 881 2HG PRO 108 2HG PRO 108 0.414 14.209 -17.583 882 1HD PRO 108 1HD PRO 108 3.117 13.290 -18.406 883 2HD PRO 108 2HD PRO 108 1.523 12.594 -18.750 884 H ASP 109 H ASP 109 0.999 17.726 -21.081 885 HA ASP 109 HA ASP 109 3.656 18.217 -22.121 886 1HB ASP 109 1HB ASP 109 1.406 18.559 -23.360 887 2HB ASP 109 2HB ASP 109 1.291 20.055 -22.439 888 H THR 110 H THR 110 3.049 18.440 -19.213 889 HA THR 110 HA THR 110 3.818 21.241 -18.791 890 HB THR 110 HB THR 110 1.639 20.727 -17.815 891 HG1 THR 110 HG1 THR 110 3.336 20.813 -15.591 892 1HG2 THR 110 1HG2 THR 110 2.986 18.331 -16.857 893 2HG2 THR 110 2HG2 THR 110 1.269 18.656 -17.098 894 3HG2 THR 110 3HG2 THR 110 2.067 19.178 -15.614 895 H ARG 111 H ARG 111 4.958 21.401 -16.518 896 HA ARG 111 HA ARG 111 7.292 19.688 -16.751 897 1HB ARG 111 1HB ARG 111 6.700 22.326 -15.612 898 2HB ARG 111 2HB ARG 111 7.806 21.363 -14.641 899 1HG ARG 111 1HG ARG 111 8.552 21.208 -17.404 900 2HG ARG 111 2HG ARG 111 8.394 22.894 -16.911 901 1HD ARG 111 1HD ARG 111 10.226 22.803 -15.628 902 2HD ARG 111 2HD ARG 111 9.771 21.244 -14.941 903 HE ARG 111 HE ARG 111 10.757 21.134 -17.653 904 1HH1 ARG 111 1HH1 ARG 111 11.588 21.000 -14.265 905 2HH1 ARG 111 2HH1 ARG 111 13.057 20.127 -14.532 906 1HH2 ARG 111 1HH2 ARG 111 12.690 19.986 -18.004 907 2HH2 ARG 111 2HH2 ARG 111 13.684 19.551 -16.654 908 H ILE 112 H ILE 112 6.884 17.743 -15.904 909 HA ILE 112 HA ILE 112 5.821 17.578 -13.170 910 HB ILE 112 HB ILE 112 6.227 15.320 -15.134 911 1HG1 ILE 112 1HG1 ILE 112 4.546 16.882 -15.975 912 2HG1 ILE 112 2HG1 ILE 112 3.779 15.393 -15.435 913 1HG2 ILE 112 1HG2 ILE 112 4.943 15.504 -12.425 914 2HG2 ILE 112 2HG2 ILE 112 6.234 14.428 -12.959 915 3HG2 ILE 112 3HG2 ILE 112 4.589 14.191 -13.550 916 1HD1 ILE 112 1HD1 ILE 112 3.884 17.986 -13.911 917 2HD1 ILE 112 2HD1 ILE 112 3.123 16.494 -13.355 918 3HD1 ILE 112 3HD1 ILE 112 2.489 17.331 -14.772 919 H ILE 113 H ILE 113 7.007 16.822 -11.512 920 HA ILE 113 HA ILE 113 9.624 15.615 -12.064 921 HB ILE 113 HB ILE 113 10.615 17.012 -10.215 922 1HG1 ILE 113 1HG1 ILE 113 9.079 19.337 -10.410 923 2HG1 ILE 113 2HG1 ILE 113 7.899 18.048 -10.201 924 1HG2 ILE 113 1HG2 ILE 113 11.546 18.165 -11.865 925 2HG2 ILE 113 2HG2 ILE 113 10.073 19.107 -12.099 926 3HG2 ILE 113 3HG2 ILE 113 10.282 17.573 -12.943 927 1HD1 ILE 113 1HD1 ILE 113 10.234 17.999 -8.399 928 2HD1 ILE 113 2HD1 ILE 113 8.540 17.627 -8.080 929 3HD1 ILE 113 3HD1 ILE 113 9.073 19.306 -8.165 930 H ARG 114 H ARG 114 10.195 14.029 -10.645 931 HA ARG 114 HA ARG 114 8.466 13.641 -8.298 932 1HB ARG 114 1HB ARG 114 7.707 11.904 -9.581 933 2HB ARG 114 2HB ARG 114 9.200 11.757 -10.463 934 1HG ARG 114 1HG ARG 114 10.095 10.822 -8.182 935 2HG ARG 114 2HG ARG 114 8.380 10.473 -7.940 936 1HD ARG 114 1HD ARG 114 9.592 8.599 -9.009 937 2HD ARG 114 2HD ARG 114 8.301 9.239 -10.019 938 HE ARG 114 HE ARG 114 10.623 10.552 -10.751 939 1HH1 ARG 114 1HH1 ARG 114 9.411 7.280 -10.732 940 2HH1 ARG 114 2HH1 ARG 114 10.373 6.783 -12.082 941 1HH2 ARG 114 1HH2 ARG 114 11.886 9.902 -12.525 942 2HH2 ARG 114 2HH2 ARG 114 11.779 8.271 -13.098 943 H GLU 115 H GLU 115 9.439 13.432 -6.415 944 HA GLU 115 HA GLU 115 12.317 12.818 -6.357 945 1HB GLU 115 1HB GLU 115 12.297 14.429 -4.303 946 2HB GLU 115 2HB GLU 115 12.394 15.087 -5.930 947 1HG GLU 115 1HG GLU 115 10.476 16.181 -5.709 948 2HG GLU 115 2HG GLU 115 9.653 14.773 -5.040 949 H GLY 116 H GLY 116 13.099 11.713 -4.554 950 1HA GLY 116 1HA GLY 116 12.929 10.605 -2.486 951 2HA GLY 116 2HA GLY 116 11.191 10.860 -2.515 952 H ARG 117 H ARG 117 13.404 9.362 -4.859 953 HA ARG 117 HA ARG 117 13.217 7.405 -6.032 954 1HB ARG 117 1HB ARG 117 14.187 6.717 -3.833 955 2HB ARG 117 2HB ARG 117 12.566 6.320 -3.285 956 1HG ARG 117 1HG ARG 117 13.405 4.270 -3.930 957 2HG ARG 117 2HG ARG 117 12.494 4.775 -5.355 958 1HD ARG 117 1HD ARG 117 14.606 3.908 -6.081 959 2HD ARG 117 2HD ARG 117 14.610 5.654 -6.318 960 HE ARG 117 HE ARG 117 15.811 4.569 -3.881 961 1HH1 ARG 117 1HH1 ARG 117 16.242 6.066 -7.014 962 2HH1 ARG 117 2HH1 ARG 117 17.861 6.575 -6.680 963 1HH2 ARG 117 1HH2 ARG 117 17.933 5.239 -3.451 964 2HH2 ARG 117 2HH2 ARG 117 18.822 6.105 -4.659 965 H ILE 118 H ILE 118 11.209 8.340 -7.011 966 HA ILE 118 HA ILE 118 9.031 8.278 -7.620 967 HB ILE 118 HB ILE 118 10.015 6.138 -8.515 968 1HG1 ILE 118 1HG1 ILE 118 7.081 6.519 -8.018 969 2HG1 ILE 118 2HG1 ILE 118 7.999 6.908 -9.455 970 1HG2 ILE 118 1HG2 ILE 118 9.480 5.181 -5.951 971 2HG2 ILE 118 2HG2 ILE 118 10.035 4.258 -7.343 972 3HG2 ILE 118 3HG2 ILE 118 8.310 4.385 -6.998 973 1HD1 ILE 118 1HD1 ILE 118 6.449 4.890 -9.545 974 2HD1 ILE 118 2HD1 ILE 118 7.656 4.070 -8.557 975 3HD1 ILE 118 3HD1 ILE 118 8.091 4.687 -10.151 976 H SER 119 H SER 119 8.534 9.423 -5.632 977 HA SER 119 HA SER 119 6.380 8.023 -4.261 978 1HB SER 119 1HB SER 119 8.687 9.274 -2.760 979 2HB SER 119 2HB SER 119 7.175 8.757 -2.013 980 HG SER 119 HG SER 119 9.075 7.242 -2.065 981 H LEU 120 H LEU 120 8.026 10.997 -5.070 982 HA LEU 120 HA LEU 120 5.572 12.494 -4.394 983 1HB LEU 120 1HB LEU 120 8.445 13.415 -4.221 984 2HB LEU 120 2HB LEU 120 7.071 14.485 -4.094 985 HG LEU 120 HG LEU 120 7.882 14.097 -1.902 986 1HD1 LEU 120 1HD1 LEU 120 5.675 14.214 -1.528 987 2HD1 LEU 120 2HD1 LEU 120 5.896 12.537 -1.029 988 3HD1 LEU 120 3HD1 LEU 120 5.296 12.903 -2.645 989 1HD2 LEU 120 1HD2 LEU 120 7.859 11.188 -2.635 990 2HD2 LEU 120 2HD2 LEU 120 7.908 11.738 -0.967 991 3HD2 LEU 120 3HD2 LEU 120 9.208 12.174 -2.077 992 H LEU 121 H LEU 121 5.109 14.335 -5.762 993 HA LEU 121 HA LEU 121 6.608 14.951 -8.048 994 1HB LEU 121 1HB LEU 121 5.004 14.079 -9.773 995 2HB LEU 121 2HB LEU 121 6.010 12.878 -8.988 996 HG LEU 121 HG LEU 121 3.330 13.309 -7.798 997 1HD1 LEU 121 1HD1 LEU 121 3.683 12.736 -10.618 998 2HD1 LEU 121 2HD1 LEU 121 2.208 13.064 -9.710 999 3HD1 LEU 121 3HD1 LEU 121 2.853 11.427 -9.779 1000 1HD2 LEU 121 1HD2 LEU 121 5.141 11.600 -7.140 1001 2HD2 LEU 121 2HD2 LEU 121 4.632 10.723 -8.577 1002 3HD2 LEU 121 3HD2 LEU 121 3.478 11.042 -7.283 1003 H LYS 122 H LYS 122 5.695 16.631 -9.346 1004 HA LYS 122 HA LYS 122 3.455 18.014 -8.018 1005 1HB LYS 122 1HB LYS 122 6.031 18.900 -8.859 1006 2HB LYS 122 2HB LYS 122 4.824 19.762 -9.801 1007 1HG LYS 122 1HG LYS 122 3.722 20.473 -7.738 1008 2HG LYS 122 2HG LYS 122 4.934 19.612 -6.797 1009 1HD LYS 122 1HD LYS 122 5.381 21.979 -8.613 1010 2HD LYS 122 2HD LYS 122 5.499 21.954 -6.854 1011 1HE LYS 122 1HE LYS 122 7.215 19.979 -8.145 1012 2HE LYS 122 2HE LYS 122 7.583 21.632 -8.623 1013 1HZ LYS 122 1HZ LYS 122 7.727 22.202 -6.250 1014 2HZ LYS 122 2HZ LYS 122 8.867 21.037 -6.704 1015 3HZ LYS 122 3HZ LYS 122 7.484 20.577 -5.851 1016 H CYS 123 H CYS 123 1.733 18.827 -9.204 1017 HA CYS 123 HA CYS 123 1.717 18.416 -12.101 1018 1HB CYS 123 1HB CYS 123 -0.277 17.210 -10.186 1019 2HB CYS 123 2HB CYS 123 -0.575 17.362 -11.909 1020 H GLU 124 H GLU 124 1.870 20.814 -11.830 1021 HA GLU 124 HA GLU 124 -0.356 22.254 -10.777 1022 1HB GLU 124 1HB GLU 124 2.213 22.902 -11.509 1023 2HB GLU 124 2HB GLU 124 1.264 23.643 -12.789 1024 1HG GLU 124 1HG GLU 124 0.119 24.162 -10.188 1025 2HG GLU 124 2HG GLU 124 1.800 24.687 -10.275 1026 H ALA 125 H ALA 125 0.426 20.883 -13.881 1027 HA ALA 125 HA ALA 125 -1.518 22.393 -15.352 1028 1HB ALA 125 1HB ALA 125 -0.919 21.084 -17.221 1029 2HB ALA 125 2HB ALA 125 -0.281 19.790 -16.207 1030 3HB ALA 125 3HB ALA 125 0.565 21.333 -16.303 1031 H CYS 126 H CYS 126 -1.361 18.859 -14.822 1032 HA CYS 126 HA CYS 126 -4.200 18.642 -15.217 1033 1HB CYS 126 1HB CYS 126 -3.877 16.244 -14.888 1034 2HB CYS 126 2HB CYS 126 -2.684 16.878 -16.014 1035 H GLY 127 H GLY 127 -4.209 20.306 -13.250 1036 1HA GLY 127 1HA GLY 127 -5.501 20.415 -11.285 1037 2HA GLY 127 2HA GLY 127 -5.156 18.718 -10.991 1038 H ALA 128 H ALA 128 -3.821 18.307 -9.376 1039 HA ALA 128 HA ALA 128 -1.539 20.006 -8.853 1040 1HB ALA 128 1HB ALA 128 -3.685 19.655 -6.766 1041 2HB ALA 128 2HB ALA 128 -3.291 21.151 -7.612 1042 3HB ALA 128 3HB ALA 128 -2.117 20.423 -6.516 1043 H LYS 129 H LYS 129 0.043 19.019 -7.542 1044 HA LYS 129 HA LYS 129 -0.499 16.271 -6.683 1045 1HB LYS 129 1HB LYS 129 0.739 16.650 -9.010 1046 2HB LYS 129 2HB LYS 129 2.124 16.794 -7.962 1047 1HG LYS 129 1HG LYS 129 1.971 14.543 -8.703 1048 2HG LYS 129 2HG LYS 129 1.543 14.583 -6.992 1049 1HD LYS 129 1HD LYS 129 -0.890 14.782 -7.843 1050 2HD LYS 129 2HD LYS 129 -0.235 14.208 -9.377 1051 1HE LYS 129 1HE LYS 129 0.818 12.515 -7.406 1052 2HE LYS 129 2HE LYS 129 -0.884 12.730 -7.000 1053 1HZ LYS 129 1HZ LYS 129 -0.537 10.857 -8.497 1054 2HZ LYS 129 2HZ LYS 129 0.153 11.883 -9.650 1055 3HZ LYS 129 3HZ LYS 129 -1.477 12.058 -9.233 1056 H ALA 130 H ALA 130 0.923 15.483 -5.063 1057 HA ALA 130 HA ALA 130 1.838 17.564 -3.287 1058 1HB ALA 130 1HB ALA 130 1.841 15.974 -1.634 1059 2HB ALA 130 2HB ALA 130 2.270 14.666 -2.737 1060 3HB ALA 130 3HB ALA 130 0.629 15.315 -2.733 1061 HA PRO 131 HA PRO 131 5.985 17.101 -5.136 1062 1HB PRO 131 1HB PRO 131 6.974 19.407 -4.106 1063 2HB PRO 131 2HB PRO 131 5.994 19.358 -5.570 1064 1HG PRO 131 1HG PRO 131 5.185 20.041 -2.773 1065 2HG PRO 131 2HG PRO 131 4.734 20.833 -4.294 1066 1HD PRO 131 1HD PRO 131 3.093 19.098 -3.019 1067 2HD PRO 131 2HD PRO 131 3.130 19.267 -4.784 1068 H LEU 132 H LEU 132 5.314 18.260 -1.849 1069 HA LEU 132 HA LEU 132 6.701 16.183 -0.574 1070 1HB LEU 132 1HB LEU 132 8.681 17.283 0.217 1071 2HB LEU 132 2HB LEU 132 8.660 17.342 -1.535 1072 HG LEU 132 HG LEU 132 7.431 19.720 -0.508 1073 1HD1 LEU 132 1HD1 LEU 132 9.672 20.598 0.447 1074 2HD1 LEU 132 2HD1 LEU 132 9.999 18.897 0.775 1075 3HD1 LEU 132 3HD1 LEU 132 8.587 19.677 1.489 1076 1HD2 LEU 132 1HD2 LEU 132 10.108 19.852 -1.715 1077 2HD2 LEU 132 2HD2 LEU 132 8.615 20.682 -2.157 1078 3HD2 LEU 132 3HD2 LEU 132 8.882 19.013 -2.665 1079 H LYS 133 H LYS 133 5.558 16.009 1.234 1080 HA LYS 133 HA LYS 133 4.582 18.468 2.522 1081 1HB LYS 133 1HB LYS 133 3.561 15.691 3.075 1082 2HB LYS 133 2HB LYS 133 2.783 17.226 3.429 1083 1HG LYS 133 1HG LYS 133 1.791 17.290 1.439 1084 2HG LYS 133 2HG LYS 133 3.286 16.889 0.591 1085 1HD LYS 133 1HD LYS 133 2.796 14.684 0.503 1086 2HD LYS 133 2HD LYS 133 2.045 14.681 2.099 1087 1HE LYS 133 1HE LYS 133 0.385 16.234 0.441 1088 2HE LYS 133 2HE LYS 133 0.817 14.801 -0.489 1089 1HZ LYS 133 1HZ LYS 133 -0.674 14.990 2.032 1090 2HZ LYS 133 2HZ LYS 133 0.210 13.586 1.702 1091 3HZ LYS 133 3HZ LYS 133 -1.013 14.080 0.646 1092 H ASN 134 H ASN 134 4.226 18.066 4.997 1093 HA ASN 134 HA ASN 134 6.807 17.667 6.126 1094 1HB ASN 134 1HB ASN 134 4.934 19.222 6.958 1095 2HB ASN 134 2HB ASN 134 4.244 17.784 7.704 1096 1HD2 ASN 134 1HD2 ASN 134 6.845 20.073 7.748 1097 2HD2 ASN 134 2HD2 ASN 134 7.499 19.612 9.279 1098 H VAL 135 H VAL 135 7.719 15.860 6.855 1099 HA VAL 135 HA VAL 135 6.013 13.485 7.194 1100 HB VAL 135 HB VAL 135 7.735 13.299 5.430 1101 1HG1 VAL 135 1HG1 VAL 135 9.354 14.738 6.982 1102 2HG1 VAL 135 2HG1 VAL 135 9.959 13.638 5.744 1103 3HG1 VAL 135 3HG1 VAL 135 9.912 13.127 7.432 1104 1HG2 VAL 135 1HG2 VAL 135 7.413 11.159 5.992 1105 2HG2 VAL 135 2HG2 VAL 135 7.437 11.518 7.719 1106 3HG2 VAL 135 3HG2 VAL 135 8.951 11.279 6.848 Start of MODEL 18 1 H MET 1 H MET 1 -31.974 -24.777 -0.524 2 HA MET 1 HA MET 1 -34.595 -26.094 -0.621 3 1HB MET 1 1HB MET 1 -33.774 -23.538 -1.675 4 2HB MET 1 2HB MET 1 -34.108 -24.649 -2.996 5 1HG MET 1 1HG MET 1 -36.324 -25.072 -2.119 6 2HG MET 1 2HG MET 1 -35.996 -24.031 -0.735 7 1HE MET 1 1HE MET 1 -36.272 -24.528 -4.319 8 2HE MET 1 2HE MET 1 -35.999 -22.952 -5.062 9 3HE MET 1 3HE MET 1 -37.633 -23.448 -4.620 10 H ASP 2 H ASP 2 -31.811 -27.098 -0.493 11 HA ASP 2 HA ASP 2 -31.675 -28.334 -3.166 12 1HB ASP 2 1HB ASP 2 -29.751 -26.770 -2.393 13 2HB ASP 2 2HB ASP 2 -29.293 -28.112 -1.347 14 H ASP 3 H ASP 3 -33.116 -29.979 -2.409 15 HA ASP 3 HA ASP 3 -32.618 -31.588 -0.156 16 1HB ASP 3 1HB ASP 3 -34.537 -31.478 -2.253 17 2HB ASP 3 2HB ASP 3 -33.927 -33.128 -2.182 18 H TYR 4 H TYR 4 -32.547 -34.179 -0.834 19 HA TYR 4 HA TYR 4 -29.862 -34.744 -1.210 20 1HB TYR 4 1HB TYR 4 -32.370 -36.340 -1.314 21 2HB TYR 4 2HB TYR 4 -30.920 -37.076 -1.988 22 HD1 TYR 4 HD1 TYR 4 -31.913 -35.165 1.073 23 HD2 TYR 4 HD2 TYR 4 -29.685 -38.398 -0.566 24 HE1 TYR 4 HE1 TYR 4 -31.200 -35.813 3.336 25 HE2 TYR 4 HE2 TYR 4 -28.966 -39.055 1.692 26 HH TYR 4 HH TYR 4 -29.468 -37.052 4.438 27 H GLU 5 H GLU 5 -28.914 -33.796 -2.972 28 HA GLU 5 HA GLU 5 -30.034 -34.034 -5.608 29 1HB GLU 5 1HB GLU 5 -28.475 -32.173 -4.585 30 2HB GLU 5 2HB GLU 5 -27.191 -33.243 -5.129 31 1HG GLU 5 1HG GLU 5 -29.377 -32.220 -6.919 32 2HG GLU 5 2HG GLU 5 -27.811 -31.433 -6.728 33 H LYS 6 H LYS 6 -27.299 -35.466 -3.868 34 HA LYS 6 HA LYS 6 -27.466 -37.886 -5.346 35 1HB LYS 6 1HB LYS 6 -26.018 -35.851 -6.606 36 2HB LYS 6 2HB LYS 6 -24.802 -36.905 -5.907 37 1HG LYS 6 1HG LYS 6 -26.132 -38.815 -7.002 38 2HG LYS 6 2HG LYS 6 -26.876 -37.533 -7.962 39 1HD LYS 6 1HD LYS 6 -24.480 -36.785 -8.472 40 2HD LYS 6 2HD LYS 6 -23.993 -38.365 -7.855 41 1HE LYS 6 1HE LYS 6 -24.297 -39.068 -9.958 42 2HE LYS 6 2HE LYS 6 -26.015 -39.023 -9.566 43 1HZ LYS 6 1HZ LYS 6 -25.936 -37.778 -11.472 44 2HZ LYS 6 2HZ LYS 6 -24.418 -37.114 -11.127 45 3HZ LYS 6 3HZ LYS 6 -25.789 -36.559 -10.306 46 H LEU 7 H LEU 7 -24.634 -36.144 -4.079 47 HA LEU 7 HA LEU 7 -24.524 -38.075 -1.866 48 1HB LEU 7 1HB LEU 7 -21.878 -37.265 -2.612 49 2HB LEU 7 2HB LEU 7 -22.543 -38.877 -2.478 50 HG LEU 7 HG LEU 7 -23.408 -37.676 -4.952 51 1HD1 LEU 7 1HD1 LEU 7 -20.438 -37.685 -4.444 52 2HD1 LEU 7 2HD1 LEU 7 -21.441 -36.289 -4.840 53 3HD1 LEU 7 3HD1 LEU 7 -21.185 -37.559 -6.036 54 1HD2 LEU 7 1HD2 LEU 7 -21.906 -39.688 -5.745 55 2HD2 LEU 7 2HD2 LEU 7 -23.454 -39.971 -4.947 56 3HD2 LEU 7 3HD2 LEU 7 -21.952 -40.105 -4.032 57 H LEU 8 H LEU 8 -24.128 -37.225 0.097 58 HA LEU 8 HA LEU 8 -23.566 -34.340 0.232 59 1HB LEU 8 1HB LEU 8 -24.599 -34.401 2.447 60 2HB LEU 8 2HB LEU 8 -25.694 -34.990 1.212 61 HG LEU 8 HG LEU 8 -24.248 -37.207 2.320 62 1HD1 LEU 8 1HD1 LEU 8 -23.934 -36.432 4.410 63 2HD1 LEU 8 2HD1 LEU 8 -25.643 -36.829 4.586 64 3HD1 LEU 8 3HD1 LEU 8 -25.154 -35.169 4.244 65 1HD2 LEU 8 1HD2 LEU 8 -26.564 -37.939 2.885 66 2HD2 LEU 8 2HD2 LEU 8 -26.344 -37.470 1.199 67 3HD2 LEU 8 3HD2 LEU 8 -27.142 -36.369 2.324 68 H GLU 9 H GLU 9 -21.747 -33.635 1.161 69 HA GLU 9 HA GLU 9 -19.780 -33.590 2.306 70 1HB GLU 9 1HB GLU 9 -21.420 -34.941 3.997 71 2HB GLU 9 2HB GLU 9 -20.174 -36.152 3.721 72 1HG GLU 9 1HG GLU 9 -19.363 -33.373 4.423 73 2HG GLU 9 2HG GLU 9 -19.968 -34.444 5.685 74 H ARG 10 H ARG 10 -20.485 -35.611 -0.046 75 HA ARG 10 HA ARG 10 -18.247 -37.434 0.187 76 1HB ARG 10 1HB ARG 10 -20.275 -36.948 -1.990 77 2HB ARG 10 2HB ARG 10 -18.983 -38.134 -2.119 78 1HG ARG 10 1HG ARG 10 -20.250 -38.631 0.331 79 2HG ARG 10 2HG ARG 10 -21.535 -38.358 -0.842 80 1HD ARG 10 1HD ARG 10 -20.436 -40.007 -2.343 81 2HD ARG 10 2HD ARG 10 -19.275 -40.338 -1.061 82 HE ARG 10 HE ARG 10 -22.141 -40.721 -0.565 83 1HH1 ARG 10 1HH1 ARG 10 -18.928 -42.066 -0.884 84 2HH1 ARG 10 2HH1 ARG 10 -19.372 -43.595 -0.212 85 1HH2 ARG 10 1HH2 ARG 10 -22.717 -42.737 0.314 86 2HH2 ARG 10 2HH2 ARG 10 -21.519 -43.979 0.463 87 H ALA 11 H ALA 11 -16.291 -37.164 -0.696 88 HA ALA 11 HA ALA 11 -14.509 -36.102 -1.633 89 1HB ALA 11 1HB ALA 11 -16.000 -34.932 -3.861 90 2HB ALA 11 2HB ALA 11 -16.290 -36.655 -3.624 91 3HB ALA 11 3HB ALA 11 -14.646 -36.063 -3.867 92 H ILE 12 H ILE 12 -16.160 -34.594 0.262 93 HA ILE 12 HA ILE 12 -16.083 -31.850 -0.696 94 HB ILE 12 HB ILE 12 -17.959 -32.621 0.710 95 1HG1 ILE 12 1HG1 ILE 12 -16.898 -30.208 0.684 96 2HG1 ILE 12 2HG1 ILE 12 -18.209 -30.603 1.785 97 1HG2 ILE 12 1HG2 ILE 12 -15.852 -32.908 2.842 98 2HG2 ILE 12 2HG2 ILE 12 -16.826 -34.191 2.131 99 3HG2 ILE 12 3HG2 ILE 12 -17.592 -32.955 3.129 100 1HD1 ILE 12 1HD1 ILE 12 -16.960 -29.939 3.477 101 2HD1 ILE 12 2HD1 ILE 12 -15.625 -29.598 2.376 102 3HD1 ILE 12 3HD1 ILE 12 -15.775 -31.192 3.110 103 H ASP 13 H ASP 13 -14.205 -34.024 1.194 104 HA ASP 13 HA ASP 13 -11.926 -32.391 1.232 105 1HB ASP 13 1HB ASP 13 -13.313 -31.132 2.890 106 2HB ASP 13 2HB ASP 13 -13.295 -32.560 3.922 107 H GLN 14 H GLN 14 -13.614 -35.237 2.040 108 HA GLN 14 HA GLN 14 -11.330 -36.496 3.343 109 1HB GLN 14 1HB GLN 14 -14.067 -36.784 3.605 110 2HB GLN 14 2HB GLN 14 -13.606 -38.210 2.688 111 1HG GLN 14 1HG GLN 14 -11.992 -38.807 4.411 112 2HG GLN 14 2HG GLN 14 -12.422 -37.361 5.322 113 1HE2 GLN 14 1HE2 GLN 14 -15.032 -37.245 5.383 114 2HE2 GLN 14 2HE2 GLN 14 -15.741 -38.665 6.063 115 H LEU 15 H LEU 15 -13.541 -37.657 0.814 116 HA LEU 15 HA LEU 15 -11.734 -39.443 -0.359 117 1HB LEU 15 1HB LEU 15 -14.022 -38.054 -1.753 118 2HB LEU 15 2HB LEU 15 -13.314 -39.598 -2.175 119 HG LEU 15 HG LEU 15 -14.956 -38.987 0.280 120 1HD1 LEU 15 1HD1 LEU 15 -15.813 -41.167 -1.415 121 2HD1 LEU 15 2HD1 LEU 15 -15.732 -39.646 -2.302 122 3HD1 LEU 15 3HD1 LEU 15 -16.711 -39.762 -0.840 123 1HD2 LEU 15 1HD2 LEU 15 -13.782 -41.644 -0.520 124 2HD2 LEU 15 2HD2 LEU 15 -14.658 -41.249 0.958 125 3HD2 LEU 15 3HD2 LEU 15 -13.053 -40.576 0.679 126 HA PRO 16 HA PRO 16 -8.985 -37.297 -3.058 127 1HB PRO 16 1HB PRO 16 -9.834 -38.128 -5.601 128 2HB PRO 16 2HB PRO 16 -8.626 -38.927 -4.592 129 1HG PRO 16 1HG PRO 16 -11.525 -39.548 -4.936 130 2HG PRO 16 2HG PRO 16 -10.155 -40.654 -4.714 131 1HD PRO 16 1HD PRO 16 -11.822 -40.142 -2.700 132 2HD PRO 16 2HD PRO 16 -10.079 -40.292 -2.410 133 HA PRO 17 HA PRO 17 -11.203 -33.579 -4.084 134 1HB PRO 17 1HB PRO 17 -9.212 -32.405 -5.603 135 2HB PRO 17 2HB PRO 17 -9.313 -32.335 -3.841 136 1HG PRO 17 1HG PRO 17 -7.669 -34.126 -5.577 137 2HG PRO 17 2HG PRO 17 -7.239 -33.341 -4.048 138 1HD PRO 17 1HD PRO 17 -7.885 -35.946 -4.165 139 2HD PRO 17 2HD PRO 17 -8.335 -34.935 -2.775 140 H GLU 18 H GLU 18 -9.112 -34.092 -6.897 141 HA GLU 18 HA GLU 18 -9.553 -34.313 -9.108 142 1HB GLU 18 1HB GLU 18 -11.471 -36.015 -7.770 143 2HB GLU 18 2HB GLU 18 -12.143 -35.378 -9.265 144 1HG GLU 18 1HG GLU 18 -10.584 -36.433 -10.582 145 2HG GLU 18 2HG GLU 18 -9.405 -36.552 -9.275 146 H VAL 19 H VAL 19 -12.995 -33.978 -8.426 147 HA VAL 19 HA VAL 19 -12.939 -31.407 -9.844 148 HB VAL 19 HB VAL 19 -15.370 -33.117 -9.340 149 1HG1 VAL 19 1HG1 VAL 19 -15.190 -30.531 -10.181 150 2HG1 VAL 19 2HG1 VAL 19 -16.526 -31.623 -10.546 151 3HG1 VAL 19 3HG1 VAL 19 -15.221 -31.406 -11.712 152 1HG2 VAL 19 1HG2 VAL 19 -13.525 -33.138 -11.727 153 2HG2 VAL 19 2HG2 VAL 19 -15.098 -33.933 -11.654 154 3HG2 VAL 19 3HG2 VAL 19 -13.794 -34.460 -10.591 155 H PHE 20 H PHE 20 -13.076 -29.657 -8.616 156 HA PHE 20 HA PHE 20 -13.953 -29.786 -5.888 157 1HB PHE 20 1HB PHE 20 -12.630 -27.840 -7.634 158 2HB PHE 20 2HB PHE 20 -13.752 -27.102 -6.496 159 HD1 PHE 20 HD1 PHE 20 -11.800 -30.167 -5.857 160 HD2 PHE 20 HD2 PHE 20 -12.179 -25.991 -5.131 161 HE1 PHE 20 HE1 PHE 20 -10.101 -30.325 -4.085 162 HE2 PHE 20 HE2 PHE 20 -10.481 -26.141 -3.357 163 HZ PHE 20 HZ PHE 20 -9.439 -28.311 -2.832 164 H GLU 21 H GLU 21 -15.422 -27.777 -5.211 165 HA GLU 21 HA GLU 21 -17.474 -26.947 -6.916 166 1HB GLU 21 1HB GLU 21 -19.349 -28.310 -5.794 167 2HB GLU 21 2HB GLU 21 -18.392 -29.074 -7.052 168 1HG GLU 21 1HG GLU 21 -17.523 -30.598 -5.659 169 2HG GLU 21 2HG GLU 21 -17.404 -29.469 -4.314 170 H THR 22 H THR 22 -18.314 -28.069 -3.685 171 HA THR 22 HA THR 22 -18.611 -25.284 -2.868 172 HB THR 22 HB THR 22 -20.552 -26.665 -2.520 173 HG1 THR 22 HG1 THR 22 -19.346 -26.434 0.025 174 1HG2 THR 22 1HG2 THR 22 -19.628 -28.869 -2.446 175 2HG2 THR 22 2HG2 THR 22 -20.512 -28.573 -0.951 176 3HG2 THR 22 3HG2 THR 22 -18.751 -28.498 -0.962 177 H LYS 23 H LYS 23 -16.009 -25.730 -2.978 178 HA LYS 23 HA LYS 23 -15.049 -26.709 -0.414 179 1HB LYS 23 1HB LYS 23 -13.974 -26.702 -2.968 180 2HB LYS 23 2HB LYS 23 -13.062 -25.447 -2.140 181 1HG LYS 23 1HG LYS 23 -13.405 -28.254 -1.108 182 2HG LYS 23 2HG LYS 23 -12.015 -27.690 -2.029 183 1HD LYS 23 1HD LYS 23 -11.788 -25.882 -0.230 184 2HD LYS 23 2HD LYS 23 -12.909 -26.865 0.712 185 1HE LYS 23 1HE LYS 23 -11.170 -28.765 0.053 186 2HE LYS 23 2HE LYS 23 -10.086 -27.374 -0.012 187 1HZ LYS 23 1HZ LYS 23 -11.328 -26.904 2.283 188 2HZ LYS 23 2HZ LYS 23 -9.906 -27.815 2.178 189 3HZ LYS 23 3HZ LYS 23 -11.404 -28.594 2.274 190 H ARG 24 H ARG 24 -13.570 -25.431 0.885 191 HA ARG 24 HA ARG 24 -14.576 -22.825 1.422 192 1HB ARG 24 1HB ARG 24 -13.421 -24.721 2.941 193 2HB ARG 24 2HB ARG 24 -12.013 -23.716 2.632 194 1HG ARG 24 1HG ARG 24 -14.608 -22.764 3.825 195 2HG ARG 24 2HG ARG 24 -13.138 -23.135 4.728 196 1HD ARG 24 1HD ARG 24 -12.377 -21.364 2.691 197 2HD ARG 24 2HD ARG 24 -13.879 -20.728 3.345 198 HE ARG 24 HE ARG 24 -11.911 -21.474 5.320 199 1HH1 ARG 24 1HH1 ARG 24 -13.175 -18.920 3.299 200 2HH1 ARG 24 2HH1 ARG 24 -12.532 -17.654 4.289 201 1HH2 ARG 24 1HH2 ARG 24 -11.059 -19.810 6.610 202 2HH2 ARG 24 2HH2 ARG 24 -11.330 -18.158 6.166 203 H PHE 25 H PHE 25 -13.941 -22.296 -0.985 204 HA PHE 25 HA PHE 25 -11.176 -21.359 -1.137 205 1HB PHE 25 1HB PHE 25 -12.979 -22.426 -3.047 206 2HB PHE 25 2HB PHE 25 -12.693 -20.750 -3.504 207 HD1 PHE 25 HD1 PHE 25 -11.455 -21.152 -5.478 208 HD2 PHE 25 HD2 PHE 25 -10.223 -22.913 -1.804 209 HE1 PHE 25 HE1 PHE 25 -9.318 -21.798 -6.507 210 HE2 PHE 25 HE2 PHE 25 -8.081 -23.560 -2.828 211 HZ PHE 25 HZ PHE 25 -7.628 -23.004 -5.184 212 H GLU 26 H GLU 26 -11.257 -19.603 0.256 213 HA GLU 26 HA GLU 26 -12.294 -17.180 -0.903 214 1HB GLU 26 1HB GLU 26 -13.714 -18.554 1.260 215 2HB GLU 26 2HB GLU 26 -13.324 -16.883 1.640 216 1HG GLU 26 1HG GLU 26 -14.781 -17.783 -0.834 217 2HG GLU 26 2HG GLU 26 -15.554 -17.172 0.627 218 H VAL 27 H VAL 27 -11.003 -15.511 -0.402 219 HA VAL 27 HA VAL 27 -9.495 -15.480 2.082 220 HB VAL 27 HB VAL 27 -8.110 -15.510 -0.607 221 1HG1 VAL 27 1HG1 VAL 27 -7.356 -14.157 1.766 222 2HG1 VAL 27 2HG1 VAL 27 -6.439 -14.349 0.272 223 3HG1 VAL 27 3HG1 VAL 27 -6.273 -15.534 1.567 224 1HG2 VAL 27 1HG2 VAL 27 -7.742 -17.354 1.749 225 2HG2 VAL 27 2HG2 VAL 27 -7.004 -17.495 0.154 226 3HG2 VAL 27 3HG2 VAL 27 -8.739 -17.726 0.344 227 HA PRO 28 HA PRO 28 -11.013 -11.267 1.294 228 1HB PRO 28 1HB PRO 28 -9.491 -10.891 3.828 229 2HB PRO 28 2HB PRO 28 -11.124 -10.362 3.406 230 1HG PRO 28 1HG PRO 28 -10.750 -12.438 5.028 231 2HG PRO 28 2HG PRO 28 -12.051 -12.447 3.822 232 1HD PRO 28 1HD PRO 28 -9.419 -13.860 3.787 233 2HD PRO 28 2HD PRO 28 -11.000 -14.399 3.183 234 H LYS 29 H LYS 29 -10.036 -9.436 0.517 235 HA LYS 29 HA LYS 29 -7.248 -8.896 0.885 236 1HB LYS 29 1HB LYS 29 -6.771 -8.994 -1.619 237 2HB LYS 29 2HB LYS 29 -6.841 -10.528 -0.763 238 1HG LYS 29 1HG LYS 29 -8.681 -11.218 -1.868 239 2HG LYS 29 2HG LYS 29 -9.373 -9.597 -1.951 240 1HD LYS 29 1HD LYS 29 -8.833 -9.772 -4.138 241 2HD LYS 29 2HD LYS 29 -7.235 -9.288 -3.566 242 1HE LYS 29 1HE LYS 29 -6.389 -11.198 -4.319 243 2HE LYS 29 2HE LYS 29 -7.455 -12.095 -3.239 244 1HZ LYS 29 1HZ LYS 29 -9.100 -11.412 -5.270 245 2HZ LYS 29 2HZ LYS 29 -8.317 -12.905 -5.115 246 3HZ LYS 29 3HZ LYS 29 -7.641 -11.693 -6.081 247 H ALA 30 H ALA 30 -8.172 -6.936 1.613 248 HA ALA 30 HA ALA 30 -8.617 -5.034 -0.534 249 1HB ALA 30 1HB ALA 30 -10.867 -5.613 -0.220 250 2HB ALA 30 2HB ALA 30 -10.656 -4.130 0.708 251 3HB ALA 30 3HB ALA 30 -10.694 -5.687 1.533 252 H TYR 31 H TYR 31 -9.285 -2.825 0.773 253 HA TYR 31 HA TYR 31 -6.912 -2.089 2.125 254 1HB TYR 31 1HB TYR 31 -7.841 0.098 2.229 255 2HB TYR 31 2HB TYR 31 -8.399 -0.597 0.711 256 HD1 TYR 31 HD1 TYR 31 -9.375 1.036 3.700 257 HD2 TYR 31 HD2 TYR 31 -10.754 -1.702 0.744 258 HE1 TYR 31 HE1 TYR 31 -11.695 1.493 4.357 259 HE2 TYR 31 HE2 TYR 31 -13.079 -1.246 1.400 260 HH TYR 31 HH TYR 31 -13.953 1.371 3.323 261 H SER 32 H SER 32 -7.779 -0.417 4.169 262 HA SER 32 HA SER 32 -8.014 -2.259 6.340 263 1HB SER 32 1HB SER 32 -8.358 0.051 7.596 264 2HB SER 32 2HB SER 32 -6.776 -0.414 6.976 265 HG SER 32 HG SER 32 -7.065 0.937 5.252 266 H VAL 33 H VAL 33 -9.690 -1.992 8.087 267 HA VAL 33 HA VAL 33 -12.299 -1.166 7.028 268 HB VAL 33 HB VAL 33 -12.943 -3.345 8.601 269 1HG1 VAL 33 1HG1 VAL 33 -13.486 -4.433 6.403 270 2HG1 VAL 33 2HG1 VAL 33 -12.715 -3.055 5.617 271 3HG1 VAL 33 3HG1 VAL 33 -14.140 -2.811 6.627 272 1HG2 VAL 33 1HG2 VAL 33 -10.382 -3.867 8.278 273 2HG2 VAL 33 2HG2 VAL 33 -10.930 -4.453 6.707 274 3HG2 VAL 33 3HG2 VAL 33 -11.594 -5.145 8.183 275 H ILE 34 H ILE 34 -13.500 -0.041 8.427 276 HA ILE 34 HA ILE 34 -12.442 0.440 11.089 277 HB ILE 34 HB ILE 34 -13.164 2.310 9.605 278 1HG1 ILE 34 1HG1 ILE 34 -14.287 3.555 11.382 279 2HG1 ILE 34 2HG1 ILE 34 -14.681 2.050 12.205 280 1HG2 ILE 34 1HG2 ILE 34 -15.268 0.880 8.927 281 2HG2 ILE 34 2HG2 ILE 34 -15.323 2.641 8.936 282 3HG2 ILE 34 3HG2 ILE 34 -15.999 1.732 10.285 283 1HD1 ILE 34 1HD1 ILE 34 -12.510 3.615 12.712 284 2HD1 ILE 34 2HD1 ILE 34 -11.837 2.372 11.655 285 3HD1 ILE 34 3HD1 ILE 34 -12.663 1.912 13.145 286 H GLN 35 H GLN 35 -13.401 -0.139 12.970 287 HA GLN 35 HA GLN 35 -16.055 -0.674 13.475 288 1HB GLN 35 1HB GLN 35 -15.813 -2.529 11.843 289 2HB GLN 35 2HB GLN 35 -14.546 -3.208 12.840 290 1HG GLN 35 1HG GLN 35 -16.646 -2.920 14.596 291 2HG GLN 35 2HG GLN 35 -17.423 -3.415 13.094 292 1HE2 GLN 35 1HE2 GLN 35 -16.686 -5.385 12.091 293 2HE2 GLN 35 2HE2 GLN 35 -16.028 -6.650 13.067 294 H GLY 36 H GLY 36 -16.334 -0.922 15.648 295 1HA GLY 36 1HA GLY 36 -15.787 -1.075 17.869 296 2HA GLY 36 2HA GLY 36 -14.619 -2.295 17.388 297 H ASN 37 H ASN 37 -14.434 0.960 16.141 298 HA ASN 37 HA ASN 37 -12.904 2.632 16.417 299 1HB ASN 37 1HB ASN 37 -13.731 2.109 18.926 300 2HB ASN 37 2HB ASN 37 -12.033 1.676 19.092 301 1HD2 ASN 37 1HD2 ASN 37 -12.013 3.471 20.604 302 2HD2 ASN 37 2HD2 ASN 37 -11.786 5.073 19.999 303 H ARG 38 H ARG 38 -12.131 0.085 15.284 304 HA ARG 38 HA ARG 38 -9.244 0.368 15.550 305 1HB ARG 38 1HB ARG 38 -9.263 -2.299 15.552 306 2HB ARG 38 2HB ARG 38 -9.244 -1.361 17.038 307 1HG ARG 38 1HG ARG 38 -11.927 -1.613 16.534 308 2HG ARG 38 2HG ARG 38 -11.284 -3.147 15.965 309 1HD ARG 38 1HD ARG 38 -9.992 -2.638 18.393 310 2HD ARG 38 2HD ARG 38 -11.679 -2.215 18.659 311 HE ARG 38 HE ARG 38 -12.006 -4.574 17.561 312 1HH1 ARG 38 1HH1 ARG 38 -9.589 -3.602 19.886 313 2HH1 ARG 38 2HH1 ARG 38 -9.464 -5.173 20.598 314 1HH2 ARG 38 1HH2 ARG 38 -11.850 -6.638 18.512 315 2HH2 ARG 38 2HH2 ARG 38 -10.747 -6.894 19.822 316 H THR 39 H THR 39 -8.044 -0.766 13.834 317 HA THR 39 HA THR 39 -9.735 -1.048 11.441 318 HB THR 39 HB THR 39 -7.482 0.566 11.846 319 HG1 THR 39 HG1 THR 39 -8.663 -0.235 9.398 320 1HG2 THR 39 1HG2 THR 39 -5.803 -0.087 10.382 321 2HG2 THR 39 2HG2 THR 39 -6.795 -1.354 9.660 322 3HG2 THR 39 3HG2 THR 39 -6.154 -1.556 11.281 323 H PHE 40 H PHE 40 -9.853 -2.929 10.402 324 HA PHE 40 HA PHE 40 -8.146 -5.114 11.353 325 1HB PHE 40 1HB PHE 40 -10.562 -5.406 9.586 326 2HB PHE 40 2HB PHE 40 -9.805 -6.626 10.585 327 HD1 PHE 40 HD1 PHE 40 -9.506 -4.990 13.086 328 HD2 PHE 40 HD2 PHE 40 -12.744 -5.484 10.377 329 HE1 PHE 40 HE1 PHE 40 -11.088 -4.534 14.911 330 HE2 PHE 40 HE2 PHE 40 -14.331 -5.026 12.181 331 HZ PHE 40 HZ PHE 40 -13.513 -4.552 14.458 332 H ILE 41 H ILE 41 -6.332 -4.239 10.064 333 HA ILE 41 HA ILE 41 -6.541 -4.250 7.212 334 HB ILE 41 HB ILE 41 -4.896 -2.927 8.681 335 1HG1 ILE 41 1HG1 ILE 41 -3.173 -3.951 6.608 336 2HG1 ILE 41 2HG1 ILE 41 -4.823 -3.797 6.009 337 1HG2 ILE 41 1HG2 ILE 41 -4.095 -5.235 9.653 338 2HG2 ILE 41 2HG2 ILE 41 -2.984 -3.882 9.474 339 3HG2 ILE 41 3HG2 ILE 41 -3.003 -5.176 8.276 340 1HD1 ILE 41 1HD1 ILE 41 -4.740 -1.568 6.020 341 2HD1 ILE 41 2HD1 ILE 41 -2.992 -1.795 6.076 342 3HD1 ILE 41 3HD1 ILE 41 -3.895 -1.510 7.565 343 H GLN 42 H GLN 42 -6.410 -5.948 5.882 344 HA GLN 42 HA GLN 42 -5.408 -8.495 6.967 345 1HB GLN 42 1HB GLN 42 -7.533 -7.829 4.959 346 2HB GLN 42 2HB GLN 42 -6.724 -9.387 4.879 347 1HG GLN 42 1HG GLN 42 -8.112 -10.161 6.404 348 2HG GLN 42 2HG GLN 42 -7.459 -9.008 7.565 349 1HE2 GLN 42 1HE2 GLN 42 -8.377 -6.654 6.294 350 2HE2 GLN 42 2HE2 GLN 42 -10.095 -6.599 6.450 351 H ASN 43 H ASN 43 -5.432 -6.441 4.102 352 HA ASN 43 HA ASN 43 -3.164 -7.945 3.021 353 1HB ASN 43 1HB ASN 43 -5.441 -6.803 1.817 354 2HB ASN 43 2HB ASN 43 -4.076 -5.823 1.291 355 1HD2 ASN 43 1HD2 ASN 43 -5.651 -7.487 -0.359 356 2HD2 ASN 43 2HD2 ASN 43 -4.627 -8.724 -0.994 357 H PHE 44 H PHE 44 -2.518 -6.467 5.229 358 HA PHE 44 HA PHE 44 -1.779 -3.847 5.006 359 1HB PHE 44 1HB PHE 44 0.229 -4.525 6.475 360 2HB PHE 44 2HB PHE 44 -1.387 -4.852 7.089 361 HD1 PHE 44 HD1 PHE 44 -2.019 -7.014 7.692 362 HD2 PHE 44 HD2 PHE 44 1.485 -6.420 5.352 363 HE1 PHE 44 HE1 PHE 44 -1.435 -9.389 7.971 364 HE2 PHE 44 HE2 PHE 44 2.076 -8.792 5.626 365 HZ PHE 44 HZ PHE 44 0.614 -10.280 6.935 366 H ARG 45 H ARG 45 -0.275 -6.610 3.467 367 HA ARG 45 HA ARG 45 2.133 -5.339 2.725 368 1HB ARG 45 1HB ARG 45 1.592 -7.826 2.632 369 2HB ARG 45 2HB ARG 45 0.760 -7.486 1.121 370 1HG ARG 45 1HG ARG 45 3.528 -6.485 1.374 371 2HG ARG 45 2HG ARG 45 3.310 -8.231 1.231 372 1HD ARG 45 1HD ARG 45 1.940 -6.332 -0.643 373 2HD ARG 45 2HD ARG 45 3.603 -6.848 -0.923 374 HE ARG 45 HE ARG 45 1.212 -8.429 -1.236 375 1HH1 ARG 45 1HH1 ARG 45 4.674 -8.484 -0.798 376 2HH1 ARG 45 2HH1 ARG 45 4.857 -10.073 -1.461 377 1HH2 ARG 45 1HH2 ARG 45 1.451 -10.520 -2.102 378 2HH2 ARG 45 2HH2 ARG 45 3.027 -11.231 -2.201 379 H GLU 46 H GLU 46 -0.913 -5.798 0.949 380 HA GLU 46 HA GLU 46 -0.007 -4.142 -1.232 381 1HB GLU 46 1HB GLU 46 -1.567 -6.103 -1.498 382 2HB GLU 46 2HB GLU 46 -2.798 -5.128 -0.716 383 1HG GLU 46 1HG GLU 46 -2.443 -3.419 -2.528 384 2HG GLU 46 2HG GLU 46 -1.462 -4.628 -3.354 385 H VAL 47 H VAL 47 -2.527 -3.919 1.255 386 HA VAL 47 HA VAL 47 -3.502 -1.409 0.631 387 HB VAL 47 HB VAL 47 -3.230 -2.425 3.457 388 1HG1 VAL 47 1HG1 VAL 47 -4.021 -0.153 3.288 389 2HG1 VAL 47 2HG1 VAL 47 -5.367 -1.198 3.740 390 3HG1 VAL 47 3HG1 VAL 47 -5.218 -0.620 2.082 391 1HG2 VAL 47 1HG2 VAL 47 -5.713 -3.192 2.722 392 2HG2 VAL 47 2HG2 VAL 47 -4.318 -4.255 2.683 393 3HG2 VAL 47 3HG2 VAL 47 -4.848 -3.447 1.210 394 H ALA 48 H ALA 48 -0.705 -2.305 2.606 395 HA ALA 48 HA ALA 48 -0.201 0.371 3.436 396 1HB ALA 48 1HB ALA 48 0.577 -1.825 4.554 397 2HB ALA 48 2HB ALA 48 1.608 -0.402 4.614 398 3HB ALA 48 3HB ALA 48 1.949 -1.686 3.455 399 H ASP 49 H ASP 49 1.274 -1.741 1.009 400 HA ASP 49 HA ASP 49 3.330 -0.156 0.140 401 1HB ASP 49 1HB ASP 49 2.049 -2.437 -0.805 402 2HB ASP 49 2HB ASP 49 1.925 -1.298 -2.140 403 H ALA 50 H ALA 50 0.154 -0.177 -1.499 404 HA ALA 50 HA ALA 50 0.609 2.084 -3.028 405 1HB ALA 50 1HB ALA 50 -2.161 1.936 -2.360 406 2HB ALA 50 2HB ALA 50 -1.521 0.313 -2.583 407 3HB ALA 50 3HB ALA 50 -1.352 1.511 -3.865 408 H LEU 51 H LEU 51 -0.776 1.861 0.239 409 HA LEU 51 HA LEU 51 -1.473 4.578 0.443 410 1HB LEU 51 1HB LEU 51 -2.518 3.259 2.014 411 2HB LEU 51 2HB LEU 51 -1.085 2.307 2.328 412 HG LEU 51 HG LEU 51 -0.147 4.124 3.653 413 1HD1 LEU 51 1HD1 LEU 51 -0.817 6.204 3.249 414 2HD1 LEU 51 2HD1 LEU 51 -2.300 5.816 4.116 415 3HD1 LEU 51 3HD1 LEU 51 -2.227 5.624 2.372 416 1HD2 LEU 51 1HD2 LEU 51 -2.644 2.761 4.270 417 2HD2 LEU 51 2HD2 LEU 51 -2.411 4.239 5.204 418 3HD2 LEU 51 3HD2 LEU 51 -1.204 2.967 5.261 419 H ASN 52 H ASN 52 1.548 3.005 0.409 420 HA ASN 52 HA ASN 52 2.906 5.500 0.837 421 1HB ASN 52 1HB ASN 52 2.733 4.961 3.137 422 2HB ASN 52 2HB ASN 52 3.103 3.266 2.852 423 1HD2 ASN 52 1HD2 ASN 52 4.948 2.786 3.716 424 2HD2 ASN 52 2HD2 ASN 52 6.395 3.724 3.631 425 H ARG 53 H ARG 53 4.381 2.362 1.496 426 HA ARG 53 HA ARG 53 5.099 1.437 -0.967 427 1HB ARG 53 1HB ARG 53 7.392 2.356 -1.317 428 2HB ARG 53 2HB ARG 53 6.120 3.544 -1.547 429 1HG ARG 53 1HG ARG 53 7.410 4.833 -0.247 430 2HG ARG 53 2HG ARG 53 6.693 3.911 1.073 431 1HD ARG 53 1HD ARG 53 8.861 3.566 1.613 432 2HD ARG 53 2HD ARG 53 8.707 2.261 0.442 433 HE ARG 53 HE ARG 53 9.615 3.981 -1.195 434 1HH1 ARG 53 1HH1 ARG 53 10.481 3.905 2.195 435 2HH1 ARG 53 2HH1 ARG 53 11.993 4.707 1.947 436 1HH2 ARG 53 1HH2 ARG 53 11.607 5.034 -1.509 437 2HH2 ARG 53 2HH2 ARG 53 12.632 5.347 -0.149 438 H ASP 54 H ASP 54 6.208 2.179 2.242 439 HA ASP 54 HA ASP 54 7.366 -0.514 2.487 440 1HB ASP 54 1HB ASP 54 8.780 1.930 2.587 441 2HB ASP 54 2HB ASP 54 8.671 1.365 4.247 442 HA PRO 55 HA PRO 55 4.905 -0.789 6.144 443 1HB PRO 55 1HB PRO 55 6.372 -2.413 7.723 444 2HB PRO 55 2HB PRO 55 5.559 -2.994 6.262 445 1HG PRO 55 1HG PRO 55 8.429 -2.236 6.662 446 2HG PRO 55 2HG PRO 55 7.751 -3.628 5.797 447 1HD PRO 55 1HD PRO 55 8.622 -1.385 4.531 448 2HD PRO 55 2HD PRO 55 7.303 -2.391 3.904 449 H GLN 56 H GLN 56 8.125 0.476 6.337 450 HA GLN 56 HA GLN 56 8.169 1.120 9.096 451 1HB GLN 56 1HB GLN 56 9.766 1.795 6.709 452 2HB GLN 56 2HB GLN 56 9.810 2.984 8.004 453 1HG GLN 56 1HG GLN 56 10.178 0.208 8.871 454 2HG GLN 56 2HG GLN 56 11.443 0.837 7.816 455 1HE2 GLN 56 1HE2 GLN 56 12.099 0.147 10.329 456 2HE2 GLN 56 2HE2 GLN 56 12.413 1.550 11.287 457 H HIS 57 H HIS 57 7.304 3.008 6.230 458 HA HIS 57 HA HIS 57 6.696 5.384 7.673 459 1HB HIS 57 1HB HIS 57 6.871 4.609 4.974 460 2HB HIS 57 2HB HIS 57 5.228 5.197 5.198 461 HD2 HIS 57 HD2 HIS 57 6.446 7.575 7.424 462 HE1 HIS 57 HE1 HIS 57 8.070 9.052 3.791 463 HE2 HIS 57 HE2 HIS 57 7.606 9.549 6.219 464 H LEU 58 H LEU 58 4.552 3.117 5.978 465 HA LEU 58 HA LEU 58 2.113 3.996 6.763 466 1HB LEU 58 1HB LEU 58 2.987 1.762 5.522 467 2HB LEU 58 2HB LEU 58 2.434 1.082 7.042 468 HG LEU 58 HG LEU 58 0.387 2.793 6.287 469 1HD1 LEU 58 1HD1 LEU 58 1.585 1.412 3.914 470 2HD1 LEU 58 2HD1 LEU 58 1.146 3.102 4.093 471 3HD1 LEU 58 3HD1 LEU 58 -0.112 1.877 3.976 472 1HD2 LEU 58 1HD2 LEU 58 -0.588 0.952 7.045 473 2HD2 LEU 58 2HD2 LEU 58 0.838 -0.029 6.709 474 3HD2 LEU 58 3HD2 LEU 58 -0.360 0.249 5.444 475 H LEU 59 H LEU 59 4.237 1.892 8.631 476 HA LEU 59 HA LEU 59 2.530 1.440 10.786 477 1HB LEU 59 1HB LEU 59 4.917 0.502 10.148 478 2HB LEU 59 2HB LEU 59 5.455 1.741 11.262 479 HG LEU 59 HG LEU 59 3.293 0.141 12.365 480 1HD1 LEU 59 1HD1 LEU 59 4.477 -1.931 12.616 481 2HD1 LEU 59 2HD1 LEU 59 5.865 -1.295 11.733 482 3HD1 LEU 59 3HD1 LEU 59 4.335 -1.561 10.898 483 1HD2 LEU 59 1HD2 LEU 59 5.643 1.532 13.193 484 2HD2 LEU 59 2HD2 LEU 59 5.703 -0.117 13.814 485 3HD2 LEU 59 3HD2 LEU 59 4.316 0.912 14.173 486 H LYS 60 H LYS 60 5.173 3.833 10.569 487 HA LYS 60 HA LYS 60 4.603 5.147 12.958 488 1HB LYS 60 1HB LYS 60 6.682 5.484 11.741 489 2HB LYS 60 2HB LYS 60 5.810 6.241 10.416 490 1HG LYS 60 1HG LYS 60 6.323 8.161 11.411 491 2HG LYS 60 2HG LYS 60 5.040 7.760 12.552 492 1HD LYS 60 1HD LYS 60 6.495 7.456 14.223 493 2HD LYS 60 2HD LYS 60 7.558 6.467 13.218 494 1HE LYS 60 1HE LYS 60 7.444 9.472 13.062 495 2HE LYS 60 2HE LYS 60 8.572 8.596 14.097 496 1HZ LYS 60 1HZ LYS 60 9.726 7.783 12.298 497 2HZ LYS 60 2HZ LYS 60 9.299 9.322 11.742 498 3HZ LYS 60 3HZ LYS 60 8.429 7.967 11.226 499 H PHE 61 H PHE 61 3.166 5.488 9.777 500 HA PHE 61 HA PHE 61 1.855 7.942 10.178 501 1HB PHE 61 1HB PHE 61 1.836 5.819 8.208 502 2HB PHE 61 2HB PHE 61 0.214 6.449 8.479 503 HD1 PHE 61 HD1 PHE 61 3.671 7.425 7.594 504 HD2 PHE 61 HD2 PHE 61 -0.443 8.512 7.581 505 HE1 PHE 61 HE1 PHE 61 4.190 9.353 6.159 506 HE2 PHE 61 HE2 PHE 61 0.068 10.444 6.144 507 HZ PHE 61 HZ PHE 61 2.388 10.866 5.432 508 H LEU 62 H LEU 62 0.632 4.612 10.545 509 HA LEU 62 HA LEU 62 -1.920 5.307 11.435 510 1HB LEU 62 1HB LEU 62 -2.184 3.050 12.054 511 2HB LEU 62 2HB LEU 62 -1.098 3.035 10.685 512 HG LEU 62 HG LEU 62 0.709 3.058 12.667 513 1HD1 LEU 62 1HD1 LEU 62 -0.587 2.983 14.569 514 2HD1 LEU 62 2HD1 LEU 62 -0.230 1.279 14.296 515 3HD1 LEU 62 3HD1 LEU 62 -1.797 1.937 13.830 516 1HD2 LEU 62 1HD2 LEU 62 0.882 0.636 12.359 517 2HD2 LEU 62 2HD2 LEU 62 0.620 1.468 10.826 518 3HD2 LEU 62 3HD2 LEU 62 -0.714 0.622 11.607 519 H LEU 63 H LEU 63 1.068 4.822 13.264 520 HA LEU 63 HA LEU 63 -0.153 5.074 15.814 521 1HB LEU 63 1HB LEU 63 2.699 5.832 15.334 522 2HB LEU 63 2HB LEU 63 1.987 5.002 16.706 523 HG LEU 63 HG LEU 63 2.050 3.638 14.046 524 1HD1 LEU 63 1HD1 LEU 63 4.309 3.167 15.893 525 2HD1 LEU 63 2HD1 LEU 63 4.362 4.629 14.906 526 3HD1 LEU 63 3HD1 LEU 63 4.234 3.048 14.135 527 1HD2 LEU 63 1HD2 LEU 63 0.802 2.759 16.056 528 2HD2 LEU 63 2HD2 LEU 63 2.378 2.504 16.806 529 3HD2 LEU 63 3HD2 LEU 63 1.962 1.657 15.315 530 H ARG 64 H ARG 64 0.792 7.306 13.402 531 HA ARG 64 HA ARG 64 1.064 9.597 15.105 532 1HB ARG 64 1HB ARG 64 1.152 9.056 12.217 533 2HB ARG 64 2HB ARG 64 0.529 10.645 12.636 534 1HG ARG 64 1HG ARG 64 3.185 9.505 13.491 535 2HG ARG 64 2HG ARG 64 2.926 10.713 12.230 536 1HD ARG 64 1HD ARG 64 2.021 11.144 15.063 537 2HD ARG 64 2HD ARG 64 3.649 11.545 14.537 538 HE ARG 64 HE ARG 64 1.170 12.813 13.600 539 1HH1 ARG 64 1HH1 ARG 64 4.662 12.782 13.807 540 2HH1 ARG 64 2HH1 ARG 64 4.829 14.402 13.228 541 1HH2 ARG 64 1HH2 ARG 64 1.401 14.939 12.833 542 2HH2 ARG 64 2HH2 ARG 64 2.984 15.625 12.674 543 H GLU 65 H GLU 65 -1.547 8.244 13.130 544 HA GLU 65 HA GLU 65 -3.340 10.382 13.995 545 1HB GLU 65 1HB GLU 65 -3.690 8.142 12.003 546 2HB GLU 65 2HB GLU 65 -4.969 9.268 12.436 547 1HG GLU 65 1HG GLU 65 -3.984 11.026 11.349 548 2HG GLU 65 2HG GLU 65 -2.362 10.346 11.490 549 H LEU 66 H LEU 66 -3.023 6.862 14.195 550 HA LEU 66 HA LEU 66 -5.409 6.509 15.733 551 1HB LEU 66 1HB LEU 66 -3.075 4.753 15.046 552 2HB LEU 66 2HB LEU 66 -4.248 4.239 16.228 553 HG LEU 66 HG LEU 66 -5.849 3.811 14.672 554 1HD1 LEU 66 1HD1 LEU 66 -5.252 6.346 13.643 555 2HD1 LEU 66 2HD1 LEU 66 -6.595 5.300 13.219 556 3HD1 LEU 66 3HD1 LEU 66 -5.096 5.225 12.300 557 1HD2 LEU 66 1HD2 LEU 66 -4.949 2.518 13.034 558 2HD2 LEU 66 2HD2 LEU 66 -3.547 2.723 14.082 559 3HD2 LEU 66 3HD2 LEU 66 -3.713 3.703 12.625 560 H GLY 67 H GLY 67 -5.441 7.672 17.603 561 1HA GLY 67 1HA GLY 67 -3.130 7.849 19.316 562 2HA GLY 67 2HA GLY 67 -4.722 8.512 19.641 563 H THR 68 H THR 68 -4.013 5.148 18.891 564 HA THR 68 HA THR 68 -4.728 4.433 21.650 565 HB THR 68 HB THR 68 -6.031 2.607 20.890 566 HG1 THR 68 HG1 THR 68 -4.771 1.851 19.221 567 1HG2 THR 68 1HG2 THR 68 -7.705 3.557 19.418 568 2HG2 THR 68 2HG2 THR 68 -6.604 4.875 19.005 569 3HG2 THR 68 3HG2 THR 68 -7.214 4.720 20.650 570 H ALA 69 H ALA 69 -4.052 2.120 22.138 571 HA ALA 69 HA ALA 69 -1.416 1.768 22.328 572 1HB ALA 69 1HB ALA 69 -2.345 -0.830 21.753 573 2HB ALA 69 2HB ALA 69 -3.691 0.048 22.480 574 3HB ALA 69 3HB ALA 69 -2.151 -0.066 23.333 575 H GLY 70 H GLY 70 -3.088 -0.085 19.779 576 1HA GLY 70 1HA GLY 70 -2.476 -0.151 17.492 577 2HA GLY 70 2HA GLY 70 -0.945 0.609 17.905 578 H ASN 71 H ASN 71 -2.581 -2.320 17.332 579 HA ASN 71 HA ASN 71 -0.140 -3.803 17.313 580 1HB ASN 71 1HB ASN 71 -0.908 -3.725 19.784 581 2HB ASN 71 2HB ASN 71 -2.160 -4.852 19.273 582 1HD2 ASN 71 1HD2 ASN 71 -1.663 -6.864 19.694 583 2HD2 ASN 71 2HD2 ASN 71 -0.085 -7.566 19.630 584 H LEU 72 H LEU 72 -0.643 -6.221 16.888 585 HA LEU 72 HA LEU 72 -2.801 -6.275 14.912 586 1HB LEU 72 1HB LEU 72 -1.569 -8.576 14.425 587 2HB LEU 72 2HB LEU 72 -0.998 -7.053 13.774 588 HG LEU 72 HG LEU 72 0.619 -6.914 15.678 589 1HD1 LEU 72 1HD1 LEU 72 -0.542 -9.618 16.256 590 2HD1 LEU 72 2HD1 LEU 72 -0.305 -8.259 17.353 591 3HD1 LEU 72 3HD1 LEU 72 1.086 -9.173 16.770 592 1HD2 LEU 72 1HD2 LEU 72 2.062 -8.826 14.807 593 2HD2 LEU 72 2HD2 LEU 72 1.526 -7.620 13.638 594 3HD2 LEU 72 3HD2 LEU 72 0.721 -9.187 13.719 595 H GLU 73 H GLU 73 -4.695 -7.104 15.511 596 HA GLU 73 HA GLU 73 -4.780 -9.085 17.681 597 1HB GLU 73 1HB GLU 73 -6.341 -6.849 17.211 598 2HB GLU 73 2HB GLU 73 -7.349 -8.160 16.616 599 1HG GLU 73 1HG GLU 73 -6.408 -9.076 19.057 600 2HG GLU 73 2HG GLU 73 -6.764 -7.369 19.327 601 H GLY 74 H GLY 74 -6.057 -11.000 17.441 602 1HA GLY 74 1HA GLY 74 -6.668 -12.915 16.337 603 2HA GLY 74 2HA GLY 74 -7.370 -11.841 15.137 604 H GLY 75 H GLY 75 -6.593 -14.002 14.017 605 1HA GLY 75 1HA GLY 75 -3.941 -14.503 13.412 606 2HA GLY 75 2HA GLY 75 -5.283 -14.838 12.327 607 H ARG 76 H ARG 76 -6.082 -12.074 12.032 608 HA ARG 76 HA ARG 76 -4.069 -11.286 10.083 609 1HB ARG 76 1HB ARG 76 -5.820 -9.548 9.463 610 2HB ARG 76 2HB ARG 76 -6.259 -11.227 9.200 611 1HG ARG 76 1HG ARG 76 -7.575 -11.216 11.254 612 2HG ARG 76 2HG ARG 76 -7.120 -9.537 11.538 613 1HD ARG 76 1HD ARG 76 -8.408 -8.754 9.784 614 2HD ARG 76 2HD ARG 76 -8.408 -10.310 8.956 615 HE ARG 76 HE ARG 76 -10.353 -9.396 10.760 616 1HH1 ARG 76 1HH1 ARG 76 -8.559 -12.287 9.978 617 2HH1 ARG 76 2HH1 ARG 76 -9.747 -13.352 10.648 618 1HH2 ARG 76 1HH2 ARG 76 -11.923 -10.799 11.617 619 2HH2 ARG 76 2HH2 ARG 76 -11.660 -12.510 11.567 620 H ALA 77 H ALA 77 -4.199 -8.557 9.963 621 HA ALA 77 HA ALA 77 -2.974 -7.858 12.528 622 1HB ALA 77 1HB ALA 77 -2.456 -7.119 9.775 623 2HB ALA 77 2HB ALA 77 -1.416 -7.016 11.195 624 3HB ALA 77 3HB ALA 77 -2.545 -5.715 10.837 625 H ILE 78 H ILE 78 -4.943 -7.681 13.634 626 HA ILE 78 HA ILE 78 -6.804 -5.571 12.905 627 HB ILE 78 HB ILE 78 -6.730 -7.362 15.311 628 1HG1 ILE 78 1HG1 ILE 78 -6.856 -8.574 13.128 629 2HG1 ILE 78 2HG1 ILE 78 -8.206 -8.865 14.214 630 1HG2 ILE 78 1HG2 ILE 78 -8.181 -5.764 15.976 631 2HG2 ILE 78 2HG2 ILE 78 -9.296 -6.818 15.107 632 3HG2 ILE 78 3HG2 ILE 78 -8.661 -5.367 14.334 633 1HD1 ILE 78 1HD1 ILE 78 -9.192 -8.623 12.135 634 2HD1 ILE 78 2HD1 ILE 78 -8.145 -7.282 11.678 635 3HD1 ILE 78 3HD1 ILE 78 -9.410 -7.046 12.878 636 H LEU 79 H LEU 79 -5.502 -3.664 13.229 637 HA LEU 79 HA LEU 79 -4.363 -3.219 15.858 638 1HB LEU 79 1HB LEU 79 -3.581 -1.091 14.951 639 2HB LEU 79 2HB LEU 79 -3.134 -2.433 13.911 640 HG LEU 79 HG LEU 79 -5.383 -1.788 12.695 641 1HD1 LEU 79 1HD1 LEU 79 -6.128 -0.064 14.131 642 2HD1 LEU 79 2HD1 LEU 79 -5.578 0.707 12.648 643 3HD1 LEU 79 3HD1 LEU 79 -4.561 0.741 14.090 644 1HD2 LEU 79 1HD2 LEU 79 -3.946 -1.361 11.075 645 2HD2 LEU 79 2HD2 LEU 79 -2.649 -1.343 12.270 646 3HD2 LEU 79 3HD2 LEU 79 -3.471 0.157 11.837 647 H GLN 80 H GLN 80 -4.764 -0.619 16.407 648 HA GLN 80 HA GLN 80 -7.671 -0.237 16.475 649 1HB GLN 80 1HB GLN 80 -6.502 -1.345 18.594 650 2HB GLN 80 2HB GLN 80 -6.132 0.334 18.961 651 1HG GLN 80 1HG GLN 80 -8.764 0.496 18.349 652 2HG GLN 80 2HG GLN 80 -8.676 -1.108 19.073 653 1HE2 GLN 80 1HE2 GLN 80 -9.266 2.014 19.732 654 2HE2 GLN 80 2HE2 GLN 80 -8.824 2.067 21.402 655 H GLY 81 H GLY 81 -8.356 1.903 16.949 656 1HA GLY 81 1HA GLY 81 -7.435 4.175 17.587 657 2HA GLY 81 2HA GLY 81 -6.315 3.919 16.275 658 H LYS 82 H LYS 82 -7.531 3.336 14.113 659 HA LYS 82 HA LYS 82 -10.143 4.131 13.674 660 1HB LYS 82 1HB LYS 82 -8.803 6.348 14.409 661 2HB LYS 82 2HB LYS 82 -8.541 6.415 12.682 662 1HG LYS 82 1HG LYS 82 -10.764 6.739 12.214 663 2HG LYS 82 2HG LYS 82 -11.296 5.942 13.695 664 1HD LYS 82 1HD LYS 82 -9.765 8.198 14.457 665 2HD LYS 82 2HD LYS 82 -10.889 8.727 13.205 666 1HE LYS 82 1HE LYS 82 -12.286 7.012 14.997 667 2HE LYS 82 2HE LYS 82 -11.403 8.205 15.948 668 1HZ LYS 82 1HZ LYS 82 -12.506 9.650 13.911 669 2HZ LYS 82 2HZ LYS 82 -13.082 9.567 15.499 670 3HZ LYS 82 3HZ LYS 82 -13.722 8.545 14.314 671 H PHE 83 H PHE 83 -7.913 5.685 11.495 672 HA PHE 83 HA PHE 83 -7.420 5.290 9.321 673 1HB PHE 83 1HB PHE 83 -6.823 2.764 10.738 674 2HB PHE 83 2HB PHE 83 -6.960 2.631 8.988 675 HD1 PHE 83 HD1 PHE 83 -4.551 1.912 9.124 676 HD2 PHE 83 HD2 PHE 83 -5.836 5.835 10.160 677 HE1 PHE 83 HE1 PHE 83 -2.249 2.735 8.854 678 HE2 PHE 83 HE2 PHE 83 -3.539 6.665 9.895 679 HZ PHE 83 HZ PHE 83 -1.738 5.114 9.236 680 H THR 84 H THR 84 -10.058 5.588 9.678 681 HA THR 84 HA THR 84 -11.540 3.429 8.458 682 HB THR 84 HB THR 84 -12.551 6.245 8.841 683 HG1 THR 84 HG1 THR 84 -11.599 4.770 10.800 684 1HG2 THR 84 1HG2 THR 84 -13.761 3.689 8.255 685 2HG2 THR 84 2HG2 THR 84 -14.418 5.318 8.115 686 3HG2 THR 84 3HG2 THR 84 -14.481 4.471 9.660 687 H HIS 85 H HIS 85 -10.143 3.379 6.541 688 HA HIS 85 HA HIS 85 -9.499 3.955 4.416 689 1HB HIS 85 1HB HIS 85 -11.515 4.639 2.974 690 2HB HIS 85 2HB HIS 85 -11.575 3.077 3.764 691 HD2 HIS 85 HD2 HIS 85 -13.359 6.530 3.904 692 HE1 HIS 85 HE1 HIS 85 -15.443 3.844 6.445 693 HE2 HIS 85 HE2 HIS 85 -15.478 6.103 5.327 694 H PHE 86 H PHE 86 -9.000 6.039 6.265 695 HA PHE 86 HA PHE 86 -9.777 8.483 4.887 696 1HB PHE 86 1HB PHE 86 -8.840 7.807 7.576 697 2HB PHE 86 2HB PHE 86 -8.076 9.250 6.914 698 HD1 PHE 86 HD1 PHE 86 -9.940 10.719 5.522 699 HD2 PHE 86 HD2 PHE 86 -10.633 8.255 8.919 700 HE1 PHE 86 HE1 PHE 86 -11.951 12.030 6.056 701 HE2 PHE 86 HE2 PHE 86 -12.646 9.562 9.462 702 HZ PHE 86 HZ PHE 86 -13.308 11.452 8.027 703 H LEU 87 H LEU 87 -6.670 7.773 6.389 704 HA LEU 87 HA LEU 87 -5.234 9.068 4.290 705 1HB LEU 87 1HB LEU 87 -4.724 8.177 6.943 706 2HB LEU 87 2HB LEU 87 -3.516 7.451 5.899 707 HG LEU 87 HG LEU 87 -2.721 9.554 6.840 708 1HD1 LEU 87 1HD1 LEU 87 -2.400 10.761 4.549 709 2HD1 LEU 87 2HD1 LEU 87 -3.170 9.314 3.901 710 3HD1 LEU 87 3HD1 LEU 87 -1.675 9.178 4.828 711 1HD2 LEU 87 1HD2 LEU 87 -4.650 11.136 5.233 712 2HD2 LEU 87 2HD2 LEU 87 -3.826 11.542 6.738 713 3HD2 LEU 87 3HD2 LEU 87 -5.214 10.452 6.758 714 H ILE 88 H ILE 88 -5.610 5.702 5.351 715 HA ILE 88 HA ILE 88 -3.855 4.509 3.564 716 HB ILE 88 HB ILE 88 -6.478 3.330 4.490 717 1HG1 ILE 88 1HG1 ILE 88 -3.776 3.438 5.843 718 2HG1 ILE 88 2HG1 ILE 88 -5.308 3.993 6.478 719 1HG2 ILE 88 1HG2 ILE 88 -4.598 2.375 2.697 720 2HG2 ILE 88 2HG2 ILE 88 -5.846 1.433 3.513 721 3HG2 ILE 88 3HG2 ILE 88 -4.225 1.539 4.202 722 1HD1 ILE 88 1HD1 ILE 88 -4.070 1.533 6.925 723 2HD1 ILE 88 2HD1 ILE 88 -5.423 1.178 5.856 724 3HD1 ILE 88 3HD1 ILE 88 -5.705 2.001 7.387 725 H ASN 89 H ASN 89 -7.400 4.658 3.175 726 HA ASN 89 HA ASN 89 -7.492 3.774 0.557 727 1HB ASN 89 1HB ASN 89 -9.329 4.788 2.435 728 2HB ASN 89 2HB ASN 89 -9.549 5.745 0.972 729 1HD2 ASN 89 1HD2 ASN 89 -8.873 3.775 -0.914 730 2HD2 ASN 89 2HD2 ASN 89 -10.113 2.573 -0.904 731 H GLU 90 H GLU 90 -7.172 7.108 1.727 732 HA GLU 90 HA GLU 90 -7.397 8.407 -0.730 733 1HB GLU 90 1HB GLU 90 -6.227 9.066 1.912 734 2HB GLU 90 2HB GLU 90 -5.718 10.060 0.555 735 1HG GLU 90 1HG GLU 90 -8.242 10.293 0.073 736 2HG GLU 90 2HG GLU 90 -8.446 9.730 1.731 737 H ARG 91 H ARG 91 -4.409 7.448 0.964 738 HA ARG 91 HA ARG 91 -2.662 8.231 -1.093 739 1HB ARG 91 1HB ARG 91 -2.390 6.236 1.129 740 2HB ARG 91 2HB ARG 91 -1.063 6.627 0.054 741 1HG ARG 91 1HG ARG 91 -2.338 8.966 1.256 742 2HG ARG 91 2HG ARG 91 -1.605 7.865 2.424 743 1HD ARG 91 1HD ARG 91 -0.155 9.750 1.406 744 2HD ARG 91 2HD ARG 91 0.519 8.126 1.535 745 HE ARG 91 HE ARG 91 -0.774 8.709 -0.978 746 1HH1 ARG 91 1HH1 ARG 91 2.229 8.757 0.805 747 2HH1 ARG 91 2HH1 ARG 91 3.213 8.691 -0.618 748 1HH2 ARG 91 1HH2 ARG 91 0.512 8.605 -2.838 749 2HH2 ARG 91 2HH2 ARG 91 2.237 8.608 -2.690 750 H ILE 92 H ILE 92 -4.004 5.013 -0.296 751 HA ILE 92 HA ILE 92 -2.700 3.562 -2.276 752 HB ILE 92 HB ILE 92 -5.480 3.138 -1.174 753 1HG1 ILE 92 1HG1 ILE 92 -2.786 2.009 -0.404 754 2HG1 ILE 92 2HG1 ILE 92 -3.835 3.030 0.571 755 1HG2 ILE 92 1HG2 ILE 92 -5.414 0.901 -2.022 756 2HG2 ILE 92 2HG2 ILE 92 -3.773 1.114 -2.614 757 3HG2 ILE 92 3HG2 ILE 92 -5.097 1.998 -3.362 758 1HD1 ILE 92 1HD1 ILE 92 -5.278 0.709 -0.233 759 2HD1 ILE 92 2HD1 ILE 92 -4.861 1.249 1.384 760 3HD1 ILE 92 3HD1 ILE 92 -3.748 0.235 0.485 761 H GLU 93 H GLU 93 -5.961 4.949 -2.367 762 HA GLU 93 HA GLU 93 -6.555 4.386 -5.024 763 1HB GLU 93 1HB GLU 93 -7.974 5.394 -3.036 764 2HB GLU 93 2HB GLU 93 -7.542 6.921 -3.796 765 1HG GLU 93 1HG GLU 93 -8.441 5.939 -5.949 766 2HG GLU 93 2HG GLU 93 -9.113 4.644 -4.955 767 H ASP 94 H ASP 94 -4.513 6.809 -3.652 768 HA ASP 94 HA ASP 94 -4.495 8.596 -5.856 769 1HB ASP 94 1HB ASP 94 -3.023 8.290 -3.331 770 2HB ASP 94 2HB ASP 94 -2.067 8.983 -4.636 771 H TYR 95 H TYR 95 -2.394 5.897 -4.904 772 HA TYR 95 HA TYR 95 -0.751 6.224 -7.271 773 1HB TYR 95 1HB TYR 95 -0.533 4.830 -4.731 774 2HB TYR 95 2HB TYR 95 -0.078 3.792 -6.078 775 HD1 TYR 95 HD1 TYR 95 0.994 6.354 -3.865 776 HD2 TYR 95 HD2 TYR 95 1.651 4.741 -7.747 777 HE1 TYR 95 HE1 TYR 95 3.210 7.418 -3.926 778 HE2 TYR 95 HE2 TYR 95 3.868 5.802 -7.819 779 HH TYR 95 HH TYR 95 5.070 7.615 -6.802 780 H VAL 96 H VAL 96 -2.684 3.542 -5.910 781 HA VAL 96 HA VAL 96 -2.591 1.891 -8.137 782 HB VAL 96 HB VAL 96 -4.922 2.154 -6.232 783 1HG1 VAL 96 1HG1 VAL 96 -4.229 0.270 -8.385 784 2HG1 VAL 96 2HG1 VAL 96 -5.801 0.689 -7.704 785 3HG1 VAL 96 3HG1 VAL 96 -4.760 -0.468 -6.875 786 1HG2 VAL 96 1HG2 VAL 96 -3.687 0.146 -5.157 787 2HG2 VAL 96 2HG2 VAL 96 -3.121 1.782 -4.818 788 3HG2 VAL 96 3HG2 VAL 96 -2.273 0.782 -5.997 789 H ASN 97 H ASN 97 -4.948 4.423 -7.327 790 HA ASN 97 HA ASN 97 -5.973 4.217 -10.076 791 1HB ASN 97 1HB ASN 97 -7.376 5.430 -7.679 792 2HB ASN 97 2HB ASN 97 -8.067 5.152 -9.276 793 1HD2 ASN 97 1HD2 ASN 97 -9.165 4.179 -6.898 794 2HD2 ASN 97 2HD2 ASN 97 -9.076 2.455 -6.915 795 H LYS 98 H LYS 98 -3.662 5.526 -9.995 796 HA LYS 98 HA LYS 98 -4.056 8.348 -9.529 797 1HB LYS 98 1HB LYS 98 -1.763 8.536 -10.615 798 2HB LYS 98 2HB LYS 98 -1.851 7.690 -9.086 799 1HG LYS 98 1HG LYS 98 -1.052 5.820 -9.973 800 2HG LYS 98 2HG LYS 98 -2.174 5.895 -11.331 801 1HD LYS 98 1HD LYS 98 -0.513 7.859 -12.040 802 2HD LYS 98 2HD LYS 98 0.611 6.876 -11.097 803 1HE LYS 98 1HE LYS 98 -1.036 6.016 -13.465 804 2HE LYS 98 2HE LYS 98 0.717 6.182 -13.392 805 1HZ LYS 98 1HZ LYS 98 0.516 3.953 -13.063 806 2HZ LYS 98 2HZ LYS 98 -0.997 4.068 -12.316 807 3HZ LYS 98 3HZ LYS 98 0.403 4.455 -11.451 808 H PHE 99 H PHE 99 -4.915 6.267 -12.001 809 HA PHE 99 HA PHE 99 -4.339 7.929 -14.248 810 1HB PHE 99 1HB PHE 99 -5.886 5.442 -13.760 811 2HB PHE 99 2HB PHE 99 -6.293 6.372 -15.199 812 HD1 PHE 99 HD1 PHE 99 -5.315 5.564 -17.103 813 HD2 PHE 99 HD2 PHE 99 -3.132 5.409 -13.451 814 HE1 PHE 99 HE1 PHE 99 -3.405 4.566 -18.291 815 HE2 PHE 99 HE2 PHE 99 -1.218 4.410 -14.634 816 HZ PHE 99 HZ PHE 99 -1.353 3.988 -17.055 817 H VAL 100 H VAL 100 -7.417 7.175 -12.591 818 HA VAL 100 HA VAL 100 -8.811 9.235 -14.019 819 HB VAL 100 HB VAL 100 -9.987 7.219 -13.337 820 1HG1 VAL 100 1HG1 VAL 100 -8.627 7.530 -10.937 821 2HG1 VAL 100 2HG1 VAL 100 -9.858 6.322 -11.305 822 3HG1 VAL 100 3HG1 VAL 100 -10.315 7.838 -10.529 823 1HG2 VAL 100 1HG2 VAL 100 -11.021 9.656 -13.356 824 2HG2 VAL 100 2HG2 VAL 100 -11.283 9.294 -11.650 825 3HG2 VAL 100 3HG2 VAL 100 -11.975 8.248 -12.890 826 H ILE 101 H ILE 101 -6.688 9.402 -11.468 827 HA ILE 101 HA ILE 101 -8.027 11.779 -10.354 828 HB ILE 101 HB ILE 101 -7.601 9.957 -8.731 829 1HG1 ILE 101 1HG1 ILE 101 -5.944 11.562 -7.282 830 2HG1 ILE 101 2HG1 ILE 101 -6.538 12.701 -8.488 831 1HG2 ILE 101 1HG2 ILE 101 -5.412 9.286 -8.135 832 2HG2 ILE 101 2HG2 ILE 101 -4.686 10.559 -9.115 833 3HG2 ILE 101 3HG2 ILE 101 -5.509 9.210 -9.894 834 1HD1 ILE 101 1HD1 ILE 101 -8.737 12.479 -7.782 835 2HD1 ILE 101 2HD1 ILE 101 -7.812 12.478 -6.280 836 3HD1 ILE 101 3HD1 ILE 101 -8.415 10.960 -6.946 837 H CYS 102 H CYS 102 -4.850 10.482 -11.342 838 HA CYS 102 HA CYS 102 -3.666 13.123 -11.259 839 1HB CYS 102 1HB CYS 102 -2.473 10.898 -10.711 840 2HB CYS 102 2HB CYS 102 -2.346 10.706 -12.457 841 H HIS 103 H HIS 103 -5.715 11.728 -13.360 842 HA HIS 103 HA HIS 103 -6.324 12.128 -15.508 843 1HB HIS 103 1HB HIS 103 -4.578 14.473 -14.898 844 2HB HIS 103 2HB HIS 103 -5.089 14.214 -16.563 845 HD2 HIS 103 HD2 HIS 103 -7.205 14.091 -13.204 846 HE1 HIS 103 HE1 HIS 103 -9.157 16.553 -16.058 847 HE2 HIS 103 HE2 HIS 103 -9.304 15.490 -13.777 848 H GLU 104 H GLU 104 -4.627 10.076 -15.286 849 HA GLU 104 HA GLU 104 -3.031 8.806 -16.314 850 1HB GLU 104 1HB GLU 104 -4.804 8.975 -18.036 851 2HB GLU 104 2HB GLU 104 -3.980 10.369 -18.721 852 1HG GLU 104 1HG GLU 104 -2.037 8.380 -18.587 853 2HG GLU 104 2HG GLU 104 -3.498 7.559 -19.133 854 H CYS 105 H CYS 105 -1.332 10.015 -15.145 855 HA CYS 105 HA CYS 105 0.117 12.080 -16.494 856 1HB CYS 105 1HB CYS 105 -0.019 11.287 -13.912 857 2HB CYS 105 2HB CYS 105 1.485 10.509 -14.389 858 H ASN 106 H ASN 106 0.051 10.471 -18.473 859 HA ASN 106 HA ASN 106 2.035 8.429 -18.525 860 1HB ASN 106 1HB ASN 106 -0.096 8.682 -19.965 861 2HB ASN 106 2HB ASN 106 0.878 9.734 -20.980 862 1HD2 ASN 106 1HD2 ASN 106 2.879 8.815 -21.835 863 2HD2 ASN 106 2HD2 ASN 106 2.921 7.132 -22.214 864 H ARG 107 H ARG 107 2.253 10.622 -21.216 865 HA ARG 107 HA ARG 107 4.983 11.312 -20.373 866 1HB ARG 107 1HB ARG 107 5.377 11.748 -22.826 867 2HB ARG 107 2HB ARG 107 5.059 10.072 -22.404 868 1HG ARG 107 1HG ARG 107 2.630 10.561 -23.051 869 2HG ARG 107 2HG ARG 107 3.261 12.023 -23.807 870 1HD ARG 107 1HD ARG 107 3.414 10.633 -25.599 871 2HD ARG 107 2HD ARG 107 4.964 10.247 -24.849 872 HE ARG 107 HE ARG 107 3.030 8.538 -23.788 873 1HH1 ARG 107 1HH1 ARG 107 4.577 9.146 -26.859 874 2HH1 ARG 107 2HH1 ARG 107 4.457 7.500 -27.384 875 1HH2 ARG 107 1HH2 ARG 107 2.872 6.374 -24.474 876 2HH2 ARG 107 2HH2 ARG 107 3.489 5.924 -26.030 877 HA PRO 108 HA PRO 108 2.269 15.244 -20.330 878 1HB PRO 108 1HB PRO 108 3.981 15.654 -17.935 879 2HB PRO 108 2HB PRO 108 2.265 16.009 -18.169 880 1HG PRO 108 1HG PRO 108 3.056 13.907 -16.723 881 2HG PRO 108 2HG PRO 108 1.618 13.831 -17.758 882 1HD PRO 108 1HD PRO 108 4.325 12.649 -18.190 883 2HD PRO 108 2HD PRO 108 2.729 12.054 -18.679 884 H ASP 109 H ASP 109 2.966 17.227 -21.025 885 HA ASP 109 HA ASP 109 5.715 17.373 -21.946 886 1HB ASP 109 1HB ASP 109 4.945 19.439 -23.100 887 2HB ASP 109 2HB ASP 109 3.977 18.026 -23.510 888 H THR 110 H THR 110 4.921 17.648 -19.050 889 HA THR 110 HA THR 110 6.083 20.298 -18.551 890 HB THR 110 HB THR 110 4.960 19.702 -16.173 891 HG1 THR 110 HG1 THR 110 3.071 18.700 -18.017 892 1HG2 THR 110 1HG2 THR 110 3.270 20.830 -18.378 893 2HG2 THR 110 2HG2 THR 110 4.617 21.717 -17.667 894 3HG2 THR 110 3HG2 THR 110 3.255 21.235 -16.665 895 H ARG 111 H ARG 111 7.074 20.283 -16.188 896 HA ARG 111 HA ARG 111 9.146 18.252 -16.294 897 1HB ARG 111 1HB ARG 111 8.838 20.925 -15.131 898 2HB ARG 111 2HB ARG 111 9.704 19.799 -14.096 899 1HG ARG 111 1HG ARG 111 11.358 19.419 -15.762 900 2HG ARG 111 2HG ARG 111 10.425 20.301 -16.970 901 1HD ARG 111 1HD ARG 111 10.654 22.339 -15.554 902 2HD ARG 111 2HD ARG 111 11.726 21.424 -14.495 903 HE ARG 111 HE ARG 111 13.396 21.848 -15.974 904 1HH1 ARG 111 1HH1 ARG 111 10.369 22.011 -17.711 905 2HH1 ARG 111 2HH1 ARG 111 11.116 22.412 -19.218 906 1HH2 ARG 111 1HH2 ARG 111 14.367 22.408 -17.951 907 2HH2 ARG 111 2HH2 ARG 111 13.380 22.652 -19.352 908 H ILE 112 H ILE 112 8.881 16.416 -15.292 909 HA ILE 112 HA ILE 112 7.316 16.335 -12.802 910 HB ILE 112 HB ILE 112 7.873 14.056 -14.703 911 1HG1 ILE 112 1HG1 ILE 112 5.182 14.492 -14.811 912 2HG1 ILE 112 2HG1 ILE 112 5.785 16.140 -14.661 913 1HG2 ILE 112 1HG2 ILE 112 5.947 14.269 -12.395 914 2HG2 ILE 112 2HG2 ILE 112 7.492 13.418 -12.356 915 3HG2 ILE 112 3HG2 ILE 112 6.206 12.865 -13.426 916 1HD1 ILE 112 1HD1 ILE 112 5.899 14.291 -16.908 917 2HD1 ILE 112 2HD1 ILE 112 7.427 15.104 -16.572 918 3HD1 ILE 112 3HD1 ILE 112 5.972 16.052 -16.878 919 H ILE 113 H ILE 113 8.108 15.118 -11.061 920 HA ILE 113 HA ILE 113 10.841 14.077 -11.263 921 HB ILE 113 HB ILE 113 9.926 15.938 -9.061 922 1HG1 ILE 113 1HG1 ILE 113 10.274 17.102 -11.233 923 2HG1 ILE 113 2HG1 ILE 113 11.424 17.599 -9.996 924 1HG2 ILE 113 1HG2 ILE 113 11.496 14.484 -8.123 925 2HG2 ILE 113 2HG2 ILE 113 12.431 15.914 -8.565 926 3HG2 ILE 113 3HG2 ILE 113 12.491 14.474 -9.580 927 1HD1 ILE 113 1HD1 ILE 113 13.133 16.205 -10.990 928 2HD1 ILE 113 2HD1 ILE 113 12.472 17.322 -12.183 929 3HD1 ILE 113 3HD1 ILE 113 11.988 15.629 -12.196 930 H ARG 114 H ARG 114 11.074 12.179 -10.196 931 HA ARG 114 HA ARG 114 9.079 11.456 -8.157 932 1HB ARG 114 1HB ARG 114 8.972 10.410 -10.643 933 2HB ARG 114 2HB ARG 114 10.104 9.291 -9.900 934 1HG ARG 114 1HG ARG 114 8.539 8.377 -8.549 935 2HG ARG 114 2HG ARG 114 7.618 9.867 -8.406 936 1HD ARG 114 1HD ARG 114 7.707 8.056 -10.808 937 2HD ARG 114 2HD ARG 114 6.381 8.189 -9.658 938 HE ARG 114 HE ARG 114 6.324 10.614 -10.426 939 1HH1 ARG 114 1HH1 ARG 114 7.298 7.980 -12.518 940 2HH1 ARG 114 2HH1 ARG 114 6.698 8.745 -13.947 941 1HH2 ARG 114 1HH2 ARG 114 5.490 11.569 -12.306 942 2HH2 ARG 114 2HH2 ARG 114 5.694 10.776 -13.832 943 H GLU 115 H GLU 115 10.016 10.826 -6.304 944 HA GLU 115 HA GLU 115 12.720 9.662 -6.434 945 1HB GLU 115 1HB GLU 115 12.902 11.937 -5.584 946 2HB GLU 115 2HB GLU 115 11.672 11.609 -4.374 947 1HG GLU 115 1HG GLU 115 13.443 11.277 -3.045 948 2HG GLU 115 2HG GLU 115 13.443 9.676 -3.772 949 H GLY 116 H GLY 116 13.202 8.031 -4.977 950 1HA GLY 116 1HA GLY 116 12.743 6.594 -3.147 951 2HA GLY 116 2HA GLY 116 11.067 7.117 -3.189 952 H ARG 117 H ARG 117 12.239 6.472 -6.291 953 HA ARG 117 HA ARG 117 11.806 4.832 -7.805 954 1HB ARG 117 1HB ARG 117 11.880 2.924 -5.465 955 2HB ARG 117 2HB ARG 117 12.186 2.549 -7.154 956 1HG ARG 117 1HG ARG 117 13.919 4.103 -5.253 957 2HG ARG 117 2HG ARG 117 14.284 2.586 -6.074 958 1HD ARG 117 1HD ARG 117 13.711 5.031 -7.691 959 2HD ARG 117 2HD ARG 117 15.283 4.845 -6.931 960 HE ARG 117 HE ARG 117 14.184 2.821 -8.769 961 1HH1 ARG 117 1HH1 ARG 117 16.806 4.907 -7.740 962 2HH1 ARG 117 2HH1 ARG 117 17.924 4.263 -8.891 963 1HH2 ARG 117 1HH2 ARG 117 15.664 1.990 -10.275 964 2HH2 ARG 117 2HH2 ARG 117 17.280 2.613 -10.327 965 H ILE 118 H ILE 118 9.656 6.017 -7.685 966 HA ILE 118 HA ILE 118 7.410 5.856 -8.029 967 HB ILE 118 HB ILE 118 7.685 2.927 -7.331 968 1HG1 ILE 118 1HG1 ILE 118 9.124 3.509 -9.218 969 2HG1 ILE 118 2HG1 ILE 118 7.741 2.573 -9.779 970 1HG2 ILE 118 1HG2 ILE 118 5.394 4.447 -7.617 971 2HG2 ILE 118 2HG2 ILE 118 5.506 2.692 -7.737 972 3HG2 ILE 118 3HG2 ILE 118 5.591 3.682 -9.193 973 1HD1 ILE 118 1HD1 ILE 118 8.167 5.536 -10.034 974 2HD1 ILE 118 2HD1 ILE 118 6.653 4.721 -10.422 975 3HD1 ILE 118 3HD1 ILE 118 8.117 4.336 -11.325 976 H SER 119 H SER 119 8.038 7.007 -5.779 977 HA SER 119 HA SER 119 6.047 5.995 -3.884 978 1HB SER 119 1HB SER 119 8.888 6.758 -3.203 979 2HB SER 119 2HB SER 119 7.608 6.606 -1.998 980 HG SER 119 HG SER 119 8.076 4.564 -2.016 981 H LEU 120 H LEU 120 8.169 8.688 -4.796 982 HA LEU 120 HA LEU 120 6.019 10.529 -3.997 983 1HB LEU 120 1HB LEU 120 8.919 11.242 -3.701 984 2HB LEU 120 2HB LEU 120 7.519 12.040 -3.012 985 HG LEU 120 HG LEU 120 7.438 9.475 -1.932 986 1HD1 LEU 120 1HD1 LEU 120 9.510 8.663 -2.106 987 2HD1 LEU 120 2HD1 LEU 120 9.931 9.846 -0.869 988 3HD1 LEU 120 3HD1 LEU 120 10.188 10.221 -2.573 989 1HD2 LEU 120 1HD2 LEU 120 7.288 12.049 -1.060 990 2HD2 LEU 120 2HD2 LEU 120 8.786 11.502 -0.305 991 3HD2 LEU 120 3HD2 LEU 120 7.284 10.626 -0.019 992 H LEU 121 H LEU 121 5.976 12.556 -5.157 993 HA LEU 121 HA LEU 121 7.728 13.175 -7.256 994 1HB LEU 121 1HB LEU 121 6.174 12.752 -9.173 995 2HB LEU 121 2HB LEU 121 6.883 11.320 -8.470 996 HG LEU 121 HG LEU 121 4.237 12.066 -7.391 997 1HD1 LEU 121 1HD1 LEU 121 4.062 12.592 -9.837 998 2HD1 LEU 121 2HD1 LEU 121 2.975 11.325 -9.274 999 3HD1 LEU 121 3HD1 LEU 121 4.434 10.901 -10.163 1000 1HD2 LEU 121 1HD2 LEU 121 5.316 10.029 -6.684 1001 2HD2 LEU 121 2HD2 LEU 121 5.499 9.501 -8.354 1002 3HD2 LEU 121 3HD2 LEU 121 3.893 9.625 -7.640 1003 H LYS 122 H LYS 122 6.781 14.896 -8.751 1004 HA LYS 122 HA LYS 122 4.783 16.480 -7.279 1005 1HB LYS 122 1HB LYS 122 7.137 17.408 -7.309 1006 2HB LYS 122 2HB LYS 122 6.961 17.593 -9.045 1007 1HG LYS 122 1HG LYS 122 5.919 19.522 -8.778 1008 2HG LYS 122 2HG LYS 122 4.702 18.759 -7.757 1009 1HD LYS 122 1HD LYS 122 7.149 19.088 -6.291 1010 2HD LYS 122 2HD LYS 122 6.662 20.627 -7.001 1011 1HE LYS 122 1HE LYS 122 4.856 18.856 -5.365 1012 2HE LYS 122 2HE LYS 122 5.742 20.234 -4.724 1013 1HZ LYS 122 1HZ LYS 122 3.469 20.199 -6.598 1014 2HZ LYS 122 2HZ LYS 122 4.539 21.508 -6.592 1015 3HZ LYS 122 3HZ LYS 122 3.680 21.117 -5.192 1016 H CYS 123 H CYS 123 3.202 17.530 -8.452 1017 HA CYS 123 HA CYS 123 3.168 17.184 -11.348 1018 1HB CYS 123 1HB CYS 123 1.184 16.013 -9.429 1019 2HB CYS 123 2HB CYS 123 0.684 16.466 -11.053 1020 H GLU 124 H GLU 124 3.676 19.531 -10.304 1021 HA GLU 124 HA GLU 124 1.604 21.171 -9.445 1022 1HB GLU 124 1HB GLU 124 4.023 21.848 -11.123 1023 2HB GLU 124 2HB GLU 124 2.979 23.042 -10.366 1024 1HG GLU 124 1HG GLU 124 3.707 21.240 -8.345 1025 2HG GLU 124 2HG GLU 124 5.175 21.584 -9.257 1026 H ALA 125 H ALA 125 2.459 20.108 -12.655 1027 HA ALA 125 HA ALA 125 0.864 21.958 -14.088 1028 1HB ALA 125 1HB ALA 125 1.377 20.694 -16.000 1029 2HB ALA 125 2HB ALA 125 1.631 19.223 -15.062 1030 3HB ALA 125 3HB ALA 125 2.789 20.546 -14.954 1031 H CYS 126 H CYS 126 0.324 18.439 -13.969 1032 HA CYS 126 HA CYS 126 -2.490 18.802 -14.431 1033 1HB CYS 126 1HB CYS 126 -2.603 16.371 -14.439 1034 2HB CYS 126 2HB CYS 126 -1.225 16.903 -15.397 1035 H GLY 127 H GLY 127 -2.115 20.176 -12.209 1036 1HA GLY 127 1HA GLY 127 -3.550 20.222 -10.285 1037 2HA GLY 127 2HA GLY 127 -3.345 18.482 -10.143 1038 H ALA 128 H ALA 128 -2.174 17.924 -8.446 1039 HA ALA 128 HA ALA 128 0.341 19.257 -7.908 1040 1HB ALA 128 1HB ALA 128 -2.023 19.472 -6.105 1041 2HB ALA 128 2HB ALA 128 -0.805 20.680 -6.516 1042 3HB ALA 128 3HB ALA 128 -0.409 19.371 -5.402 1043 H LYS 129 H LYS 129 1.728 18.055 -6.538 1044 HA LYS 129 HA LYS 129 0.833 15.461 -5.585 1045 1HB LYS 129 1HB LYS 129 2.495 15.843 -7.983 1046 2HB LYS 129 2HB LYS 129 3.127 14.683 -6.835 1047 1HG LYS 129 1HG LYS 129 0.330 14.594 -7.934 1048 2HG LYS 129 2HG LYS 129 1.693 13.712 -8.624 1049 1HD LYS 129 1HD LYS 129 1.738 13.150 -5.881 1050 2HD LYS 129 2HD LYS 129 0.043 13.046 -6.363 1051 1HE LYS 129 1HE LYS 129 1.311 11.751 -8.408 1052 2HE LYS 129 2HE LYS 129 2.301 11.307 -7.019 1053 1HZ LYS 129 1HZ LYS 129 0.761 9.743 -6.700 1054 2HZ LYS 129 2HZ LYS 129 -0.372 10.495 -7.705 1055 3HZ LYS 129 3HZ LYS 129 -0.216 10.985 -6.094 1056 H ALA 130 H ALA 130 2.344 14.486 -4.111 1057 HA ALA 130 HA ALA 130 3.938 16.467 -2.719 1058 1HB ALA 130 1HB ALA 130 3.536 15.258 -0.887 1059 2HB ALA 130 2HB ALA 130 4.036 13.755 -1.663 1060 3HB ALA 130 3HB ALA 130 2.393 14.356 -1.884 1061 HA PRO 131 HA PRO 131 7.519 14.891 -5.030 1062 1HB PRO 131 1HB PRO 131 9.142 16.984 -4.443 1063 2HB PRO 131 2HB PRO 131 7.925 17.041 -5.717 1064 1HG PRO 131 1HG PRO 131 7.813 18.138 -2.943 1065 2HG PRO 131 2HG PRO 131 7.233 18.852 -4.450 1066 1HD PRO 131 1HD PRO 131 5.598 17.618 -2.656 1067 2HD PRO 131 2HD PRO 131 5.270 17.678 -4.390 1068 H LEU 132 H LEU 132 8.812 16.813 -2.377 1069 HA LEU 132 HA LEU 132 9.531 14.431 -0.876 1070 1HB LEU 132 1HB LEU 132 11.395 16.042 -2.481 1071 2HB LEU 132 2HB LEU 132 11.910 15.776 -0.827 1072 HG LEU 132 HG LEU 132 10.981 13.341 -2.160 1073 1HD1 LEU 132 1HD1 LEU 132 11.959 14.441 -4.096 1074 2HD1 LEU 132 2HD1 LEU 132 12.961 13.094 -3.566 1075 3HD1 LEU 132 3HD1 LEU 132 13.439 14.744 -3.191 1076 1HD2 LEU 132 1HD2 LEU 132 13.614 13.072 -1.307 1077 2HD2 LEU 132 2HD2 LEU 132 12.161 12.607 -0.426 1078 3HD2 LEU 132 3HD2 LEU 132 12.882 14.192 -0.158 1079 H LYS 133 H LYS 133 10.786 15.126 1.151 1080 HA LYS 133 HA LYS 133 9.204 17.058 2.510 1081 1HB LYS 133 1HB LYS 133 10.975 14.970 3.213 1082 2HB LYS 133 2HB LYS 133 11.610 16.436 3.949 1083 1HG LYS 133 1HG LYS 133 10.167 15.424 5.529 1084 2HG LYS 133 2HG LYS 133 9.329 16.842 4.896 1085 1HD LYS 133 1HD LYS 133 8.744 14.520 3.292 1086 2HD LYS 133 2HD LYS 133 8.386 14.204 4.990 1087 1HE LYS 133 1HE LYS 133 7.115 16.375 5.013 1088 2HE LYS 133 2HE LYS 133 7.318 16.428 3.263 1089 1HZ LYS 133 1HZ LYS 133 5.766 14.862 2.956 1090 2HZ LYS 133 2HZ LYS 133 5.251 15.270 4.516 1091 3HZ LYS 133 3HZ LYS 133 6.264 13.937 4.283 1092 H ASN 134 H ASN 134 9.700 19.109 3.180 1093 HA ASN 134 HA ASN 134 11.570 20.564 1.605 1094 1HB ASN 134 1HB ASN 134 10.839 22.511 2.869 1095 2HB ASN 134 2HB ASN 134 9.444 21.534 2.422 1096 1HD2 ASN 134 1HD2 ASN 134 10.907 23.178 4.878 1097 2HD2 ASN 134 2HD2 ASN 134 10.098 22.454 6.223 1098 H VAL 135 H VAL 135 13.606 21.194 2.039 1099 HA VAL 135 HA VAL 135 14.859 20.120 4.435 1100 HB VAL 135 HB VAL 135 16.244 21.612 2.213 1101 1HG1 VAL 135 1HG1 VAL 135 17.177 20.766 4.632 1102 2HG1 VAL 135 2HG1 VAL 135 18.170 21.023 3.198 1103 3HG1 VAL 135 3HG1 VAL 135 17.589 19.406 3.589 1104 1HG2 VAL 135 1HG2 VAL 135 14.821 19.588 1.482 1105 2HG2 VAL 135 2HG2 VAL 135 16.038 18.623 2.317 1106 3HG2 VAL 135 3HG2 VAL 135 16.507 19.660 0.970 Start of MODEL 19 1 H MET 1 H MET 1 -5.851 -4.973 -23.727 2 HA MET 1 HA MET 1 -6.181 -2.088 -23.443 3 1HB MET 1 1HB MET 1 -6.900 -4.408 -21.642 4 2HB MET 1 2HB MET 1 -7.487 -2.754 -21.534 5 1HG MET 1 1HG MET 1 -8.948 -3.011 -23.275 6 2HG MET 1 2HG MET 1 -8.001 -4.295 -24.025 7 1HE MET 1 1HE MET 1 -10.980 -3.600 -23.280 8 2HE MET 1 2HE MET 1 -11.339 -3.914 -21.583 9 3HE MET 1 3HE MET 1 -11.765 -5.107 -22.811 10 H ASP 2 H ASP 2 -5.044 -4.747 -21.359 11 HA ASP 2 HA ASP 2 -3.321 -2.956 -19.914 12 1HB ASP 2 1HB ASP 2 -4.595 -5.323 -19.302 13 2HB ASP 2 2HB ASP 2 -2.912 -5.821 -19.457 14 H ASP 3 H ASP 3 -1.006 -3.566 -19.510 15 HA ASP 3 HA ASP 3 0.351 -3.746 -22.024 16 1HB ASP 3 1HB ASP 3 1.001 -2.981 -19.303 17 2HB ASP 3 2HB ASP 3 2.266 -3.992 -19.996 18 H TYR 4 H TYR 4 2.598 -5.161 -21.631 19 HA TYR 4 HA TYR 4 1.617 -7.916 -21.285 20 1HB TYR 4 1HB TYR 4 3.608 -6.733 -23.203 21 2HB TYR 4 2HB TYR 4 3.607 -8.456 -22.838 22 HD1 TYR 4 HD1 TYR 4 1.523 -5.702 -24.189 23 HD2 TYR 4 HD2 TYR 4 2.062 -9.909 -23.868 24 HE1 TYR 4 HE1 TYR 4 -0.241 -6.049 -25.867 25 HE2 TYR 4 HE2 TYR 4 0.301 -10.269 -25.547 26 HH TYR 4 HH TYR 4 -0.686 -8.794 -27.527 27 H GLU 5 H GLU 5 3.902 -5.579 -20.237 28 HA GLU 5 HA GLU 5 5.637 -7.585 -19.018 29 1HB GLU 5 1HB GLU 5 6.163 -5.124 -20.128 30 2HB GLU 5 2HB GLU 5 6.175 -4.767 -18.407 31 1HG GLU 5 1HG GLU 5 8.303 -5.408 -18.473 32 2HG GLU 5 2HG GLU 5 7.665 -7.050 -18.526 33 H LYS 6 H LYS 6 5.523 -8.149 -16.935 34 HA LYS 6 HA LYS 6 3.388 -7.230 -15.301 35 1HB LYS 6 1HB LYS 6 4.415 -9.529 -15.230 36 2HB LYS 6 2HB LYS 6 5.804 -8.815 -14.421 37 1HG LYS 6 1HG LYS 6 4.488 -8.202 -12.533 38 2HG LYS 6 2HG LYS 6 2.993 -8.637 -13.366 39 1HD LYS 6 1HD LYS 6 3.170 -10.738 -12.657 40 2HD LYS 6 2HD LYS 6 4.772 -10.881 -13.382 41 1HE LYS 6 1HE LYS 6 5.852 -10.249 -11.422 42 2HE LYS 6 2HE LYS 6 4.408 -9.487 -10.758 43 1HZ LYS 6 1HZ LYS 6 3.483 -11.884 -10.807 44 2HZ LYS 6 2HZ LYS 6 4.537 -11.432 -9.564 45 3HZ LYS 6 3HZ LYS 6 5.111 -12.342 -10.870 46 H LEU 7 H LEU 7 6.905 -6.787 -15.169 47 HA LEU 7 HA LEU 7 6.495 -4.283 -13.732 48 1HB LEU 7 1HB LEU 7 8.013 -6.649 -12.705 49 2HB LEU 7 2HB LEU 7 8.548 -5.031 -12.290 50 HG LEU 7 HG LEU 7 5.706 -5.850 -11.805 51 1HD1 LEU 7 1HD1 LEU 7 7.259 -7.543 -10.798 52 2HD1 LEU 7 2HD1 LEU 7 6.235 -6.683 -9.648 53 3HD1 LEU 7 3HD1 LEU 7 7.933 -6.240 -9.820 54 1HD2 LEU 7 1HD2 LEU 7 7.495 -3.634 -11.081 55 2HD2 LEU 7 2HD2 LEU 7 6.474 -4.236 -9.775 56 3HD2 LEU 7 3HD2 LEU 7 5.743 -3.666 -11.275 57 H LEU 8 H LEU 8 7.676 -2.738 -14.617 58 HA LEU 8 HA LEU 8 9.685 -3.425 -16.582 59 1HB LEU 8 1HB LEU 8 9.806 -0.801 -16.686 60 2HB LEU 8 2HB LEU 8 8.485 -1.678 -17.429 61 HG LEU 8 HG LEU 8 7.181 -1.228 -15.275 62 1HD1 LEU 8 1HD1 LEU 8 9.657 0.329 -14.801 63 2HD1 LEU 8 2HD1 LEU 8 8.608 -0.510 -13.659 64 3HD1 LEU 8 3HD1 LEU 8 8.123 1.052 -14.319 65 1HD2 LEU 8 1HD2 LEU 8 7.302 0.090 -17.616 66 2HD2 LEU 8 2HD2 LEU 8 7.739 1.387 -16.504 67 3HD2 LEU 8 3HD2 LEU 8 6.213 0.526 -16.299 68 H GLU 9 H GLU 9 11.701 -1.972 -16.613 69 HA GLU 9 HA GLU 9 12.790 -1.091 -14.142 70 1HB GLU 9 1HB GLU 9 14.595 -2.825 -13.997 71 2HB GLU 9 2HB GLU 9 12.985 -3.379 -13.561 72 1HG GLU 9 1HG GLU 9 12.985 -4.927 -15.147 73 2HG GLU 9 2HG GLU 9 13.545 -3.788 -16.371 74 H ARG 10 H ARG 10 12.939 -1.568 -17.501 75 HA ARG 10 HA ARG 10 15.653 -0.633 -17.835 76 1HB ARG 10 1HB ARG 10 14.556 -2.323 -19.336 77 2HB ARG 10 2HB ARG 10 13.514 -1.038 -19.930 78 1HG ARG 10 1HG ARG 10 15.683 0.179 -20.540 79 2HG ARG 10 2HG ARG 10 16.463 -1.388 -20.310 80 1HD ARG 10 1HD ARG 10 15.954 -1.721 -22.473 81 2HD ARG 10 2HD ARG 10 14.338 -2.070 -21.865 82 HE ARG 10 HE ARG 10 14.747 0.714 -22.391 83 1HH1 ARG 10 1HH1 ARG 10 13.927 -2.352 -23.847 84 2HH1 ARG 10 2HH1 ARG 10 13.075 -1.635 -25.172 85 1HH2 ARG 10 1HH2 ARG 10 13.631 1.656 -24.138 86 2HH2 ARG 10 2HH2 ARG 10 12.908 0.639 -25.339 87 H ALA 11 H ALA 11 16.149 1.450 -17.667 88 HA ALA 11 HA ALA 11 16.084 3.720 -17.820 89 1HB ALA 11 1HB ALA 11 14.113 4.164 -19.812 90 2HB ALA 11 2HB ALA 11 15.017 2.714 -20.249 91 3HB ALA 11 3HB ALA 11 15.868 4.232 -19.964 92 H ILE 12 H ILE 12 14.244 2.423 -15.980 93 HA ILE 12 HA ILE 12 12.011 4.341 -15.966 94 HB ILE 12 HB ILE 12 11.401 1.944 -15.990 95 1HG1 ILE 12 1HG1 ILE 12 9.985 2.046 -13.828 96 2HG1 ILE 12 2HG1 ILE 12 10.690 3.646 -13.618 97 1HG2 ILE 12 1HG2 ILE 12 13.499 1.606 -14.287 98 2HG2 ILE 12 2HG2 ILE 12 12.229 0.426 -14.596 99 3HG2 ILE 12 3HG2 ILE 12 12.117 1.487 -13.197 100 1HD1 ILE 12 1HD1 ILE 12 8.432 2.999 -15.072 101 2HD1 ILE 12 2HD1 ILE 12 9.676 3.288 -16.289 102 3HD1 ILE 12 3HD1 ILE 12 9.311 4.525 -15.093 103 H ASP 13 H ASP 13 14.877 3.415 -14.333 104 HA ASP 13 HA ASP 13 14.131 5.007 -11.976 105 1HB ASP 13 1HB ASP 13 15.872 3.794 -10.773 106 2HB ASP 13 2HB ASP 13 14.765 2.660 -11.540 107 H GLN 14 H GLN 14 17.273 4.890 -11.510 108 HA GLN 14 HA GLN 14 17.727 7.506 -12.641 109 1HB GLN 14 1HB GLN 14 19.901 5.972 -11.279 110 2HB GLN 14 2HB GLN 14 19.560 7.692 -11.238 111 1HG GLN 14 1HG GLN 14 18.287 7.511 -9.418 112 2HG GLN 14 2HG GLN 14 17.461 6.076 -10.017 113 1HE2 GLN 14 1HE2 GLN 14 19.089 7.063 -7.488 114 2HE2 GLN 14 2HE2 GLN 14 19.974 5.641 -7.063 115 H LEU 15 H LEU 15 17.388 5.906 -14.750 116 HA LEU 15 HA LEU 15 20.101 5.460 -15.817 117 1HB LEU 15 1HB LEU 15 17.549 3.948 -16.145 118 2HB LEU 15 2HB LEU 15 18.642 4.020 -17.511 119 HG LEU 15 HG LEU 15 19.002 1.974 -16.284 120 1HD1 LEU 15 1HD1 LEU 15 21.317 3.772 -15.635 121 2HD1 LEU 15 2HD1 LEU 15 20.943 3.244 -17.274 122 3HD1 LEU 15 3HD1 LEU 15 21.339 2.056 -16.036 123 1HD2 LEU 15 1HD2 LEU 15 20.155 3.016 -13.866 124 2HD2 LEU 15 2HD2 LEU 15 18.876 1.820 -14.077 125 3HD2 LEU 15 3HD2 LEU 15 18.477 3.537 -14.027 126 HA PRO 16 HA PRO 16 19.513 8.608 -18.865 127 1HB PRO 16 1HB PRO 16 20.137 7.125 -21.167 128 2HB PRO 16 2HB PRO 16 21.273 8.042 -20.176 129 1HG PRO 16 1HG PRO 16 20.653 5.128 -20.149 130 2HG PRO 16 2HG PRO 16 22.201 5.952 -19.888 131 1HD PRO 16 1HD PRO 16 20.827 4.935 -17.841 132 2HD PRO 16 2HD PRO 16 21.685 6.481 -17.680 133 HA PRO 17 HA PRO 17 15.245 7.466 -19.926 134 1HB PRO 17 1HB PRO 17 14.611 9.997 -20.844 135 2HB PRO 17 2HB PRO 17 14.452 9.457 -19.170 136 1HG PRO 17 1HG PRO 17 16.631 11.045 -20.453 137 2HG PRO 17 2HG PRO 17 15.910 11.221 -18.843 138 1HD PRO 17 1HD PRO 17 18.302 10.056 -19.198 139 2HD PRO 17 2HD PRO 17 17.169 9.494 -17.952 140 H GLU 18 H GLU 18 16.246 10.056 -22.124 141 HA GLU 18 HA GLU 18 16.600 10.119 -24.372 142 1HB GLU 18 1HB GLU 18 18.052 8.111 -23.982 143 2HB GLU 18 2HB GLU 18 16.656 7.099 -24.323 144 1HG GLU 18 1HG GLU 18 16.649 7.616 -26.557 145 2HG GLU 18 2HG GLU 18 17.476 9.155 -26.315 146 H VAL 19 H VAL 19 14.318 7.614 -23.324 147 HA VAL 19 HA VAL 19 12.631 8.132 -25.646 148 HB VAL 19 HB VAL 19 12.134 6.149 -23.426 149 1HG1 VAL 19 1HG1 VAL 19 10.181 6.596 -24.746 150 2HG1 VAL 19 2HG1 VAL 19 10.806 5.007 -25.187 151 3HG1 VAL 19 3HG1 VAL 19 11.091 6.391 -26.242 152 1HG2 VAL 19 1HG2 VAL 19 13.650 5.751 -26.004 153 2HG2 VAL 19 2HG2 VAL 19 13.127 4.454 -24.929 154 3HG2 VAL 19 3HG2 VAL 19 14.301 5.645 -24.368 155 H PHE 20 H PHE 20 10.871 9.390 -25.557 156 HA PHE 20 HA PHE 20 10.183 10.723 -23.101 157 1HB PHE 20 1HB PHE 20 9.708 11.119 -25.928 158 2HB PHE 20 2HB PHE 20 8.210 11.299 -25.024 159 HD1 PHE 20 HD1 PHE 20 8.223 12.900 -23.026 160 HD2 PHE 20 HD2 PHE 20 11.251 12.849 -26.017 161 HE1 PHE 20 HE1 PHE 20 8.875 15.190 -22.401 162 HE2 PHE 20 HE2 PHE 20 11.910 15.136 -25.395 163 HZ PHE 20 HZ PHE 20 10.721 16.310 -23.585 164 H GLU 21 H GLU 21 9.779 8.228 -22.429 165 HA GLU 21 HA GLU 21 6.904 7.696 -22.751 166 1HB GLU 21 1HB GLU 21 8.861 5.980 -23.326 167 2HB GLU 21 2HB GLU 21 8.742 5.650 -21.603 168 1HG GLU 21 1HG GLU 21 7.167 4.188 -22.170 169 2HG GLU 21 2HG GLU 21 6.125 5.594 -22.377 170 H THR 22 H THR 22 5.688 7.067 -20.890 171 HA THR 22 HA THR 22 6.718 8.287 -18.437 172 HB THR 22 HB THR 22 3.891 7.420 -19.059 173 HG1 THR 22 HG1 THR 22 4.531 9.071 -20.463 174 1HG2 THR 22 1HG2 THR 22 3.192 8.730 -17.234 175 2HG2 THR 22 2HG2 THR 22 4.794 9.438 -17.032 176 3HG2 THR 22 3HG2 THR 22 4.524 7.740 -16.641 177 H LYS 23 H LYS 23 6.491 7.247 -16.398 178 HA LYS 23 HA LYS 23 7.105 4.461 -16.488 179 1HB LYS 23 1HB LYS 23 6.992 4.704 -13.937 180 2HB LYS 23 2HB LYS 23 8.215 5.621 -14.795 181 1HG LYS 23 1HG LYS 23 7.075 7.643 -14.505 182 2HG LYS 23 2HG LYS 23 5.580 6.827 -14.040 183 1HD LYS 23 1HD LYS 23 6.277 7.329 -11.946 184 2HD LYS 23 2HD LYS 23 7.247 5.871 -12.147 185 1HE LYS 23 1HE LYS 23 8.085 8.743 -12.315 186 2HE LYS 23 2HE LYS 23 8.780 7.435 -11.361 187 1HZ LYS 23 1HZ LYS 23 9.362 6.444 -13.645 188 2HZ LYS 23 2HZ LYS 23 10.301 7.718 -13.052 189 3HZ LYS 23 3HZ LYS 23 9.123 8.013 -14.229 190 H ARG 24 H ARG 24 5.464 3.188 -17.147 191 HA ARG 24 HA ARG 24 2.779 3.544 -16.150 192 1HB ARG 24 1HB ARG 24 2.444 1.295 -17.432 193 2HB ARG 24 2HB ARG 24 2.678 2.786 -18.326 194 1HG ARG 24 1HG ARG 24 5.204 2.039 -18.264 195 2HG ARG 24 2HG ARG 24 4.487 0.448 -18.013 196 1HD ARG 24 1HD ARG 24 4.889 0.855 -20.375 197 2HD ARG 24 2HD ARG 24 3.165 0.725 -20.048 198 HE ARG 24 HE ARG 24 4.626 3.138 -20.804 199 1HH1 ARG 24 1HH1 ARG 24 1.590 1.652 -19.910 200 2HH1 ARG 24 2HH1 ARG 24 0.633 2.954 -20.531 201 1HH2 ARG 24 1HH2 ARG 24 3.366 4.847 -21.609 202 2HH2 ARG 24 2HH2 ARG 24 1.640 4.768 -21.494 203 H PHE 25 H PHE 25 2.408 3.020 -14.110 204 HA PHE 25 HA PHE 25 3.693 0.671 -12.942 205 1HB PHE 25 1HB PHE 25 2.572 3.187 -11.925 206 2HB PHE 25 2HB PHE 25 2.175 1.781 -10.944 207 HD1 PHE 25 HD1 PHE 25 4.597 4.259 -11.639 208 HD2 PHE 25 HD2 PHE 25 4.149 0.253 -10.276 209 HE1 PHE 25 HE1 PHE 25 6.817 4.374 -10.585 210 HE2 PHE 25 HE2 PHE 25 6.369 0.361 -9.219 211 HZ PHE 25 HZ PHE 25 7.706 2.423 -9.372 212 H GLU 26 H GLU 26 2.489 -0.930 -11.813 213 HA GLU 26 HA GLU 26 -0.385 -1.047 -12.294 214 1HB GLU 26 1HB GLU 26 1.251 -2.285 -14.073 215 2HB GLU 26 2HB GLU 26 1.029 -3.570 -12.894 216 1HG GLU 26 1HG GLU 26 -1.241 -3.725 -13.293 217 2HG GLU 26 2HG GLU 26 -1.337 -2.097 -13.964 218 H VAL 27 H VAL 27 -1.284 -1.489 -10.406 219 HA VAL 27 HA VAL 27 -0.234 -3.616 -8.720 220 HB VAL 27 HB VAL 27 -0.657 -0.837 -7.605 221 1HG1 VAL 27 1HG1 VAL 27 -0.159 -3.485 -6.403 222 2HG1 VAL 27 2HG1 VAL 27 -1.011 -2.085 -5.755 223 3HG1 VAL 27 3HG1 VAL 27 0.751 -2.135 -5.728 224 1HG2 VAL 27 1HG2 VAL 27 1.772 -0.772 -7.277 225 2HG2 VAL 27 2HG2 VAL 27 1.345 -0.881 -8.984 226 3HG2 VAL 27 3HG2 VAL 27 1.923 -2.309 -8.126 227 HA PRO 28 HA PRO 28 -4.612 -4.437 -8.413 228 1HB PRO 28 1HB PRO 28 -3.824 -5.485 -5.735 229 2HB PRO 28 2HB PRO 28 -4.793 -6.248 -7.001 230 1HG PRO 28 1HG PRO 28 -2.276 -6.992 -6.609 231 2HG PRO 28 2HG PRO 28 -2.928 -6.843 -8.252 232 1HD PRO 28 1HD PRO 28 -1.092 -5.022 -6.766 233 2HD PRO 28 2HD PRO 28 -1.120 -5.432 -8.493 234 H LYS 29 H LYS 29 -6.269 -4.340 -6.437 235 HA LYS 29 HA LYS 29 -5.992 -1.633 -5.337 236 1HB LYS 29 1HB LYS 29 -8.200 -3.149 -6.478 237 2HB LYS 29 2HB LYS 29 -8.619 -2.444 -4.923 238 1HG LYS 29 1HG LYS 29 -7.254 -0.483 -6.479 239 2HG LYS 29 2HG LYS 29 -8.540 -1.197 -7.453 240 1HD LYS 29 1HD LYS 29 -10.205 -0.539 -5.955 241 2HD LYS 29 2HD LYS 29 -9.055 -0.309 -4.635 242 1HE LYS 29 1HE LYS 29 -9.296 1.866 -5.164 243 2HE LYS 29 2HE LYS 29 -8.106 1.482 -6.406 244 1HZ LYS 29 1HZ LYS 29 -11.041 1.376 -6.837 245 2HZ LYS 29 2HZ LYS 29 -9.832 1.232 -8.011 246 3HZ LYS 29 3HZ LYS 29 -10.077 2.711 -7.228 247 H ALA 30 H ALA 30 -5.543 -1.424 -3.266 248 HA ALA 30 HA ALA 30 -6.256 -3.614 -1.430 249 1HB ALA 30 1HB ALA 30 -4.293 -3.346 -0.284 250 2HB ALA 30 2HB ALA 30 -4.151 -1.639 -0.704 251 3HB ALA 30 3HB ALA 30 -3.765 -2.875 -1.899 252 H TYR 31 H TYR 31 -7.264 -3.129 0.504 253 HA TYR 31 HA TYR 31 -7.658 -0.436 1.386 254 1HB TYR 31 1HB TYR 31 -10.087 -0.345 1.074 255 2HB TYR 31 2HB TYR 31 -9.256 -0.474 -0.469 256 HD1 TYR 31 HD1 TYR 31 -9.805 -2.183 -1.975 257 HD2 TYR 31 HD2 TYR 31 -11.115 -2.457 2.064 258 HE1 TYR 31 HE1 TYR 31 -11.221 -4.104 -2.570 259 HE2 TYR 31 HE2 TYR 31 -12.529 -4.381 1.480 260 HH TYR 31 HH TYR 31 -13.679 -5.176 -0.848 261 H SER 32 H SER 32 -7.998 -0.405 3.518 262 HA SER 32 HA SER 32 -8.149 -2.888 4.954 263 1HB SER 32 1HB SER 32 -8.531 -0.608 6.668 264 2HB SER 32 2HB SER 32 -7.140 -1.687 6.553 265 HG SER 32 HG SER 32 -6.514 -0.382 4.692 266 H VAL 33 H VAL 33 -9.638 -2.543 7.117 267 HA VAL 33 HA VAL 33 -12.347 -1.909 6.172 268 HB VAL 33 HB VAL 33 -12.334 -4.112 8.083 269 1HG1 VAL 33 1HG1 VAL 33 -13.562 -3.646 5.375 270 2HG1 VAL 33 2HG1 VAL 33 -14.329 -3.453 6.952 271 3HG1 VAL 33 3HG1 VAL 33 -13.887 -5.061 6.376 272 1HG2 VAL 33 1HG2 VAL 33 -10.248 -4.454 6.456 273 2HG2 VAL 33 2HG2 VAL 33 -11.519 -5.043 5.387 274 3HG2 VAL 33 3HG2 VAL 33 -11.278 -5.790 6.964 275 H ILE 34 H ILE 34 -13.632 -0.863 7.594 276 HA ILE 34 HA ILE 34 -12.406 0.012 10.076 277 HB ILE 34 HB ILE 34 -15.095 0.835 8.985 278 1HG1 ILE 34 1HG1 ILE 34 -13.430 2.911 8.396 279 2HG1 ILE 34 2HG1 ILE 34 -12.365 1.539 8.109 280 1HG2 ILE 34 1HG2 ILE 34 -13.231 2.424 10.720 281 2HG2 ILE 34 2HG2 ILE 34 -14.409 1.301 11.398 282 3HG2 ILE 34 3HG2 ILE 34 -14.952 2.674 10.433 283 1HD1 ILE 34 1HD1 ILE 34 -13.309 1.204 6.144 284 2HD1 ILE 34 2HD1 ILE 34 -14.343 2.606 6.414 285 3HD1 ILE 34 3HD1 ILE 34 -14.885 1.000 6.906 286 H GLN 35 H GLN 35 -13.136 -0.427 12.106 287 HA GLN 35 HA GLN 35 -15.580 -2.002 12.423 288 1HB GLN 35 1HB GLN 35 -12.897 -3.041 12.700 289 2HB GLN 35 2HB GLN 35 -13.752 -3.135 14.233 290 1HG GLN 35 1HG GLN 35 -15.485 -4.452 13.281 291 2HG GLN 35 2HG GLN 35 -14.872 -4.182 11.649 292 1HE2 GLN 35 1HE2 GLN 35 -14.818 -6.190 14.350 293 2HE2 GLN 35 2HE2 GLN 35 -13.519 -7.224 13.870 294 H GLY 36 H GLY 36 -16.519 -0.187 13.410 295 1HA GLY 36 1HA GLY 36 -17.096 1.138 15.198 296 2HA GLY 36 2HA GLY 36 -16.202 0.001 16.196 297 H ASN 37 H ASN 37 -13.902 0.335 16.461 298 HA ASN 37 HA ASN 37 -12.956 3.025 15.785 299 1HB ASN 37 1HB ASN 37 -13.932 2.989 18.116 300 2HB ASN 37 2HB ASN 37 -12.649 1.867 18.556 301 1HD2 ASN 37 1HD2 ASN 37 -11.734 3.264 20.028 302 2HD2 ASN 37 2HD2 ASN 37 -10.874 4.686 19.554 303 H ARG 38 H ARG 38 -12.378 0.104 15.060 304 HA ARG 38 HA ARG 38 -9.470 0.338 15.331 305 1HB ARG 38 1HB ARG 38 -9.743 -2.361 15.375 306 2HB ARG 38 2HB ARG 38 -9.542 -1.370 16.811 307 1HG ARG 38 1HG ARG 38 -11.683 -1.676 17.489 308 2HG ARG 38 2HG ARG 38 -12.302 -1.782 15.842 309 1HD ARG 38 1HD ARG 38 -12.507 -3.968 16.354 310 2HD ARG 38 2HD ARG 38 -10.806 -4.005 15.902 311 HE ARG 38 HE ARG 38 -10.235 -3.968 18.228 312 1HH1 ARG 38 1HH1 ARG 38 -13.632 -4.497 17.574 313 2HH1 ARG 38 2HH1 ARG 38 -13.949 -5.170 19.135 314 1HH2 ARG 38 1HH2 ARG 38 -10.666 -4.855 20.278 315 2HH2 ARG 38 2HH2 ARG 38 -12.273 -5.371 20.668 316 H THR 39 H THR 39 -8.254 -0.595 13.644 317 HA THR 39 HA THR 39 -9.827 -1.012 11.202 318 HB THR 39 HB THR 39 -7.657 0.671 11.721 319 HG1 THR 39 HG1 THR 39 -8.526 -0.151 9.159 320 1HG2 THR 39 1HG2 THR 39 -6.723 -1.209 9.594 321 2HG2 THR 39 2HG2 THR 39 -6.218 -1.425 11.267 322 3HG2 THR 39 3HG2 THR 39 -5.843 0.074 10.423 323 H PHE 40 H PHE 40 -9.910 -2.932 10.290 324 HA PHE 40 HA PHE 40 -8.236 -5.079 11.331 325 1HB PHE 40 1HB PHE 40 -10.742 -5.295 11.060 326 2HB PHE 40 2HB PHE 40 -10.484 -5.274 9.321 327 HD1 PHE 40 HD1 PHE 40 -9.161 -7.122 8.265 328 HD2 PHE 40 HD2 PHE 40 -10.430 -7.235 12.321 329 HE1 PHE 40 HE1 PHE 40 -8.822 -9.559 8.299 330 HE2 PHE 40 HE2 PHE 40 -10.088 -9.670 12.367 331 HZ PHE 40 HZ PHE 40 -9.286 -10.836 10.352 332 H ILE 41 H ILE 41 -6.267 -4.404 10.346 333 HA ILE 41 HA ILE 41 -6.112 -4.262 7.464 334 HB ILE 41 HB ILE 41 -4.480 -2.866 8.103 335 1HG1 ILE 41 1HG1 ILE 41 -3.121 -5.537 8.221 336 2HG1 ILE 41 2HG1 ILE 41 -2.931 -4.233 7.057 337 1HG2 ILE 41 1HG2 ILE 41 -4.593 -4.327 10.674 338 2HG2 ILE 41 2HG2 ILE 41 -4.861 -2.625 10.331 339 3HG2 ILE 41 3HG2 ILE 41 -3.224 -3.270 10.369 340 1HD1 ILE 41 1HD1 ILE 41 -2.040 -3.278 9.564 341 2HD1 ILE 41 2HD1 ILE 41 -1.097 -3.603 8.111 342 3HD1 ILE 41 3HD1 ILE 41 -1.337 -4.872 9.310 343 H GLN 42 H GLN 42 -6.191 -6.002 6.265 344 HA GLN 42 HA GLN 42 -5.069 -8.527 7.282 345 1HB GLN 42 1HB GLN 42 -7.532 -8.371 6.694 346 2HB GLN 42 2HB GLN 42 -7.031 -8.190 5.020 347 1HG GLN 42 1HG GLN 42 -5.866 -10.493 6.402 348 2HG GLN 42 2HG GLN 42 -7.617 -10.544 6.218 349 1HE2 GLN 42 1HE2 GLN 42 -7.458 -12.279 4.783 350 2HE2 GLN 42 2HE2 GLN 42 -6.934 -12.065 3.151 351 H ASN 43 H ASN 43 -5.318 -6.499 4.397 352 HA ASN 43 HA ASN 43 -3.246 -8.066 3.072 353 1HB ASN 43 1HB ASN 43 -5.265 -6.050 2.214 354 2HB ASN 43 2HB ASN 43 -3.775 -6.149 1.281 355 1HD2 ASN 43 1HD2 ASN 43 -3.147 -8.477 0.733 356 2HD2 ASN 43 2HD2 ASN 43 -4.424 -9.484 0.152 357 H PHE 44 H PHE 44 -2.296 -6.828 5.326 358 HA PHE 44 HA PHE 44 -1.349 -4.281 5.217 359 1HB PHE 44 1HB PHE 44 0.754 -5.264 6.411 360 2HB PHE 44 2HB PHE 44 -0.814 -5.313 7.196 361 HD1 PHE 44 HD1 PHE 44 1.641 -7.330 5.319 362 HD2 PHE 44 HD2 PHE 44 -1.808 -7.343 7.810 363 HE1 PHE 44 HE1 PHE 44 1.882 -9.758 5.634 364 HE2 PHE 44 HE2 PHE 44 -1.576 -9.770 8.128 365 HZ PHE 44 HZ PHE 44 0.273 -10.981 7.041 366 H ARG 45 H ARG 45 -0.299 -6.943 3.249 367 HA ARG 45 HA ARG 45 2.164 -5.708 2.453 368 1HB ARG 45 1HB ARG 45 1.787 -8.164 2.378 369 2HB ARG 45 2HB ARG 45 0.631 -7.913 1.076 370 1HG ARG 45 1HG ARG 45 2.457 -8.375 -0.174 371 2HG ARG 45 2HG ARG 45 2.694 -6.635 0.007 372 1HD ARG 45 1HD ARG 45 4.493 -6.886 1.347 373 2HD ARG 45 2HD ARG 45 3.814 -8.296 2.162 374 HE ARG 45 HE ARG 45 5.684 -8.341 0.070 375 1HH1 ARG 45 1HH1 ARG 45 2.760 -9.943 1.103 376 2HH1 ARG 45 2HH1 ARG 45 3.143 -11.432 0.306 377 1HH2 ARG 45 1HH2 ARG 45 6.191 -10.301 -0.980 378 2HH2 ARG 45 2HH2 ARG 45 5.094 -11.636 -0.873 379 H GLU 46 H GLU 46 -0.888 -6.347 0.723 380 HA GLU 46 HA GLU 46 -0.224 -4.729 -1.506 381 1HB GLU 46 1HB GLU 46 -2.012 -6.560 -1.371 382 2HB GLU 46 2HB GLU 46 -3.030 -5.336 -0.632 383 1HG GLU 46 1HG GLU 46 -3.665 -5.141 -2.813 384 2HG GLU 46 2HG GLU 46 -2.375 -3.942 -2.743 385 H VAL 47 H VAL 47 -2.031 -4.172 1.457 386 HA VAL 47 HA VAL 47 -2.828 -1.528 0.800 387 HB VAL 47 HB VAL 47 -2.507 -2.501 3.631 388 1HG1 VAL 47 1HG1 VAL 47 -3.167 -0.158 3.225 389 2HG1 VAL 47 2HG1 VAL 47 -4.420 -1.083 4.050 390 3HG1 VAL 47 3HG1 VAL 47 -4.573 -0.732 2.329 391 1HG2 VAL 47 1HG2 VAL 47 -5.146 -2.994 2.596 392 2HG2 VAL 47 2HG2 VAL 47 -4.043 -4.097 3.417 393 3HG2 VAL 47 3HG2 VAL 47 -3.946 -3.893 1.668 394 H ALA 48 H ALA 48 -0.042 -2.898 2.533 395 HA ALA 48 HA ALA 48 0.975 -0.475 3.490 396 1HB ALA 48 1HB ALA 48 2.150 -3.155 3.026 397 2HB ALA 48 2HB ALA 48 1.973 -2.244 4.525 398 3HB ALA 48 3HB ALA 48 3.223 -1.802 3.364 399 H ASP 49 H ASP 49 1.197 -1.954 0.358 400 HA ASP 49 HA ASP 49 3.391 -0.278 -0.488 401 1HB ASP 49 1HB ASP 49 2.831 -2.612 -1.401 402 2HB ASP 49 2HB ASP 49 1.563 -1.817 -2.329 403 H ALA 50 H ALA 50 0.067 -0.552 -1.773 404 HA ALA 50 HA ALA 50 0.075 1.762 -3.229 405 1HB ALA 50 1HB ALA 50 -1.770 0.464 -3.613 406 2HB ALA 50 2HB ALA 50 -2.469 1.780 -2.670 407 3HB ALA 50 3HB ALA 50 -2.107 0.237 -1.896 408 H LEU 51 H LEU 51 -0.894 1.492 0.211 409 HA LEU 51 HA LEU 51 -1.498 4.235 0.470 410 1HB LEU 51 1HB LEU 51 -2.503 2.921 2.099 411 2HB LEU 51 2HB LEU 51 -1.044 1.995 2.397 412 HG LEU 51 HG LEU 51 -0.044 3.924 3.504 413 1HD1 LEU 51 1HD1 LEU 51 -1.535 5.501 2.126 414 2HD1 LEU 51 2HD1 LEU 51 -1.052 5.961 3.758 415 3HD1 LEU 51 3HD1 LEU 51 -2.665 5.319 3.464 416 1HD2 LEU 51 1HD2 LEU 51 -2.709 3.009 4.547 417 2HD2 LEU 51 2HD2 LEU 51 -1.596 4.005 5.482 418 3HD2 LEU 51 3HD2 LEU 51 -1.110 2.395 4.962 419 H ASN 52 H ASN 52 1.416 2.328 1.241 420 HA ASN 52 HA ASN 52 2.967 4.784 1.044 421 1HB ASN 52 1HB ASN 52 2.305 3.694 3.574 422 2HB ASN 52 2HB ASN 52 4.002 3.341 3.296 423 1HD2 ASN 52 1HD2 ASN 52 4.785 5.539 1.852 424 2HD2 ASN 52 2HD2 ASN 52 4.653 6.953 2.836 425 H ARG 53 H ARG 53 3.966 4.024 -0.754 426 HA ARG 53 HA ARG 53 4.863 1.617 -1.506 427 1HB ARG 53 1HB ARG 53 5.339 4.181 -2.318 428 2HB ARG 53 2HB ARG 53 6.943 3.669 -1.818 429 1HG ARG 53 1HG ARG 53 5.444 1.781 -3.519 430 2HG ARG 53 2HG ARG 53 5.959 3.287 -4.279 431 1HD ARG 53 1HD ARG 53 7.700 1.250 -2.899 432 2HD ARG 53 2HD ARG 53 7.660 1.630 -4.621 433 HE ARG 53 HE ARG 53 8.332 3.833 -2.870 434 1HH1 ARG 53 1HH1 ARG 53 9.536 1.246 -4.879 435 2HH1 ARG 53 2HH1 ARG 53 11.092 1.976 -5.086 436 1HH2 ARG 53 1HH2 ARG 53 10.343 4.776 -3.137 437 2HH2 ARG 53 2HH2 ARG 53 11.555 3.990 -4.090 438 H ASP 54 H ASP 54 6.245 3.558 1.057 439 HA ASP 54 HA ASP 54 8.435 1.670 1.459 440 1HB ASP 54 1HB ASP 54 7.891 4.454 2.192 441 2HB ASP 54 2HB ASP 54 8.575 3.512 3.512 442 HA PRO 55 HA PRO 55 6.096 -0.503 4.555 443 1HB PRO 55 1HB PRO 55 8.109 -1.864 5.741 444 2HB PRO 55 2HB PRO 55 7.496 -2.279 4.135 445 1HG PRO 55 1HG PRO 55 9.933 -0.713 4.890 446 2HG PRO 55 2HG PRO 55 9.740 -1.951 3.634 447 1HD PRO 55 1HD PRO 55 9.730 0.718 3.106 448 2HD PRO 55 2HD PRO 55 8.836 -0.466 2.134 449 H GLN 56 H GLN 56 9.155 0.955 5.646 450 HA GLN 56 HA GLN 56 8.490 1.090 8.373 451 1HB GLN 56 1HB GLN 56 10.501 2.466 6.631 452 2HB GLN 56 2HB GLN 56 10.289 2.985 8.296 453 1HG GLN 56 1HG GLN 56 11.486 1.286 9.057 454 2HG GLN 56 2HG GLN 56 10.521 0.123 8.149 455 1HE2 GLN 56 1HE2 GLN 56 11.054 0.893 5.566 456 2HE2 GLN 56 2HE2 GLN 56 12.721 0.620 5.213 457 H HIS 57 H HIS 57 7.790 3.190 5.688 458 HA HIS 57 HA HIS 57 7.046 5.468 7.224 459 1HB HIS 57 1HB HIS 57 7.123 4.724 4.439 460 2HB HIS 57 2HB HIS 57 5.600 5.525 4.807 461 HD2 HIS 57 HD2 HIS 57 6.178 8.106 6.293 462 HE1 HIS 57 HE1 HIS 57 9.669 8.656 3.942 463 HE2 HIS 57 HE2 HIS 57 8.057 9.726 5.557 464 H LEU 58 H LEU 58 5.013 3.202 5.381 465 HA LEU 58 HA LEU 58 2.542 3.949 6.262 466 1HB LEU 58 1HB LEU 58 3.299 2.044 4.648 467 2HB LEU 58 2HB LEU 58 3.185 1.035 6.079 468 HG LEU 58 HG LEU 58 0.791 2.618 5.796 469 1HD1 LEU 58 1HD1 LEU 58 0.967 2.713 3.499 470 2HD1 LEU 58 2HD1 LEU 58 0.057 1.227 3.737 471 3HD1 LEU 58 3HD1 LEU 58 1.781 1.161 3.394 472 1HD2 LEU 58 1HD2 LEU 58 -0.208 0.691 6.435 473 2HD2 LEU 58 2HD2 LEU 58 1.440 0.263 6.895 474 3HD2 LEU 58 3HD2 LEU 58 0.777 -0.305 5.364 475 H LEU 59 H LEU 59 4.803 1.788 7.911 476 HA LEU 59 HA LEU 59 3.155 0.953 9.992 477 1HB LEU 59 1HB LEU 59 6.019 1.022 9.445 478 2HB LEU 59 2HB LEU 59 5.655 1.163 11.156 479 HG LEU 59 HG LEU 59 6.034 -1.164 10.514 480 1HD1 LEU 59 1HD1 LEU 59 3.403 -0.241 11.531 481 2HD1 LEU 59 2HD1 LEU 59 4.661 -1.182 12.331 482 3HD1 LEU 59 3HD1 LEU 59 3.590 -1.955 11.163 483 1HD2 LEU 59 1HD2 LEU 59 3.595 -0.865 8.766 484 2HD2 LEU 59 2HD2 LEU 59 4.561 -2.321 9.001 485 3HD2 LEU 59 3HD2 LEU 59 5.254 -0.928 8.172 486 H LYS 60 H LYS 60 5.514 3.632 10.051 487 HA LYS 60 HA LYS 60 4.774 4.618 12.566 488 1HB LYS 60 1HB LYS 60 6.452 5.459 10.364 489 2HB LYS 60 2HB LYS 60 5.607 6.832 11.064 490 1HG LYS 60 1HG LYS 60 7.499 6.801 12.339 491 2HG LYS 60 2HG LYS 60 6.430 5.800 13.325 492 1HD LYS 60 1HD LYS 60 7.676 4.077 11.470 493 2HD LYS 60 2HD LYS 60 8.939 5.125 12.118 494 1HE LYS 60 1HE LYS 60 8.908 3.343 13.610 495 2HE LYS 60 2HE LYS 60 7.924 4.564 14.417 496 1HZ LYS 60 1HZ LYS 60 6.582 2.758 14.628 497 2HZ LYS 60 2HZ LYS 60 7.112 2.032 13.196 498 3HZ LYS 60 3HZ LYS 60 6.020 3.320 13.136 499 H PHE 61 H PHE 61 3.175 4.825 9.524 500 HA PHE 61 HA PHE 61 1.671 7.197 10.092 501 1HB PHE 61 1HB PHE 61 1.935 5.323 7.887 502 2HB PHE 61 2HB PHE 61 0.251 5.754 8.171 503 HD1 PHE 61 HD1 PHE 61 3.484 6.890 6.998 504 HD2 PHE 61 HD2 PHE 61 -0.463 8.111 8.018 505 HE1 PHE 61 HE1 PHE 61 3.829 9.007 5.792 506 HE2 PHE 61 HE2 PHE 61 -0.125 10.226 6.813 507 HZ PHE 61 HZ PHE 61 2.023 10.677 5.697 508 H LEU 62 H LEU 62 0.955 3.706 10.182 509 HA LEU 62 HA LEU 62 -1.719 3.897 10.954 510 1HB LEU 62 1HB LEU 62 0.394 1.821 11.163 511 2HB LEU 62 2HB LEU 62 -0.996 1.631 12.211 512 HG LEU 62 HG LEU 62 -1.338 0.335 10.225 513 1HD1 LEU 62 1HD1 LEU 62 -3.301 1.880 9.220 514 2HD1 LEU 62 2HD1 LEU 62 -3.036 2.671 10.772 515 3HD1 LEU 62 3HD1 LEU 62 -3.437 0.959 10.714 516 1HD2 LEU 62 1HD2 LEU 62 -0.150 2.633 8.939 517 2HD2 LEU 62 2HD2 LEU 62 -1.645 2.143 8.141 518 3HD2 LEU 62 3HD2 LEU 62 -0.337 0.980 8.355 519 H LEU 63 H LEU 63 1.241 3.815 12.890 520 HA LEU 63 HA LEU 63 -0.214 3.996 15.365 521 1HB LEU 63 1HB LEU 63 2.357 3.217 14.641 522 2HB LEU 63 2HB LEU 63 2.590 4.694 15.559 523 HG LEU 63 HG LEU 63 0.901 3.463 17.223 524 1HD1 LEU 63 1HD1 LEU 63 2.402 1.196 15.924 525 2HD1 LEU 63 2HD1 LEU 63 0.675 1.504 15.747 526 3HD1 LEU 63 3HD1 LEU 63 1.340 1.092 17.328 527 1HD2 LEU 63 1HD2 LEU 63 3.174 2.364 18.119 528 2HD2 LEU 63 2HD2 LEU 63 2.809 4.084 18.263 529 3HD2 LEU 63 3HD2 LEU 63 3.841 3.508 16.954 530 H ARG 64 H ARG 64 1.076 6.228 13.065 531 HA ARG 64 HA ARG 64 1.547 8.430 14.725 532 1HB ARG 64 1HB ARG 64 1.483 7.939 11.927 533 2HB ARG 64 2HB ARG 64 0.466 9.337 12.232 534 1HG ARG 64 1HG ARG 64 2.860 9.842 11.707 535 2HG ARG 64 2HG ARG 64 2.249 10.547 13.204 536 1HD ARG 64 1HD ARG 64 3.230 8.278 14.202 537 2HD ARG 64 2HD ARG 64 4.270 8.412 12.788 538 HE ARG 64 HE ARG 64 5.411 10.021 13.917 539 1HH1 ARG 64 1HH1 ARG 64 2.121 10.011 15.086 540 2HH1 ARG 64 2HH1 ARG 64 2.411 11.210 16.298 541 1HH2 ARG 64 1HH2 ARG 64 5.795 11.609 15.518 542 2HH2 ARG 64 2HH2 ARG 64 4.495 12.115 16.545 543 H GLU 65 H GLU 65 -1.394 7.557 12.926 544 HA GLU 65 HA GLU 65 -2.879 9.648 14.281 545 1HB GLU 65 1HB GLU 65 -3.697 7.579 12.252 546 2HB GLU 65 2HB GLU 65 -4.796 8.767 12.925 547 1HG GLU 65 1HG GLU 65 -2.720 10.319 12.058 548 2HG GLU 65 2HG GLU 65 -2.781 9.042 10.843 549 H LEU 66 H LEU 66 -2.320 6.242 14.616 550 HA LEU 66 HA LEU 66 -4.610 5.404 15.921 551 1HB LEU 66 1HB LEU 66 -1.884 4.486 15.652 552 2HB LEU 66 2HB LEU 66 -2.517 4.113 17.240 553 HG LEU 66 HG LEU 66 -4.258 2.774 16.346 554 1HD1 LEU 66 1HD1 LEU 66 -5.260 3.241 14.425 555 2HD1 LEU 66 2HD1 LEU 66 -3.795 2.817 13.540 556 3HD1 LEU 66 3HD1 LEU 66 -4.043 4.473 14.091 557 1HD2 LEU 66 1HD2 LEU 66 -1.669 2.299 14.887 558 2HD2 LEU 66 2HD2 LEU 66 -3.002 1.146 14.926 559 3HD2 LEU 66 3HD2 LEU 66 -2.187 1.601 16.421 560 H GLY 67 H GLY 67 -5.452 6.965 17.275 561 1HA GLY 67 1HA GLY 67 -3.894 8.071 19.431 562 2HA GLY 67 2HA GLY 67 -5.605 8.332 19.138 563 H THR 68 H THR 68 -5.750 5.230 19.002 564 HA THR 68 HA THR 68 -6.174 4.914 21.873 565 HB THR 68 HB THR 68 -7.792 3.351 21.432 566 HG1 THR 68 HG1 THR 68 -6.053 2.400 19.644 567 1HG2 THR 68 1HG2 THR 68 -8.863 3.846 19.108 568 2HG2 THR 68 2HG2 THR 68 -7.710 5.179 19.090 569 3HG2 THR 68 3HG2 THR 68 -8.891 5.053 20.393 570 H ALA 69 H ALA 69 -5.734 2.611 22.690 571 HA ALA 69 HA ALA 69 -3.221 2.060 23.172 572 1HB ALA 69 1HB ALA 69 -5.464 0.187 22.635 573 2HB ALA 69 2HB ALA 69 -4.604 0.527 24.136 574 3HB ALA 69 3HB ALA 69 -3.852 -0.479 22.898 575 H GLY 70 H GLY 70 -4.663 0.443 20.331 576 1HA GLY 70 1HA GLY 70 -3.751 0.064 18.239 577 2HA GLY 70 2HA GLY 70 -2.363 1.029 18.715 578 H ASN 71 H ASN 71 -3.581 -2.126 18.234 579 HA ASN 71 HA ASN 71 -0.965 -3.254 18.556 580 1HB ASN 71 1HB ASN 71 -2.356 -3.221 20.883 581 2HB ASN 71 2HB ASN 71 -2.898 -4.756 20.210 582 1HD2 ASN 71 1HD2 ASN 71 -0.922 -3.732 22.388 583 2HD2 ASN 71 2HD2 ASN 71 0.443 -4.768 22.167 584 H LEU 72 H LEU 72 -0.984 -5.636 18.089 585 HA LEU 72 HA LEU 72 -2.795 -6.112 15.869 586 1HB LEU 72 1HB LEU 72 -1.243 -8.352 15.971 587 2HB LEU 72 2HB LEU 72 -0.892 -6.924 15.027 588 HG LEU 72 HG LEU 72 0.274 -6.334 17.462 589 1HD1 LEU 72 1HD1 LEU 72 -0.111 -8.585 18.279 590 2HD1 LEU 72 2HD1 LEU 72 1.610 -8.291 18.041 591 3HD1 LEU 72 3HD1 LEU 72 0.709 -9.252 16.867 592 1HD2 LEU 72 1HD2 LEU 72 1.952 -5.928 16.074 593 2HD2 LEU 72 2HD2 LEU 72 1.025 -6.693 14.784 594 3HD2 LEU 72 3HD2 LEU 72 2.154 -7.648 15.745 595 H GLU 73 H GLU 73 -4.716 -6.954 16.317 596 HA GLU 73 HA GLU 73 -4.941 -8.957 18.459 597 1HB GLU 73 1HB GLU 73 -6.632 -6.773 17.555 598 2HB GLU 73 2HB GLU 73 -7.516 -8.290 17.599 599 1HG GLU 73 1HG GLU 73 -5.931 -7.196 19.903 600 2HG GLU 73 2HG GLU 73 -7.657 -6.930 19.666 601 H GLY 74 H GLY 74 -6.201 -10.865 18.081 602 1HA GLY 74 1HA GLY 74 -6.744 -12.741 16.874 603 2HA GLY 74 2HA GLY 74 -7.399 -11.616 15.693 604 H GLY 75 H GLY 75 -6.499 -13.830 14.631 605 1HA GLY 75 1HA GLY 75 -3.802 -14.161 14.093 606 2HA GLY 75 2HA GLY 75 -5.095 -14.623 12.998 607 H ARG 76 H ARG 76 -6.010 -11.793 12.779 608 HA ARG 76 HA ARG 76 -4.106 -11.015 10.720 609 1HB ARG 76 1HB ARG 76 -6.883 -10.968 10.884 610 2HB ARG 76 2HB ARG 76 -6.419 -9.278 11.026 611 1HG ARG 76 1HG ARG 76 -6.863 -9.968 8.711 612 2HG ARG 76 2HG ARG 76 -5.217 -9.381 8.954 613 1HD ARG 76 1HD ARG 76 -5.100 -12.132 9.431 614 2HD ARG 76 2HD ARG 76 -6.132 -11.947 8.014 615 HE ARG 76 HE ARG 76 -3.685 -10.427 7.909 616 1HH1 ARG 76 1HH1 ARG 76 -5.201 -13.490 7.210 617 2HH1 ARG 76 2HH1 ARG 76 -4.078 -13.904 5.959 618 1HH2 ARG 76 1HH2 ARG 76 -2.210 -10.959 6.258 619 2HH2 ARG 76 2HH2 ARG 76 -2.377 -12.466 5.416 620 H ALA 77 H ALA 77 -4.546 -8.277 10.599 621 HA ALA 77 HA ALA 77 -3.047 -7.405 12.961 622 1HB ALA 77 1HB ALA 77 -2.069 -7.018 10.710 623 2HB ALA 77 2HB ALA 77 -2.284 -5.543 11.653 624 3HB ALA 77 3HB ALA 77 -3.413 -5.932 10.356 625 H ILE 78 H ILE 78 -5.396 -7.630 13.916 626 HA ILE 78 HA ILE 78 -7.190 -5.470 13.366 627 HB ILE 78 HB ILE 78 -7.108 -7.267 15.780 628 1HG1 ILE 78 1HG1 ILE 78 -9.004 -7.672 13.528 629 2HG1 ILE 78 2HG1 ILE 78 -7.349 -8.238 13.335 630 1HG2 ILE 78 1HG2 ILE 78 -8.591 -4.993 15.411 631 2HG2 ILE 78 2HG2 ILE 78 -8.993 -6.316 16.504 632 3HG2 ILE 78 3HG2 ILE 78 -9.692 -6.266 14.886 633 1HD1 ILE 78 1HD1 ILE 78 -9.456 -9.581 14.537 634 2HD1 ILE 78 2HD1 ILE 78 -8.441 -9.046 15.876 635 3HD1 ILE 78 3HD1 ILE 78 -7.749 -10.024 14.581 636 H LEU 79 H LEU 79 -5.976 -3.561 13.619 637 HA LEU 79 HA LEU 79 -4.882 -3.000 16.272 638 1HB LEU 79 1HB LEU 79 -3.851 -1.062 15.274 639 2HB LEU 79 2HB LEU 79 -3.508 -2.482 14.300 640 HG LEU 79 HG LEU 79 -5.654 -1.643 12.988 641 1HD1 LEU 79 1HD1 LEU 79 -4.799 1.043 13.130 642 2HD1 LEU 79 2HD1 LEU 79 -5.121 0.504 14.778 643 3HD1 LEU 79 3HD1 LEU 79 -6.375 0.372 13.546 644 1HD2 LEU 79 1HD2 LEU 79 -4.148 -0.514 11.429 645 2HD2 LEU 79 2HD2 LEU 79 -3.459 -2.026 12.018 646 3HD2 LEU 79 3HD2 LEU 79 -2.889 -0.487 12.665 647 H GLN 80 H GLN 80 -5.228 -0.604 16.969 648 HA GLN 80 HA GLN 80 -7.970 0.271 16.437 649 1HB GLN 80 1HB GLN 80 -8.156 0.689 18.984 650 2HB GLN 80 2HB GLN 80 -8.414 -0.944 18.380 651 1HG GLN 80 1HG GLN 80 -5.648 -0.604 18.945 652 2HG GLN 80 2HG GLN 80 -6.584 -0.051 20.331 653 1HE2 GLN 80 1HE2 GLN 80 -6.135 -1.695 21.697 654 2HE2 GLN 80 2HE2 GLN 80 -6.616 -3.334 21.433 655 H GLY 81 H GLY 81 -8.027 2.399 16.057 656 1HA GLY 81 1HA GLY 81 -6.727 4.331 17.622 657 2HA GLY 81 2HA GLY 81 -5.729 4.007 16.216 658 H LYS 82 H LYS 82 -5.971 5.550 14.765 659 HA LYS 82 HA LYS 82 -8.679 6.570 14.242 660 1HB LYS 82 1HB LYS 82 -6.055 8.057 14.149 661 2HB LYS 82 2HB LYS 82 -7.583 8.713 13.580 662 1HG LYS 82 1HG LYS 82 -8.357 8.064 16.024 663 2HG LYS 82 2HG LYS 82 -6.631 8.235 16.347 664 1HD LYS 82 1HD LYS 82 -6.695 10.492 15.356 665 2HD LYS 82 2HD LYS 82 -8.434 10.317 15.118 666 1HE LYS 82 1HE LYS 82 -8.850 10.893 17.228 667 2HE LYS 82 2HE LYS 82 -7.705 9.700 17.838 668 1HZ LYS 82 1HZ LYS 82 -6.211 11.277 18.231 669 2HZ LYS 82 2HZ LYS 82 -7.427 12.417 17.945 670 3HZ LYS 82 3HZ LYS 82 -6.386 11.959 16.692 671 H PHE 83 H PHE 83 -6.188 4.771 12.985 672 HA PHE 83 HA PHE 83 -6.374 5.676 10.238 673 1HB PHE 83 1HB PHE 83 -4.609 4.004 11.764 674 2HB PHE 83 2HB PHE 83 -5.197 3.093 10.376 675 HD1 PHE 83 HD1 PHE 83 -4.236 3.402 8.298 676 HD2 PHE 83 HD2 PHE 83 -3.660 6.338 11.301 677 HE1 PHE 83 HE1 PHE 83 -2.641 4.564 6.842 678 HE2 PHE 83 HE2 PHE 83 -2.055 7.514 9.854 679 HZ PHE 83 HZ PHE 83 -1.544 6.623 7.616 680 H THR 84 H THR 84 -8.892 5.149 11.150 681 HA THR 84 HA THR 84 -9.708 2.472 10.566 682 HB THR 84 HB THR 84 -12.016 3.947 10.523 683 HG1 THR 84 HG1 THR 84 -11.106 5.895 10.963 684 1HG2 THR 84 1HG2 THR 84 -11.002 2.065 12.154 685 2HG2 THR 84 2HG2 THR 84 -12.490 2.952 12.481 686 3HG2 THR 84 3HG2 THR 84 -10.976 3.462 13.229 687 H HIS 85 H HIS 85 -8.558 2.567 8.457 688 HA HIS 85 HA HIS 85 -8.496 2.697 6.184 689 1HB HIS 85 1HB HIS 85 -10.470 1.165 6.723 690 2HB HIS 85 2HB HIS 85 -11.504 2.537 6.343 691 HD2 HIS 85 HD2 HIS 85 -12.504 1.158 4.100 692 HE1 HIS 85 HE1 HIS 85 -8.874 1.341 1.914 693 HE2 HIS 85 HE2 HIS 85 -11.370 1.024 1.781 694 H PHE 86 H PHE 86 -8.514 5.224 7.456 695 HA PHE 86 HA PHE 86 -10.224 6.908 5.797 696 1HB PHE 86 1HB PHE 86 -8.758 7.267 8.326 697 2HB PHE 86 2HB PHE 86 -8.730 8.663 7.253 698 HD1 PHE 86 HD1 PHE 86 -10.904 6.374 9.130 699 HD2 PHE 86 HD2 PHE 86 -10.674 9.978 6.884 700 HE1 PHE 86 HE1 PHE 86 -13.169 6.977 9.878 701 HE2 PHE 86 HE2 PHE 86 -12.939 10.591 7.627 702 HZ PHE 86 HZ PHE 86 -14.190 9.089 9.126 703 H LEU 87 H LEU 87 -6.911 7.553 6.818 704 HA LEU 87 HA LEU 87 -6.184 8.801 4.406 705 1HB LEU 87 1HB LEU 87 -4.940 8.144 6.940 706 2HB LEU 87 2HB LEU 87 -3.818 7.920 5.613 707 HG LEU 87 HG LEU 87 -3.490 10.122 6.419 708 1HD1 LEU 87 1HD1 LEU 87 -5.062 11.181 4.286 709 2HD1 LEU 87 2HD1 LEU 87 -4.381 9.630 3.793 710 3HD1 LEU 87 3HD1 LEU 87 -3.320 10.918 4.363 711 1HD2 LEU 87 1HD2 LEU 87 -6.337 10.903 5.982 712 2HD2 LEU 87 2HD2 LEU 87 -5.116 11.634 7.024 713 3HD2 LEU 87 3HD2 LEU 87 -5.869 10.107 7.485 714 H ILE 88 H ILE 88 -5.996 5.485 5.506 715 HA ILE 88 HA ILE 88 -4.133 4.418 3.738 716 HB ILE 88 HB ILE 88 -6.685 3.106 4.674 717 1HG1 ILE 88 1HG1 ILE 88 -3.941 3.173 5.956 718 2HG1 ILE 88 2HG1 ILE 88 -5.408 3.920 6.582 719 1HG2 ILE 88 1HG2 ILE 88 -5.849 1.756 2.972 720 2HG2 ILE 88 2HG2 ILE 88 -5.223 1.022 4.446 721 3HG2 ILE 88 3HG2 ILE 88 -4.173 2.026 3.449 722 1HD1 ILE 88 1HD1 ILE 88 -6.385 1.575 6.627 723 2HD1 ILE 88 2HD1 ILE 88 -5.151 1.959 7.821 724 3HD1 ILE 88 3HD1 ILE 88 -4.733 1.009 6.396 725 H ASN 89 H ASN 89 -7.653 4.273 3.365 726 HA ASN 89 HA ASN 89 -7.744 3.395 0.749 727 1HB ASN 89 1HB ASN 89 -9.631 3.755 2.523 728 2HB ASN 89 2HB ASN 89 -9.799 5.328 1.756 729 1HD2 ASN 89 1HD2 ASN 89 -11.368 5.365 0.357 730 2HD2 ASN 89 2HD2 ASN 89 -11.829 4.085 -0.707 731 H GLU 90 H GLU 90 -7.881 6.744 1.911 732 HA GLU 90 HA GLU 90 -8.195 8.041 -0.518 733 1HB GLU 90 1HB GLU 90 -8.242 9.045 1.812 734 2HB GLU 90 2HB GLU 90 -6.485 9.089 1.731 735 1HG GLU 90 1HG GLU 90 -6.458 10.745 0.154 736 2HG GLU 90 2HG GLU 90 -8.050 10.322 -0.474 737 H ARG 91 H ARG 91 -5.155 7.344 1.172 738 HA ARG 91 HA ARG 91 -3.444 8.351 -0.802 739 1HB ARG 91 1HB ARG 91 -3.211 6.668 1.597 740 2HB ARG 91 2HB ARG 91 -1.946 6.428 0.400 741 1HG ARG 91 1HG ARG 91 -2.468 9.233 0.858 742 2HG ARG 91 2HG ARG 91 -2.039 8.387 2.346 743 1HD ARG 91 1HD ARG 91 -0.313 7.475 0.283 744 2HD ARG 91 2HD ARG 91 -0.345 9.237 0.236 745 HE ARG 91 HE ARG 91 0.275 7.703 2.677 746 1HH1 ARG 91 1HH1 ARG 91 0.870 10.356 0.499 747 2HH1 ARG 91 2HH1 ARG 91 2.129 11.023 1.471 748 1HH2 ARG 91 1HH2 ARG 91 1.909 8.604 3.973 749 2HH2 ARG 91 2HH2 ARG 91 2.713 10.048 3.451 750 H ILE 92 H ILE 92 -4.458 5.001 -0.158 751 HA ILE 92 HA ILE 92 -3.005 3.790 -2.199 752 HB ILE 92 HB ILE 92 -5.615 3.008 -0.908 753 1HG1 ILE 92 1HG1 ILE 92 -2.862 1.801 -0.634 754 2HG1 ILE 92 2HG1 ILE 92 -3.464 3.073 0.420 755 1HG2 ILE 92 1HG2 ILE 92 -4.493 0.709 -1.992 756 2HG2 ILE 92 2HG2 ILE 92 -4.376 1.908 -3.280 757 3HG2 ILE 92 3HG2 ILE 92 -5.941 1.544 -2.552 758 1HD1 ILE 92 1HD1 ILE 92 -5.312 1.583 1.084 759 2HD1 ILE 92 2HD1 ILE 92 -3.717 0.950 1.492 760 3HD1 ILE 92 3HD1 ILE 92 -4.591 0.307 0.102 761 H GLU 93 H GLU 93 -6.454 4.739 -2.253 762 HA GLU 93 HA GLU 93 -6.901 4.173 -4.953 763 1HB GLU 93 1HB GLU 93 -8.322 5.445 -2.796 764 2HB GLU 93 2HB GLU 93 -8.546 6.366 -4.276 765 1HG GLU 93 1HG GLU 93 -10.176 4.938 -4.746 766 2HG GLU 93 2HG GLU 93 -8.905 3.771 -5.102 767 H ASP 94 H ASP 94 -5.357 6.873 -3.416 768 HA ASP 94 HA ASP 94 -5.580 8.715 -5.554 769 1HB ASP 94 1HB ASP 94 -3.877 8.492 -3.113 770 2HB ASP 94 2HB ASP 94 -3.396 9.627 -4.370 771 H TYR 95 H TYR 95 -3.101 6.332 -4.671 772 HA TYR 95 HA TYR 95 -1.513 7.015 -6.998 773 1HB TYR 95 1HB TYR 95 -1.070 5.564 -4.513 774 2HB TYR 95 2HB TYR 95 -0.398 4.723 -5.906 775 HD1 TYR 95 HD1 TYR 95 0.731 6.509 -3.383 776 HD2 TYR 95 HD2 TYR 95 0.511 6.916 -7.615 777 HE1 TYR 95 HE1 TYR 95 2.682 8.004 -3.336 778 HE2 TYR 95 HE2 TYR 95 2.464 8.412 -7.576 779 HH TYR 95 HH TYR 95 4.474 8.743 -4.887 780 H VAL 96 H VAL 96 -2.982 3.979 -5.779 781 HA VAL 96 HA VAL 96 -2.589 2.521 -8.126 782 HB VAL 96 HB VAL 96 -3.257 1.573 -5.883 783 1HG1 VAL 96 1HG1 VAL 96 -5.129 2.553 -5.055 784 2HG1 VAL 96 2HG1 VAL 96 -5.893 1.213 -5.899 785 3HG1 VAL 96 3HG1 VAL 96 -5.845 2.808 -6.642 786 1HG2 VAL 96 1HG2 VAL 96 -3.988 0.710 -8.540 787 2HG2 VAL 96 2HG2 VAL 96 -5.068 0.036 -7.319 788 3HG2 VAL 96 3HG2 VAL 96 -3.328 -0.216 -7.192 789 H ASN 97 H ASN 97 -5.239 4.656 -7.177 790 HA ASN 97 HA ASN 97 -6.415 4.286 -9.847 791 1HB ASN 97 1HB ASN 97 -7.819 3.777 -7.754 792 2HB ASN 97 2HB ASN 97 -7.828 5.513 -7.480 793 1HD2 ASN 97 1HD2 ASN 97 -9.789 6.187 -7.945 794 2HD2 ASN 97 2HD2 ASN 97 -10.669 5.825 -9.387 795 H LYS 98 H LYS 98 -4.203 5.838 -9.780 796 HA LYS 98 HA LYS 98 -4.910 8.610 -9.380 797 1HB LYS 98 1HB LYS 98 -2.632 9.097 -10.185 798 2HB LYS 98 2HB LYS 98 -2.649 7.949 -8.856 799 1HG LYS 98 1HG LYS 98 -1.333 6.672 -10.085 800 2HG LYS 98 2HG LYS 98 -2.733 6.355 -11.112 801 1HD LYS 98 1HD LYS 98 -2.072 7.888 -12.709 802 2HD LYS 98 2HD LYS 98 -1.108 8.820 -11.562 803 1HE LYS 98 1HE LYS 98 -0.344 6.017 -12.297 804 2HE LYS 98 2HE LYS 98 0.100 7.374 -13.330 805 1HZ LYS 98 1HZ LYS 98 1.217 6.551 -10.818 806 2HZ LYS 98 2HZ LYS 98 0.840 8.200 -10.852 807 3HZ LYS 98 3HZ LYS 98 1.875 7.545 -12.018 808 H PHE 99 H PHE 99 -5.328 6.381 -11.844 809 HA PHE 99 HA PHE 99 -4.925 7.994 -14.135 810 1HB PHE 99 1HB PHE 99 -4.935 5.615 -14.369 811 2HB PHE 99 2HB PHE 99 -6.527 5.484 -13.638 812 HD1 PHE 99 HD1 PHE 99 -8.411 5.388 -14.967 813 HD2 PHE 99 HD2 PHE 99 -4.777 6.857 -16.624 814 HE1 PHE 99 HE1 PHE 99 -9.437 5.393 -17.200 815 HE2 PHE 99 HE2 PHE 99 -5.802 6.863 -18.864 816 HZ PHE 99 HZ PHE 99 -8.133 6.131 -19.151 817 H VAL 100 H VAL 100 -7.951 6.977 -12.529 818 HA VAL 100 HA VAL 100 -9.436 8.956 -14.035 819 HB VAL 100 HB VAL 100 -10.368 6.707 -13.672 820 1HG1 VAL 100 1HG1 VAL 100 -11.454 6.469 -11.296 821 2HG1 VAL 100 2HG1 VAL 100 -10.113 7.509 -10.817 822 3HG1 VAL 100 3HG1 VAL 100 -9.792 5.957 -11.591 823 1HG2 VAL 100 1HG2 VAL 100 -12.615 7.403 -13.199 824 2HG2 VAL 100 2HG2 VAL 100 -11.807 8.685 -14.099 825 3HG2 VAL 100 3HG2 VAL 100 -12.042 8.842 -12.358 826 H ILE 101 H ILE 101 -7.609 9.208 -11.313 827 HA ILE 101 HA ILE 101 -9.446 11.163 -10.099 828 HB ILE 101 HB ILE 101 -8.554 9.229 -8.678 829 1HG1 ILE 101 1HG1 ILE 101 -9.545 11.501 -7.914 830 2HG1 ILE 101 2HG1 ILE 101 -8.699 10.507 -6.736 831 1HG2 ILE 101 1HG2 ILE 101 -6.383 9.213 -7.893 832 2HG2 ILE 101 2HG2 ILE 101 -6.082 10.880 -8.379 833 3HG2 ILE 101 3HG2 ILE 101 -6.198 9.614 -9.595 834 1HD1 ILE 101 1HD1 ILE 101 -7.370 12.750 -8.219 835 2HD1 ILE 101 2HD1 ILE 101 -6.803 11.904 -6.781 836 3HD1 ILE 101 3HD1 ILE 101 -8.204 12.969 -6.683 837 H CYS 102 H CYS 102 -6.026 10.653 -10.985 838 HA CYS 102 HA CYS 102 -5.434 13.468 -10.692 839 1HB CYS 102 1HB CYS 102 -3.814 11.604 -10.130 840 2HB CYS 102 2HB CYS 102 -3.643 11.339 -11.861 841 H HIS 103 H HIS 103 -7.416 12.766 -12.724 842 HA HIS 103 HA HIS 103 -7.952 13.159 -14.903 843 1HB HIS 103 1HB HIS 103 -5.741 15.205 -14.617 844 2HB HIS 103 2HB HIS 103 -6.969 15.195 -15.877 845 HD2 HIS 103 HD2 HIS 103 -9.547 14.666 -13.810 846 HE1 HIS 103 HE1 HIS 103 -8.279 18.366 -12.162 847 HE2 HIS 103 HE2 HIS 103 -10.191 16.742 -12.407 848 H GLU 104 H GLU 104 -6.363 10.960 -14.698 849 HA GLU 104 HA GLU 104 -4.906 9.595 -15.794 850 1HB GLU 104 1HB GLU 104 -6.562 9.666 -17.503 851 2HB GLU 104 2HB GLU 104 -6.042 11.253 -18.045 852 1HG GLU 104 1HG GLU 104 -3.771 9.785 -18.400 853 2HG GLU 104 2HG GLU 104 -5.022 8.594 -18.725 854 H CYS 105 H CYS 105 -3.149 10.778 -14.601 855 HA CYS 105 HA CYS 105 -1.562 12.634 -16.120 856 1HB CYS 105 1HB CYS 105 -1.793 12.090 -13.442 857 2HB CYS 105 2HB CYS 105 -0.258 11.321 -13.841 858 H ASN 106 H ASN 106 -1.935 10.337 -17.639 859 HA ASN 106 HA ASN 106 0.265 8.536 -17.379 860 1HB ASN 106 1HB ASN 106 -1.997 8.924 -19.252 861 2HB ASN 106 2HB ASN 106 -0.557 8.175 -19.935 862 1HD2 ASN 106 1HD2 ASN 106 -2.869 7.939 -17.285 863 2HD2 ASN 106 2HD2 ASN 106 -2.762 6.225 -17.104 864 H ARG 107 H ARG 107 -0.557 10.634 -20.127 865 HA ARG 107 HA ARG 107 2.168 10.770 -20.982 866 1HB ARG 107 1HB ARG 107 -0.410 11.992 -21.901 867 2HB ARG 107 2HB ARG 107 1.115 12.589 -22.541 868 1HG ARG 107 1HG ARG 107 0.158 9.737 -22.683 869 2HG ARG 107 2HG ARG 107 0.084 10.915 -23.994 870 1HD ARG 107 1HD ARG 107 2.258 10.679 -24.487 871 2HD ARG 107 2HD ARG 107 2.739 10.629 -22.794 872 HE ARG 107 HE ARG 107 1.958 8.251 -22.841 873 1HH1 ARG 107 1HH1 ARG 107 3.058 9.834 -25.764 874 2HH1 ARG 107 2HH1 ARG 107 3.493 8.351 -26.541 875 1HH2 ARG 107 1HH2 ARG 107 2.533 6.315 -23.872 876 2HH2 ARG 107 2HH2 ARG 107 3.198 6.358 -25.472 877 HA PRO 108 HA PRO 108 3.665 14.239 -18.692 878 1HB PRO 108 1HB PRO 108 4.952 15.117 -21.218 879 2HB PRO 108 2HB PRO 108 5.680 14.768 -19.647 880 1HG PRO 108 1HG PRO 108 5.968 13.078 -21.684 881 2HG PRO 108 2HG PRO 108 5.726 12.481 -20.031 882 1HD PRO 108 1HD PRO 108 3.766 12.660 -22.288 883 2HD PRO 108 2HD PRO 108 3.987 11.372 -21.084 884 H ASP 109 H ASP 109 1.222 14.879 -19.030 885 HA ASP 109 HA ASP 109 0.892 17.199 -20.766 886 1HB ASP 109 1HB ASP 109 -0.894 15.354 -19.301 887 2HB ASP 109 2HB ASP 109 -1.430 17.029 -19.344 888 H THR 110 H THR 110 1.938 16.524 -17.644 889 HA THR 110 HA THR 110 1.609 19.313 -16.859 890 HB THR 110 HB THR 110 0.656 18.780 -14.783 891 HG1 THR 110 HG1 THR 110 1.603 17.086 -13.935 892 1HG2 THR 110 1HG2 THR 110 -0.592 16.797 -16.656 893 2HG2 THR 110 2HG2 THR 110 -0.957 18.521 -16.611 894 3HG2 THR 110 3HG2 THR 110 -1.313 17.508 -15.221 895 H ARG 111 H ARG 111 2.840 19.611 -14.658 896 HA ARG 111 HA ARG 111 5.519 18.547 -15.077 897 1HB ARG 111 1HB ARG 111 4.331 20.907 -13.773 898 2HB ARG 111 2HB ARG 111 5.700 20.213 -12.915 899 1HG ARG 111 1HG ARG 111 5.951 20.695 -15.838 900 2HG ARG 111 2HG ARG 111 6.031 22.070 -14.734 901 1HD ARG 111 1HD ARG 111 8.073 21.513 -14.027 902 2HD ARG 111 2HD ARG 111 7.627 19.818 -13.833 903 HE ARG 111 HE ARG 111 8.120 20.767 -16.543 904 1HH1 ARG 111 1HH1 ARG 111 9.302 19.025 -13.751 905 2HH1 ARG 111 2HH1 ARG 111 10.535 18.197 -14.638 906 1HH2 ARG 111 1HH2 ARG 111 9.745 19.678 -17.703 907 2HH2 ARG 111 2HH2 ARG 111 10.788 18.569 -16.879 908 H ILE 112 H ILE 112 5.625 16.505 -14.271 909 HA ILE 112 HA ILE 112 4.515 15.951 -11.622 910 HB ILE 112 HB ILE 112 5.769 13.638 -12.800 911 1HG1 ILE 112 1HG1 ILE 112 3.717 15.010 -14.555 912 2HG1 ILE 112 2HG1 ILE 112 5.412 14.767 -14.957 913 1HG2 ILE 112 1HG2 ILE 112 2.928 14.370 -12.144 914 2HG2 ILE 112 2HG2 ILE 112 4.066 13.450 -11.166 915 3HG2 ILE 112 3HG2 ILE 112 3.439 12.763 -12.658 916 1HD1 ILE 112 1HD1 ILE 112 3.211 12.758 -14.798 917 2HD1 ILE 112 2HD1 ILE 112 4.896 12.264 -14.642 918 3HD1 ILE 112 3HD1 ILE 112 4.347 13.077 -16.108 919 H ILE 113 H ILE 113 5.750 15.808 -9.845 920 HA ILE 113 HA ILE 113 8.622 15.211 -10.111 921 HB ILE 113 HB ILE 113 7.587 17.399 -8.301 922 1HG1 ILE 113 1HG1 ILE 113 9.259 18.551 -10.220 923 2HG1 ILE 113 2HG1 ILE 113 8.203 17.480 -11.137 924 1HG2 ILE 113 1HG2 ILE 113 9.583 16.396 -7.462 925 2HG2 ILE 113 2HG2 ILE 113 10.012 17.962 -8.152 926 3HG2 ILE 113 3HG2 ILE 113 10.356 16.481 -9.045 927 1HD1 ILE 113 1HD1 ILE 113 7.464 19.811 -9.414 928 2HD1 ILE 113 2HD1 ILE 113 6.285 18.580 -9.868 929 3HD1 ILE 113 3HD1 ILE 113 7.098 19.527 -11.116 930 H ARG 114 H ARG 114 9.405 13.865 -8.529 931 HA ARG 114 HA ARG 114 7.760 13.471 -6.135 932 1HB ARG 114 1HB ARG 114 7.958 11.067 -6.257 933 2HB ARG 114 2HB ARG 114 7.223 11.665 -7.732 934 1HG ARG 114 1HG ARG 114 10.166 11.245 -7.679 935 2HG ARG 114 2HG ARG 114 9.104 9.841 -7.786 936 1HD ARG 114 1HD ARG 114 8.288 10.445 -9.851 937 2HD ARG 114 2HD ARG 114 8.652 12.152 -9.613 938 HE ARG 114 HE ARG 114 10.644 10.074 -10.244 939 1HH1 ARG 114 1HH1 ARG 114 9.574 13.402 -10.340 940 2HH1 ARG 114 2HH1 ARG 114 10.970 13.950 -11.203 941 1HH2 ARG 114 1HH2 ARG 114 12.470 10.801 -11.384 942 2HH2 ARG 114 2HH2 ARG 114 12.609 12.477 -11.798 943 H GLU 115 H GLU 115 8.826 13.097 -4.260 944 HA GLU 115 HA GLU 115 11.734 12.676 -4.362 945 1HB GLU 115 1HB GLU 115 11.399 15.092 -4.122 946 2HB GLU 115 2HB GLU 115 10.356 14.821 -2.734 947 1HG GLU 115 1HG GLU 115 12.171 15.115 -1.494 948 2HG GLU 115 2HG GLU 115 12.660 13.509 -2.025 949 H GLY 116 H GLY 116 12.622 11.641 -2.553 950 1HA GLY 116 1HA GLY 116 12.592 10.580 -0.468 951 2HA GLY 116 2HA GLY 116 10.870 10.916 -0.347 952 H ARG 117 H ARG 117 12.196 9.471 -3.213 953 HA ARG 117 HA ARG 117 11.911 7.440 -4.181 954 1HB ARG 117 1HB ARG 117 11.942 6.584 -1.284 955 2HB ARG 117 2HB ARG 117 11.890 5.448 -2.619 956 1HG ARG 117 1HG ARG 117 14.039 5.802 -3.210 957 2HG ARG 117 2HG ARG 117 14.017 7.486 -2.689 958 1HD ARG 117 1HD ARG 117 14.374 6.925 -0.452 959 2HD ARG 117 2HD ARG 117 13.854 5.257 -0.693 960 HE ARG 117 HE ARG 117 16.014 4.742 -1.175 961 1HH1 ARG 117 1HH1 ARG 117 15.545 8.141 -1.807 962 2HH1 ARG 117 2HH1 ARG 117 17.189 8.411 -2.273 963 1HH2 ARG 117 1HH2 ARG 117 18.182 5.095 -1.783 964 2HH2 ARG 117 2HH2 ARG 117 18.689 6.682 -2.256 965 H ILE 118 H ILE 118 9.778 8.599 -4.650 966 HA ILE 118 HA ILE 118 7.542 8.453 -5.035 967 HB ILE 118 HB ILE 118 7.813 5.623 -4.006 968 1HG1 ILE 118 1HG1 ILE 118 8.117 6.750 -6.799 969 2HG1 ILE 118 2HG1 ILE 118 9.382 6.011 -5.822 970 1HG2 ILE 118 1HG2 ILE 118 5.555 7.135 -4.858 971 2HG2 ILE 118 2HG2 ILE 118 5.630 5.448 -4.351 972 3HG2 ILE 118 3HG2 ILE 118 5.868 5.870 -6.046 973 1HD1 ILE 118 1HD1 ILE 118 6.962 4.408 -6.454 974 2HD1 ILE 118 2HD1 ILE 118 8.629 3.892 -6.204 975 3HD1 ILE 118 3HD1 ILE 118 8.165 4.673 -7.715 976 H SER 119 H SER 119 8.009 9.820 -2.848 977 HA SER 119 HA SER 119 6.129 8.773 -0.826 978 1HB SER 119 1HB SER 119 8.379 8.991 0.103 979 2HB SER 119 2HB SER 119 8.460 10.668 -0.440 980 HG SER 119 HG SER 119 7.372 9.660 1.809 981 H LEU 120 H LEU 120 7.289 11.654 -2.507 982 HA LEU 120 HA LEU 120 4.643 12.859 -2.079 983 1HB LEU 120 1HB LEU 120 5.701 15.080 -2.028 984 2HB LEU 120 2HB LEU 120 6.102 14.080 -0.654 985 HG LEU 120 HG LEU 120 8.162 13.632 -2.484 986 1HD1 LEU 120 1HD1 LEU 120 8.917 16.109 -2.652 987 2HD1 LEU 120 2HD1 LEU 120 7.197 16.462 -2.507 988 3HD1 LEU 120 3HD1 LEU 120 7.781 15.471 -3.840 989 1HD2 LEU 120 1HD2 LEU 120 7.896 14.117 0.155 990 2HD2 LEU 120 2HD2 LEU 120 8.576 15.654 -0.379 991 3HD2 LEU 120 3HD2 LEU 120 9.441 14.150 -0.695 992 H LEU 121 H LEU 121 3.999 14.397 -3.691 993 HA LEU 121 HA LEU 121 5.434 14.525 -6.180 994 1HB LEU 121 1HB LEU 121 3.990 12.277 -5.745 995 2HB LEU 121 2HB LEU 121 2.779 13.291 -6.492 996 HG LEU 121 HG LEU 121 5.284 13.294 -7.971 997 1HD1 LEU 121 1HD1 LEU 121 4.952 10.906 -6.855 998 2HD1 LEU 121 2HD1 LEU 121 5.534 11.102 -8.508 999 3HD1 LEU 121 3HD1 LEU 121 3.838 10.721 -8.208 1000 1HD2 LEU 121 1HD2 LEU 121 2.746 12.262 -9.067 1001 2HD2 LEU 121 2HD2 LEU 121 3.886 13.427 -9.731 1002 3HD2 LEU 121 3HD2 LEU 121 2.748 13.927 -8.487 1003 H LYS 122 H LYS 122 4.737 16.267 -7.444 1004 HA LYS 122 HA LYS 122 2.372 17.719 -6.430 1005 1HB LYS 122 1HB LYS 122 4.604 19.031 -7.945 1006 2HB LYS 122 2HB LYS 122 3.413 19.768 -6.882 1007 1HG LYS 122 1HG LYS 122 4.904 19.696 -5.253 1008 2HG LYS 122 2HG LYS 122 4.811 17.935 -5.296 1009 1HD LYS 122 1HD LYS 122 6.746 17.724 -6.483 1010 2HD LYS 122 2HD LYS 122 6.527 19.262 -7.319 1011 1HE LYS 122 1HE LYS 122 8.432 19.188 -5.682 1012 2HE LYS 122 2HE LYS 122 7.274 20.494 -5.435 1013 1HZ LYS 122 1HZ LYS 122 6.493 18.204 -3.966 1014 2HZ LYS 122 2HZ LYS 122 6.868 19.752 -3.401 1015 3HZ LYS 122 3HZ LYS 122 8.095 18.605 -3.589 1016 H CYS 123 H CYS 123 0.862 18.547 -7.834 1017 HA CYS 123 HA CYS 123 1.285 18.246 -10.713 1018 1HB CYS 123 1HB CYS 123 -0.669 16.702 -9.093 1019 2HB CYS 123 2HB CYS 123 -1.234 17.319 -10.638 1020 H GLU 124 H GLU 124 1.279 20.657 -9.447 1021 HA GLU 124 HA GLU 124 -1.141 21.947 -9.051 1022 1HB GLU 124 1HB GLU 124 0.064 24.040 -9.581 1023 2HB GLU 124 2HB GLU 124 0.952 23.004 -8.472 1024 1HG GLU 124 1HG GLU 124 2.649 22.705 -9.903 1025 2HG GLU 124 2HG GLU 124 1.588 22.602 -11.307 1026 H ALA 125 H ALA 125 0.373 21.004 -12.044 1027 HA ALA 125 HA ALA 125 -1.040 22.763 -13.752 1028 1HB ALA 125 1HB ALA 125 -0.494 20.727 -15.400 1029 2HB ALA 125 2HB ALA 125 0.625 20.360 -14.089 1030 3HB ALA 125 3HB ALA 125 0.703 21.921 -14.900 1031 H CYS 126 H CYS 126 -1.557 19.200 -13.531 1032 HA CYS 126 HA CYS 126 -4.265 19.566 -14.483 1033 1HB CYS 126 1HB CYS 126 -4.452 17.118 -14.334 1034 2HB CYS 126 2HB CYS 126 -3.028 17.608 -15.239 1035 H GLY 127 H GLY 127 -3.964 20.945 -12.131 1036 1HA GLY 127 1HA GLY 127 -5.780 21.080 -10.508 1037 2HA GLY 127 2HA GLY 127 -5.617 19.343 -10.288 1038 H ALA 128 H ALA 128 -4.570 18.741 -8.512 1039 HA ALA 128 HA ALA 128 -2.212 20.166 -7.652 1040 1HB ALA 128 1HB ALA 128 -4.115 21.400 -6.599 1041 2HB ALA 128 2HB ALA 128 -2.936 20.738 -5.467 1042 3HB ALA 128 3HB ALA 128 -4.487 19.930 -5.698 1043 H LYS 129 H LYS 129 -0.978 19.047 -6.097 1044 HA LYS 129 HA LYS 129 -1.846 16.341 -5.426 1045 1HB LYS 129 1HB LYS 129 0.057 16.974 -7.451 1046 2HB LYS 129 2HB LYS 129 0.899 16.183 -6.136 1047 1HG LYS 129 1HG LYS 129 -1.555 14.815 -6.762 1048 2HG LYS 129 2HG LYS 129 -0.533 14.985 -8.190 1049 1HD LYS 129 1HD LYS 129 0.027 12.930 -7.077 1050 2HD LYS 129 2HD LYS 129 1.357 14.073 -6.881 1051 1HE LYS 129 1HE LYS 129 1.129 14.132 -4.659 1052 2HE LYS 129 2HE LYS 129 -0.625 14.259 -4.764 1053 1HZ LYS 129 1HZ LYS 129 -0.819 11.922 -4.961 1054 2HZ LYS 129 2HZ LYS 129 0.203 12.223 -3.647 1055 3HZ LYS 129 3HZ LYS 129 0.854 11.718 -5.124 1056 H ALA 130 H ALA 130 -0.690 15.438 -3.618 1057 HA ALA 130 HA ALA 130 0.119 17.449 -1.733 1058 1HB ALA 130 1HB ALA 130 -0.650 15.987 -0.257 1059 2HB ALA 130 2HB ALA 130 0.532 14.781 -0.766 1060 3HB ALA 130 3HB ALA 130 -1.022 14.895 -1.591 1061 HA PRO 131 HA PRO 131 4.468 16.798 -2.916 1062 1HB PRO 131 1HB PRO 131 5.417 19.052 -1.794 1063 2HB PRO 131 2HB PRO 131 4.555 19.065 -3.338 1064 1HG PRO 131 1HG PRO 131 3.524 19.696 -0.594 1065 2HG PRO 131 2HG PRO 131 3.276 20.580 -2.112 1066 1HD PRO 131 1HD PRO 131 1.428 18.875 -1.101 1067 2HD PRO 131 2HD PRO 131 1.655 19.125 -2.843 1068 H LEU 132 H LEU 132 2.886 16.604 0.026 1069 HA LEU 132 HA LEU 132 3.445 15.864 2.099 1070 1HB LEU 132 1HB LEU 132 4.790 14.318 0.245 1071 2HB LEU 132 2HB LEU 132 6.033 14.725 1.412 1072 HG LEU 132 HG LEU 132 5.144 12.669 2.115 1073 1HD1 LEU 132 1HD1 LEU 132 5.404 14.167 3.979 1074 2HD1 LEU 132 2HD1 LEU 132 3.967 13.177 4.226 1075 3HD1 LEU 132 3HD1 LEU 132 3.803 14.852 3.700 1076 1HD2 LEU 132 1HD2 LEU 132 2.470 13.892 1.525 1077 2HD2 LEU 132 2HD2 LEU 132 2.660 12.416 2.470 1078 3HD2 LEU 132 3HD2 LEU 132 3.213 12.469 0.796 1079 H LYS 133 H LYS 133 3.774 18.173 2.552 1080 HA LYS 133 HA LYS 133 6.173 18.569 4.027 1081 1HB LYS 133 1HB LYS 133 5.937 19.767 1.332 1082 2HB LYS 133 2HB LYS 133 6.453 20.863 2.603 1083 1HG LYS 133 1HG LYS 133 7.795 18.254 1.924 1084 2HG LYS 133 2HG LYS 133 8.332 19.846 1.396 1085 1HD LYS 133 1HD LYS 133 8.766 20.518 3.654 1086 2HD LYS 133 2HD LYS 133 8.036 19.042 4.286 1087 1HE LYS 133 1HE LYS 133 9.980 18.139 2.525 1088 2HE LYS 133 2HE LYS 133 10.733 19.519 3.323 1089 1HZ LYS 133 1HZ LYS 133 10.775 18.466 5.299 1090 2HZ LYS 133 2HZ LYS 133 10.744 17.075 4.337 1091 3HZ LYS 133 3HZ LYS 133 9.316 17.648 5.042 1092 H ASN 134 H ASN 134 3.198 19.791 2.671 1093 HA ASN 134 HA ASN 134 1.512 21.003 3.586 1094 1HB ASN 134 1HB ASN 134 2.804 19.947 5.830 1095 2HB ASN 134 2HB ASN 134 2.653 21.668 6.171 1096 1HD2 ASN 134 1HD2 ASN 134 1.324 19.698 7.616 1097 2HD2 ASN 134 2HD2 ASN 134 -0.373 19.860 7.342 1098 H VAL 135 H VAL 135 1.677 22.766 2.313 1099 HA VAL 135 HA VAL 135 3.386 24.964 3.280 1100 HB VAL 135 HB VAL 135 4.079 24.122 1.077 1101 1HG1 VAL 135 1HG1 VAL 135 1.369 25.010 0.100 1102 2HG1 VAL 135 2HG1 VAL 135 1.843 23.331 0.358 1103 3HG1 VAL 135 3HG1 VAL 135 2.666 24.302 -0.862 1104 1HG2 VAL 135 1HG2 VAL 135 4.074 26.616 1.801 1105 2HG2 VAL 135 2HG2 VAL 135 2.823 26.787 0.571 1106 3HG2 VAL 135 3HG2 VAL 135 4.424 26.200 0.123 Start of MODEL 20 1 H MET 1 H MET 1 -7.833 -6.699 -10.966 2 HA MET 1 HA MET 1 -10.280 -7.016 -10.409 3 1HB MET 1 1HB MET 1 -9.264 -5.586 -12.174 4 2HB MET 1 2HB MET 1 -9.296 -6.957 -13.273 5 1HG MET 1 1HG MET 1 -11.693 -7.003 -13.235 6 2HG MET 1 2HG MET 1 -11.737 -5.761 -11.985 7 1HE MET 1 1HE MET 1 -11.234 -3.497 -12.159 8 2HE MET 1 2HE MET 1 -11.256 -2.516 -13.624 9 3HE MET 1 3HE MET 1 -9.757 -3.281 -13.099 10 H ASP 2 H ASP 2 -9.441 -8.802 -13.362 11 HA ASP 2 HA ASP 2 -11.044 -11.065 -12.381 12 1HB ASP 2 1HB ASP 2 -11.178 -9.772 -15.111 13 2HB ASP 2 2HB ASP 2 -11.879 -11.344 -14.742 14 H ASP 3 H ASP 3 -8.539 -9.925 -14.590 15 HA ASP 3 HA ASP 3 -7.738 -12.525 -15.441 16 1HB ASP 3 1HB ASP 3 -7.319 -10.146 -16.503 17 2HB ASP 3 2HB ASP 3 -5.868 -10.191 -15.507 18 H TYR 4 H TYR 4 -5.586 -13.449 -15.025 19 HA TYR 4 HA TYR 4 -4.488 -12.771 -12.390 20 1HB TYR 4 1HB TYR 4 -5.469 -15.470 -13.294 21 2HB TYR 4 2HB TYR 4 -4.254 -15.312 -12.029 22 HD1 TYR 4 HD1 TYR 4 -7.755 -15.192 -12.814 23 HD2 TYR 4 HD2 TYR 4 -4.849 -13.996 -9.947 24 HE1 TYR 4 HE1 TYR 4 -9.539 -14.860 -11.155 25 HE2 TYR 4 HE2 TYR 4 -6.624 -13.661 -8.279 26 HH TYR 4 HH TYR 4 -9.845 -14.745 -8.778 27 H GLU 5 H GLU 5 -3.296 -11.929 -14.641 28 HA GLU 5 HA GLU 5 -1.405 -13.796 -15.694 29 1HB GLU 5 1HB GLU 5 -2.233 -11.108 -16.239 30 2HB GLU 5 2HB GLU 5 -0.481 -11.148 -16.109 31 1HG GLU 5 1HG GLU 5 -1.690 -13.291 -17.720 32 2HG GLU 5 2HG GLU 5 -1.841 -11.659 -18.370 33 H LYS 6 H LYS 6 0.992 -12.474 -15.714 34 HA LYS 6 HA LYS 6 1.843 -12.801 -12.933 35 1HB LYS 6 1HB LYS 6 3.038 -13.318 -15.546 36 2HB LYS 6 2HB LYS 6 4.130 -12.465 -14.464 37 1HG LYS 6 1HG LYS 6 4.162 -14.197 -12.921 38 2HG LYS 6 2HG LYS 6 2.668 -14.904 -13.539 39 1HD LYS 6 1HD LYS 6 3.750 -16.108 -15.091 40 2HD LYS 6 2HD LYS 6 4.800 -14.760 -15.531 41 1HE LYS 6 1HE LYS 6 6.270 -15.220 -13.699 42 2HE LYS 6 2HE LYS 6 5.158 -16.424 -13.045 43 1HZ LYS 6 1HZ LYS 6 6.017 -16.901 -15.767 44 2HZ LYS 6 2HZ LYS 6 5.875 -17.978 -14.471 45 3HZ LYS 6 3HZ LYS 6 7.247 -17.000 -14.610 46 H LEU 7 H LEU 7 2.167 -11.068 -11.719 47 HA LEU 7 HA LEU 7 2.032 -8.429 -12.671 48 1HB LEU 7 1HB LEU 7 2.217 -9.741 -10.156 49 2HB LEU 7 2HB LEU 7 3.450 -8.496 -10.196 50 HG LEU 7 HG LEU 7 0.882 -7.522 -11.167 51 1HD1 LEU 7 1HD1 LEU 7 0.983 -9.022 -8.623 52 2HD1 LEU 7 2HD1 LEU 7 -0.373 -8.707 -9.706 53 3HD1 LEU 7 3HD1 LEU 7 0.173 -7.455 -8.589 54 1HD2 LEU 7 1HD2 LEU 7 3.045 -6.706 -9.301 55 2HD2 LEU 7 2HD2 LEU 7 1.463 -5.950 -9.121 56 3HD2 LEU 7 3HD2 LEU 7 2.326 -5.833 -10.654 57 H LEU 8 H LEU 8 3.480 -7.701 -14.105 58 HA LEU 8 HA LEU 8 6.313 -8.304 -13.737 59 1HB LEU 8 1HB LEU 8 4.921 -8.373 -15.975 60 2HB LEU 8 2HB LEU 8 5.277 -6.657 -15.996 61 HG LEU 8 HG LEU 8 7.754 -7.739 -15.522 62 1HD1 LEU 8 1HD1 LEU 8 6.081 -9.726 -16.929 63 2HD1 LEU 8 2HD1 LEU 8 7.506 -9.952 -15.916 64 3HD1 LEU 8 3HD1 LEU 8 7.688 -9.430 -17.591 65 1HD2 LEU 8 1HD2 LEU 8 6.832 -7.399 -18.337 66 2HD2 LEU 8 2HD2 LEU 8 8.312 -6.837 -17.559 67 3HD2 LEU 8 3HD2 LEU 8 6.783 -6.015 -17.245 68 H GLU 9 H GLU 9 7.888 -6.766 -13.470 69 HA GLU 9 HA GLU 9 6.984 -4.014 -12.984 70 1HB GLU 9 1HB GLU 9 8.892 -5.609 -11.272 71 2HB GLU 9 2HB GLU 9 8.581 -3.890 -11.084 72 1HG GLU 9 1HG GLU 9 7.139 -4.655 -9.529 73 2HG GLU 9 2HG GLU 9 6.074 -4.761 -10.929 74 H ARG 10 H ARG 10 8.856 -5.886 -14.876 75 HA ARG 10 HA ARG 10 11.195 -4.172 -14.967 76 1HB ARG 10 1HB ARG 10 11.438 -6.610 -15.244 77 2HB ARG 10 2HB ARG 10 10.431 -6.544 -16.683 78 1HG ARG 10 1HG ARG 10 12.259 -6.230 -17.889 79 2HG ARG 10 2HG ARG 10 12.469 -4.670 -17.090 80 1HD ARG 10 1HD ARG 10 13.469 -7.257 -15.921 81 2HD ARG 10 2HD ARG 10 14.441 -6.246 -16.993 82 HE ARG 10 HE ARG 10 14.017 -5.818 -14.246 83 1HH1 ARG 10 1HH1 ARG 10 14.164 -4.076 -17.275 84 2HH1 ARG 10 2HH1 ARG 10 14.649 -2.587 -16.537 85 1HH2 ARG 10 1HH2 ARG 10 14.745 -3.867 -13.294 86 2HH2 ARG 10 2HH2 ARG 10 15.016 -2.481 -14.296 87 H ALA 11 H ALA 11 10.883 -2.240 -15.882 88 HA ALA 11 HA ALA 11 10.561 -0.698 -17.537 89 1HB ALA 11 1HB ALA 11 9.450 -2.449 -19.582 90 2HB ALA 11 2HB ALA 11 11.005 -2.994 -18.955 91 3HB ALA 11 3HB ALA 11 10.849 -1.377 -19.642 92 H ILE 12 H ILE 12 8.873 0.105 -16.179 93 HA ILE 12 HA ILE 12 6.168 -0.569 -17.104 94 HB ILE 12 HB ILE 12 6.892 0.824 -14.527 95 1HG1 ILE 12 1HG1 ILE 12 6.030 -2.049 -14.810 96 2HG1 ILE 12 2HG1 ILE 12 7.727 -1.574 -14.770 97 1HG2 ILE 12 1HG2 ILE 12 4.500 0.761 -15.849 98 2HG2 ILE 12 2HG2 ILE 12 4.693 1.003 -14.113 99 3HG2 ILE 12 3HG2 ILE 12 4.347 -0.606 -14.746 100 1HD1 ILE 12 1HD1 ILE 12 6.523 -2.303 -12.593 101 2HD1 ILE 12 2HD1 ILE 12 5.894 -0.657 -12.614 102 3HD1 ILE 12 3HD1 ILE 12 7.635 -0.936 -12.571 103 H ASP 13 H ASP 13 6.325 2.296 -15.262 104 HA ASP 13 HA ASP 13 5.402 3.875 -17.435 105 1HB ASP 13 1HB ASP 13 5.642 5.760 -15.698 106 2HB ASP 13 2HB ASP 13 4.514 4.458 -15.335 107 H GLN 14 H GLN 14 8.356 4.023 -15.449 108 HA GLN 14 HA GLN 14 9.542 5.826 -17.398 109 1HB GLN 14 1HB GLN 14 10.438 4.897 -14.672 110 2HB GLN 14 2HB GLN 14 11.452 5.872 -15.722 111 1HG GLN 14 1HG GLN 14 8.737 6.679 -14.695 112 2HG GLN 14 2HG GLN 14 10.284 7.217 -14.045 113 1HE2 GLN 14 1HE2 GLN 14 11.397 8.810 -15.058 114 2HE2 GLN 14 2HE2 GLN 14 10.799 9.682 -16.425 115 H LEU 15 H LEU 15 12.093 4.153 -16.024 116 HA LEU 15 HA LEU 15 13.593 2.652 -16.819 117 1HB LEU 15 1HB LEU 15 10.957 1.529 -17.598 118 2HB LEU 15 2HB LEU 15 12.376 0.805 -18.330 119 HG LEU 15 HG LEU 15 11.736 -0.443 -16.337 120 1HD1 LEU 15 1HD1 LEU 15 14.199 1.097 -15.601 121 2HD1 LEU 15 2HD1 LEU 15 14.174 -0.023 -16.960 122 3HD1 LEU 15 3HD1 LEU 15 13.840 -0.610 -15.332 123 1HD2 LEU 15 1HD2 LEU 15 12.359 1.137 -14.167 124 2HD2 LEU 15 2HD2 LEU 15 10.733 0.707 -14.694 125 3HD2 LEU 15 3HD2 LEU 15 11.452 2.230 -15.209 126 HA PRO 16 HA PRO 16 15.259 3.616 -20.783 127 1HB PRO 16 1HB PRO 16 14.928 1.301 -22.354 128 2HB PRO 16 2HB PRO 16 16.341 1.736 -21.387 129 1HG PRO 16 1HG PRO 16 14.061 -0.062 -20.711 130 2HG PRO 16 2HG PRO 16 15.774 -0.205 -20.273 131 1HD PRO 16 1HD PRO 16 13.989 0.599 -18.479 132 2HD PRO 16 2HD PRO 16 15.587 1.365 -18.548 133 HA PRO 17 HA PRO 17 11.496 4.959 -22.879 134 1HB PRO 17 1HB PRO 17 12.840 6.563 -24.688 135 2HB PRO 17 2HB PRO 17 12.360 7.069 -23.066 136 1HG PRO 17 1HG PRO 17 15.010 6.094 -24.042 137 2HG PRO 17 2HG PRO 17 14.644 7.407 -22.908 138 1HD PRO 17 1HD PRO 17 15.495 5.010 -22.056 139 2HD PRO 17 2HD PRO 17 14.304 5.954 -21.138 140 H GLU 18 H GLU 18 11.717 5.598 -25.664 141 HA GLU 18 HA GLU 18 11.640 4.665 -27.734 142 1HB GLU 18 1HB GLU 18 13.753 3.008 -26.434 143 2HB GLU 18 2HB GLU 18 13.068 2.434 -27.946 144 1HG GLU 18 1HG GLU 18 13.753 4.423 -29.083 145 2HG GLU 18 2HG GLU 18 14.266 5.166 -27.568 146 H VAL 19 H VAL 19 12.074 1.581 -26.079 147 HA VAL 19 HA VAL 19 9.590 0.612 -27.155 148 HB VAL 19 HB VAL 19 10.177 -1.431 -25.657 149 1HG1 VAL 19 1HG1 VAL 19 10.537 -0.833 -28.245 150 2HG1 VAL 19 2HG1 VAL 19 10.970 -2.382 -27.523 151 3HG1 VAL 19 3HG1 VAL 19 12.206 -1.149 -27.767 152 1HG2 VAL 19 1HG2 VAL 19 12.977 -1.116 -25.834 153 2HG2 VAL 19 2HG2 VAL 19 11.994 -1.297 -24.383 154 3HG2 VAL 19 3HG2 VAL 19 12.361 0.311 -25.001 155 H PHE 20 H PHE 20 7.675 0.575 -26.223 156 HA PHE 20 HA PHE 20 7.505 1.284 -23.377 157 1HB PHE 20 1HB PHE 20 5.094 1.871 -23.990 158 2HB PHE 20 2HB PHE 20 6.358 2.926 -24.605 159 HD1 PHE 20 HD1 PHE 20 5.648 3.807 -26.601 160 HD2 PHE 20 HD2 PHE 20 5.027 -0.341 -25.862 161 HE1 PHE 20 HE1 PHE 20 4.770 3.532 -28.883 162 HE2 PHE 20 HE2 PHE 20 4.154 -0.622 -28.142 163 HZ PHE 20 HZ PHE 20 4.023 1.314 -29.656 164 H GLU 21 H GLU 21 5.418 0.420 -22.338 165 HA GLU 21 HA GLU 21 4.549 -2.163 -23.282 166 1HB GLU 21 1HB GLU 21 6.796 -2.096 -21.648 167 2HB GLU 21 2HB GLU 21 5.483 -2.464 -20.539 168 1HG GLU 21 1HG GLU 21 5.896 -4.577 -21.147 169 2HG GLU 21 2HG GLU 21 4.908 -4.166 -22.548 170 H THR 22 H THR 22 3.086 -3.189 -21.492 171 HA THR 22 HA THR 22 1.412 -1.007 -20.447 172 HB THR 22 HB THR 22 0.553 -3.856 -20.957 173 HG1 THR 22 HG1 THR 22 0.816 -3.275 -22.970 174 1HG2 THR 22 1HG2 THR 22 -1.693 -2.772 -21.164 175 2HG2 THR 22 2HG2 THR 22 -0.965 -1.306 -20.505 176 3HG2 THR 22 3HG2 THR 22 -1.004 -2.782 -19.540 177 H LYS 23 H LYS 23 1.239 -0.753 -18.335 178 HA LYS 23 HA LYS 23 2.511 -2.612 -16.538 179 1HB LYS 23 1HB LYS 23 1.905 -0.957 -14.789 180 2HB LYS 23 2HB LYS 23 2.814 -0.263 -16.120 181 1HG LYS 23 1HG LYS 23 0.551 0.440 -17.071 182 2HG LYS 23 2HG LYS 23 -0.092 0.063 -15.471 183 1HD LYS 23 1HD LYS 23 1.018 1.798 -14.466 184 2HD LYS 23 2HD LYS 23 2.323 1.793 -15.653 185 1HE LYS 23 1HE LYS 23 -0.465 2.879 -15.982 186 2HE LYS 23 2HE LYS 23 1.047 3.783 -15.982 187 1HZ LYS 23 1HZ LYS 23 0.973 3.583 -18.180 188 2HZ LYS 23 2HZ LYS 23 -0.251 2.418 -18.133 189 3HZ LYS 23 3HZ LYS 23 1.367 1.950 -17.977 190 H ARG 24 H ARG 24 1.524 -4.349 -15.800 191 HA ARG 24 HA ARG 24 -1.377 -4.494 -15.747 192 1HB ARG 24 1HB ARG 24 0.717 -6.581 -15.101 193 2HB ARG 24 2HB ARG 24 -1.016 -6.873 -15.177 194 1HG ARG 24 1HG ARG 24 0.196 -5.662 -17.577 195 2HG ARG 24 2HG ARG 24 0.664 -7.325 -17.217 196 1HD ARG 24 1HD ARG 24 -1.221 -7.948 -18.230 197 2HD ARG 24 2HD ARG 24 -2.075 -7.307 -16.826 198 HE ARG 24 HE ARG 24 -2.758 -5.514 -18.089 199 1HH1 ARG 24 1HH1 ARG 24 -0.276 -7.259 -19.815 200 2HH1 ARG 24 2HH1 ARG 24 -0.525 -6.395 -21.295 201 1HH2 ARG 24 1HH2 ARG 24 -3.083 -4.379 -20.040 202 2HH2 ARG 24 2HH2 ARG 24 -2.121 -4.770 -21.425 203 H PHE 25 H PHE 25 -1.881 -3.085 -14.042 204 HA PHE 25 HA PHE 25 -0.764 -3.514 -11.420 205 1HB PHE 25 1HB PHE 25 -2.613 -1.578 -12.681 206 2HB PHE 25 2HB PHE 25 -2.877 -1.882 -10.967 207 HD1 PHE 25 HD1 PHE 25 -0.405 -2.071 -9.712 208 HD2 PHE 25 HD2 PHE 25 -1.421 0.330 -13.075 209 HE1 PHE 25 HE1 PHE 25 1.426 -0.524 -9.156 210 HE2 PHE 25 HE2 PHE 25 0.407 1.880 -12.527 211 HZ PHE 25 HZ PHE 25 1.835 1.454 -10.564 212 H GLU 26 H GLU 26 -1.718 -4.493 -9.681 213 HA GLU 26 HA GLU 26 -4.391 -5.652 -10.026 214 1HB GLU 26 1HB GLU 26 -1.826 -7.103 -9.642 215 2HB GLU 26 2HB GLU 26 -3.216 -7.695 -8.744 216 1HG GLU 26 1HG GLU 26 -3.287 -7.242 -11.712 217 2HG GLU 26 2HG GLU 26 -2.756 -8.760 -10.993 218 H VAL 27 H VAL 27 -5.601 -5.038 -8.375 219 HA VAL 27 HA VAL 27 -4.581 -5.121 -5.648 220 HB VAL 27 HB VAL 27 -5.761 -2.586 -6.806 221 1HG1 VAL 27 1HG1 VAL 27 -5.366 -3.549 -4.062 222 2HG1 VAL 27 2HG1 VAL 27 -6.494 -2.349 -4.695 223 3HG1 VAL 27 3HG1 VAL 27 -4.818 -1.902 -4.371 224 1HG2 VAL 27 1HG2 VAL 27 -3.298 -2.045 -5.605 225 2HG2 VAL 27 2HG2 VAL 27 -3.679 -2.020 -7.326 226 3HG2 VAL 27 3HG2 VAL 27 -3.038 -3.484 -6.584 227 HA PRO 28 HA PRO 28 -8.849 -6.842 -5.961 228 1HB PRO 28 1HB PRO 28 -7.982 -7.876 -3.311 229 2HB PRO 28 2HB PRO 28 -8.734 -8.724 -4.665 230 1HG PRO 28 1HG PRO 28 -6.136 -9.029 -4.122 231 2HG PRO 28 2HG PRO 28 -6.732 -8.982 -5.791 232 1HD PRO 28 1HD PRO 28 -5.324 -6.867 -4.218 233 2HD PRO 28 2HD PRO 28 -5.178 -7.285 -5.939 234 H LYS 29 H LYS 29 -8.042 -6.382 -2.529 235 HA LYS 29 HA LYS 29 -10.329 -4.576 -2.333 236 1HB LYS 29 1HB LYS 29 -8.753 -6.111 -0.265 237 2HB LYS 29 2HB LYS 29 -9.951 -4.900 0.166 238 1HG LYS 29 1HG LYS 29 -11.461 -6.385 -1.447 239 2HG LYS 29 2HG LYS 29 -10.318 -7.627 -0.929 240 1HD LYS 29 1HD LYS 29 -11.232 -5.993 1.293 241 2HD LYS 29 2HD LYS 29 -12.576 -6.770 0.454 242 1HE LYS 29 1HE LYS 29 -11.608 -8.096 2.351 243 2HE LYS 29 2HE LYS 29 -11.626 -8.939 0.801 244 1HZ LYS 29 1HZ LYS 29 -9.512 -9.075 2.158 245 2HZ LYS 29 2HZ LYS 29 -9.254 -7.453 1.748 246 3HZ LYS 29 3HZ LYS 29 -9.339 -8.627 0.534 247 H ALA 30 H ALA 30 -7.252 -4.717 -0.565 248 HA ALA 30 HA ALA 30 -5.735 -3.126 0.002 249 1HB ALA 30 1HB ALA 30 -5.266 -1.352 -1.541 250 2HB ALA 30 2HB ALA 30 -6.830 -1.571 -2.329 251 3HB ALA 30 3HB ALA 30 -5.602 -2.832 -2.433 252 H TYR 31 H TYR 31 -8.059 -3.116 1.452 253 HA TYR 31 HA TYR 31 -8.060 -0.407 2.418 254 1HB TYR 31 1HB TYR 31 -10.339 0.118 2.146 255 2HB TYR 31 2HB TYR 31 -9.852 -0.524 0.581 256 HD1 TYR 31 HD1 TYR 31 -10.499 -2.882 -0.016 257 HD2 TYR 31 HD2 TYR 31 -12.049 -0.898 3.413 258 HE1 TYR 31 HE1 TYR 31 -12.330 -4.518 0.098 259 HE2 TYR 31 HE2 TYR 31 -13.882 -2.533 3.540 260 HH TYR 31 HH TYR 31 -14.105 -5.237 1.257 261 H SER 32 H SER 32 -8.670 -0.245 4.547 262 HA SER 32 HA SER 32 -8.675 -2.718 6.030 263 1HB SER 32 1HB SER 32 -8.049 0.051 6.559 264 2HB SER 32 2HB SER 32 -9.152 -0.563 7.789 265 HG SER 32 HG SER 32 -6.939 -2.116 7.043 266 H VAL 33 H VAL 33 -10.231 -2.620 8.072 267 HA VAL 33 HA VAL 33 -12.935 -1.998 7.092 268 HB VAL 33 HB VAL 33 -13.047 -4.223 8.903 269 1HG1 VAL 33 1HG1 VAL 33 -13.697 -4.132 5.965 270 2HG1 VAL 33 2HG1 VAL 33 -14.737 -3.477 7.230 271 3HG1 VAL 33 3HG1 VAL 33 -14.381 -5.204 7.188 272 1HG2 VAL 33 1HG2 VAL 33 -10.821 -4.368 7.045 273 2HG2 VAL 33 2HG2 VAL 33 -11.997 -5.646 6.758 274 3HG2 VAL 33 3HG2 VAL 33 -11.273 -5.459 8.351 275 H ILE 34 H ILE 34 -14.107 -0.789 8.406 276 HA ILE 34 HA ILE 34 -13.069 0.094 10.898 277 HB ILE 34 HB ILE 34 -14.398 1.552 9.443 278 1HG1 ILE 34 1HG1 ILE 34 -15.729 2.607 11.160 279 2HG1 ILE 34 2HG1 ILE 34 -15.816 1.104 12.070 280 1HG2 ILE 34 1HG2 ILE 34 -15.965 -0.084 8.578 281 2HG2 ILE 34 2HG2 ILE 34 -16.814 1.296 9.274 282 3HG2 ILE 34 3HG2 ILE 34 -16.716 -0.219 10.168 283 1HD1 ILE 34 1HD1 ILE 34 -13.992 1.656 13.182 284 2HD1 ILE 34 2HD1 ILE 34 -13.942 3.186 12.306 285 3HD1 ILE 34 3HD1 ILE 34 -13.079 1.784 11.678 286 H GLN 35 H GLN 35 -13.638 -0.411 12.949 287 HA GLN 35 HA GLN 35 -15.962 -2.015 13.471 288 1HB GLN 35 1HB GLN 35 -13.328 -3.235 13.267 289 2HB GLN 35 2HB GLN 35 -14.066 -3.512 14.838 290 1HG GLN 35 1HG GLN 35 -15.583 -4.019 12.308 291 2HG GLN 35 2HG GLN 35 -14.481 -5.223 12.980 292 1HE2 GLN 35 1HE2 GLN 35 -17.097 -3.065 14.064 293 2HE2 GLN 35 2HE2 GLN 35 -17.844 -4.221 15.110 294 H GLY 36 H GLY 36 -16.703 -0.457 14.871 295 1HA GLY 36 1HA GLY 36 -16.923 0.647 16.875 296 2HA GLY 36 2HA GLY 36 -15.779 -0.512 17.534 297 H ASN 37 H ASN 37 -13.462 -0.064 17.169 298 HA ASN 37 HA ASN 37 -12.749 2.643 16.448 299 1HB ASN 37 1HB ASN 37 -13.472 2.413 19.000 300 2HB ASN 37 2HB ASN 37 -11.816 1.838 19.160 301 1HD2 ASN 37 1HD2 ASN 37 -10.973 3.521 20.243 302 2HD2 ASN 37 2HD2 ASN 37 -10.853 5.125 19.612 303 H ARG 38 H ARG 38 -12.141 -0.084 15.550 304 HA ARG 38 HA ARG 38 -9.223 0.110 15.712 305 1HB ARG 38 1HB ARG 38 -9.330 -2.523 15.621 306 2HB ARG 38 2HB ARG 38 -9.375 -1.676 17.156 307 1HG ARG 38 1HG ARG 38 -11.962 -2.258 15.841 308 2HG ARG 38 2HG ARG 38 -11.077 -3.604 16.557 309 1HD ARG 38 1HD ARG 38 -11.208 -2.717 18.697 310 2HD ARG 38 2HD ARG 38 -11.494 -1.081 18.104 311 HE ARG 38 HE ARG 38 -13.625 -2.814 17.389 312 1HH1 ARG 38 1HH1 ARG 38 -12.283 -1.038 20.076 313 2HH1 ARG 38 2HH1 ARG 38 -13.806 -0.864 20.883 314 1HH2 ARG 38 1HH2 ARG 38 -15.633 -2.564 18.438 315 2HH2 ARG 38 2HH2 ARG 38 -15.707 -1.731 19.955 316 H THR 39 H THR 39 -8.092 -0.870 13.935 317 HA THR 39 HA THR 39 -9.779 -1.077 11.538 318 HB THR 39 HB THR 39 -7.638 0.576 11.987 319 HG1 THR 39 HG1 THR 39 -8.150 -0.328 9.387 320 1HG2 THR 39 1HG2 THR 39 -5.693 -0.093 11.044 321 2HG2 THR 39 2HG2 THR 39 -6.472 -1.263 9.979 322 3HG2 THR 39 3HG2 THR 39 -6.226 -1.644 11.681 323 H PHE 40 H PHE 40 -9.938 -2.984 10.555 324 HA PHE 40 HA PHE 40 -8.270 -5.173 11.539 325 1HB PHE 40 1HB PHE 40 -10.869 -5.065 10.028 326 2HB PHE 40 2HB PHE 40 -9.981 -6.568 10.258 327 HD1 PHE 40 HD1 PHE 40 -11.051 -7.869 11.797 328 HD2 PHE 40 HD2 PHE 40 -10.752 -3.688 12.514 329 HE1 PHE 40 HE1 PHE 40 -12.142 -8.169 13.980 330 HE2 PHE 40 HE2 PHE 40 -11.841 -3.979 14.697 331 HZ PHE 40 HZ PHE 40 -12.539 -6.221 15.435 332 H ILE 41 H ILE 41 -6.378 -4.488 10.305 333 HA ILE 41 HA ILE 41 -6.395 -4.284 7.488 334 HB ILE 41 HB ILE 41 -4.439 -4.177 9.590 335 1HG1 ILE 41 1HG1 ILE 41 -3.601 -3.296 6.933 336 2HG1 ILE 41 2HG1 ILE 41 -5.198 -2.709 7.373 337 1HG2 ILE 41 1HG2 ILE 41 -3.647 -6.319 8.771 338 2HG2 ILE 41 2HG2 ILE 41 -2.502 -5.043 8.373 339 3HG2 ILE 41 3HG2 ILE 41 -3.571 -5.683 7.126 340 1HD1 ILE 41 1HD1 ILE 41 -2.631 -2.282 8.883 341 2HD1 ILE 41 2HD1 ILE 41 -4.222 -1.812 9.479 342 3HD1 ILE 41 3HD1 ILE 41 -3.578 -1.077 8.012 343 H GLN 42 H GLN 42 -6.669 -5.796 6.015 344 HA GLN 42 HA GLN 42 -6.256 -8.599 6.780 345 1HB GLN 42 1HB GLN 42 -8.367 -7.318 5.509 346 2HB GLN 42 2HB GLN 42 -7.538 -8.152 4.204 347 1HG GLN 42 1HG GLN 42 -7.662 -10.234 5.603 348 2HG GLN 42 2HG GLN 42 -8.712 -9.338 6.699 349 1HE2 GLN 42 1HE2 GLN 42 -10.790 -8.939 6.148 350 2HE2 GLN 42 2HE2 GLN 42 -11.553 -9.602 4.748 351 H ASN 43 H ASN 43 -5.533 -6.246 4.241 352 HA ASN 43 HA ASN 43 -3.483 -8.080 3.188 353 1HB ASN 43 1HB ASN 43 -4.587 -5.704 1.711 354 2HB ASN 43 2HB ASN 43 -3.706 -7.078 1.056 355 1HD2 ASN 43 1HD2 ASN 43 -5.149 -9.086 2.496 356 2HD2 ASN 43 2HD2 ASN 43 -6.734 -9.167 1.813 357 H PHE 44 H PHE 44 -2.638 -6.956 5.371 358 HA PHE 44 HA PHE 44 -1.658 -4.417 5.512 359 1HB PHE 44 1HB PHE 44 0.401 -5.582 6.684 360 2HB PHE 44 2HB PHE 44 -1.186 -5.606 7.429 361 HD1 PHE 44 HD1 PHE 44 1.411 -7.576 5.823 362 HD2 PHE 44 HD2 PHE 44 -2.512 -7.651 7.467 363 HE1 PHE 44 HE1 PHE 44 1.498 -10.033 5.908 364 HE2 PHE 44 HE2 PHE 44 -2.436 -10.107 7.552 365 HZ PHE 44 HZ PHE 44 -0.430 -11.303 6.772 366 H ARG 45 H ARG 45 -0.232 -7.118 3.756 367 HA ARG 45 HA ARG 45 2.142 -5.768 3.020 368 1HB ARG 45 1HB ARG 45 1.344 -8.324 2.909 369 2HB ARG 45 2HB ARG 45 1.077 -7.872 1.233 370 1HG ARG 45 1HG ARG 45 3.239 -7.983 0.777 371 2HG ARG 45 2HG ARG 45 3.648 -6.950 2.149 372 1HD ARG 45 1HD ARG 45 3.521 -8.897 3.638 373 2HD ARG 45 2HD ARG 45 3.132 -9.921 2.256 374 HE ARG 45 HE ARG 45 5.577 -8.490 1.893 375 1HH1 ARG 45 1HH1 ARG 45 4.155 -11.300 3.394 376 2HH1 ARG 45 2HH1 ARG 45 5.637 -12.196 3.415 377 1HH2 ARG 45 1HH2 ARG 45 7.530 -9.667 1.915 378 2HH2 ARG 45 2HH2 ARG 45 7.555 -11.267 2.575 379 H GLU 46 H GLU 46 -0.819 -6.444 1.180 380 HA GLU 46 HA GLU 46 -0.011 -4.910 -1.081 381 1HB GLU 46 1HB GLU 46 -1.890 -6.801 -0.700 382 2HB GLU 46 2HB GLU 46 -2.894 -5.360 -0.640 383 1HG GLU 46 1HG GLU 46 -2.874 -5.226 -2.844 384 2HG GLU 46 2HG GLU 46 -1.115 -5.121 -2.840 385 H VAL 47 H VAL 47 -2.480 -4.334 1.418 386 HA VAL 47 HA VAL 47 -3.245 -1.788 0.664 387 HB VAL 47 HB VAL 47 -3.035 -2.853 3.492 388 1HG1 VAL 47 1HG1 VAL 47 -3.322 -0.326 3.147 389 2HG1 VAL 47 2HG1 VAL 47 -4.494 -1.150 4.176 390 3HG1 VAL 47 3HG1 VAL 47 -4.917 -0.730 2.517 391 1HG2 VAL 47 1HG2 VAL 47 -5.518 -2.736 1.827 392 2HG2 VAL 47 2HG2 VAL 47 -5.177 -3.724 3.250 393 3HG2 VAL 47 3HG2 VAL 47 -4.415 -4.105 1.704 394 H ALA 48 H ALA 48 -0.411 -2.816 2.482 395 HA ALA 48 HA ALA 48 0.369 -0.282 3.410 396 1HB ALA 48 1HB ALA 48 2.739 -1.526 3.252 397 2HB ALA 48 2HB ALA 48 1.656 -2.915 3.170 398 3HB ALA 48 3HB ALA 48 1.569 -1.811 4.545 399 H ASP 49 H ASP 49 1.581 -2.147 0.655 400 HA ASP 49 HA ASP 49 3.348 -0.316 -0.383 401 1HB ASP 49 1HB ASP 49 2.091 -2.686 -1.292 402 2HB ASP 49 2HB ASP 49 1.923 -1.500 -2.581 403 H ALA 50 H ALA 50 0.008 -0.657 -1.632 404 HA ALA 50 HA ALA 50 -0.049 1.607 -3.155 405 1HB ALA 50 1HB ALA 50 -2.519 1.600 -2.799 406 2HB ALA 50 2HB ALA 50 -2.277 0.312 -1.617 407 3HB ALA 50 3HB ALA 50 -1.822 0.061 -3.301 408 H LEU 51 H LEU 51 -1.048 1.459 0.275 409 HA LEU 51 HA LEU 51 -1.602 4.215 0.472 410 1HB LEU 51 1HB LEU 51 -2.596 3.061 2.187 411 2HB LEU 51 2HB LEU 51 -1.233 1.978 2.394 412 HG LEU 51 HG LEU 51 0.002 3.715 3.583 413 1HD1 LEU 51 1HD1 LEU 51 -0.568 5.886 3.693 414 2HD1 LEU 51 2HD1 LEU 51 -2.293 5.532 3.821 415 3HD1 LEU 51 3HD1 LEU 51 -1.499 5.493 2.253 416 1HD2 LEU 51 1HD2 LEU 51 -0.987 2.792 5.357 417 2HD2 LEU 51 2HD2 LEU 51 -2.502 2.593 4.488 418 3HD2 LEU 51 3HD2 LEU 51 -2.149 4.112 5.304 419 H ASN 52 H ASN 52 1.325 2.496 0.309 420 HA ASN 52 HA ASN 52 2.953 4.708 0.144 421 1HB ASN 52 1HB ASN 52 2.187 4.307 2.804 422 2HB ASN 52 2HB ASN 52 3.829 3.676 2.709 423 1HD2 ASN 52 1HD2 ASN 52 3.013 5.951 4.171 424 2HD2 ASN 52 2HD2 ASN 52 3.826 7.322 3.505 425 H ARG 53 H ARG 53 4.331 3.810 -1.226 426 HA ARG 53 HA ARG 53 4.955 1.136 -1.490 427 1HB ARG 53 1HB ARG 53 5.536 3.274 -2.955 428 2HB ARG 53 2HB ARG 53 7.080 3.128 -2.129 429 1HG ARG 53 1HG ARG 53 7.618 1.759 -3.810 430 2HG ARG 53 2HG ARG 53 6.654 0.563 -2.942 431 1HD ARG 53 1HD ARG 53 5.829 2.296 -5.259 432 2HD ARG 53 2HD ARG 53 5.898 0.536 -5.187 433 HE ARG 53 HE ARG 53 4.097 1.149 -3.275 434 1HH1 ARG 53 1HH1 ARG 53 4.398 2.060 -6.630 435 2HH1 ARG 53 2HH1 ARG 53 2.691 2.233 -6.866 436 1HH2 ARG 53 1HH2 ARG 53 1.855 1.384 -3.579 437 2HH2 ARG 53 2HH2 ARG 53 1.247 1.848 -5.132 438 H ASP 54 H ASP 54 6.076 3.374 0.853 439 HA ASP 54 HA ASP 54 8.314 1.678 1.640 440 1HB ASP 54 1HB ASP 54 8.443 4.233 1.489 441 2HB ASP 54 2HB ASP 54 7.456 4.253 2.946 442 HA PRO 55 HA PRO 55 5.662 -0.241 4.704 443 1HB PRO 55 1HB PRO 55 7.562 -1.695 5.972 444 2HB PRO 55 2HB PRO 55 6.924 -2.141 4.386 445 1HG PRO 55 1HG PRO 55 9.465 -0.715 5.070 446 2HG PRO 55 2HG PRO 55 9.194 -2.014 3.894 447 1HD PRO 55 1HD PRO 55 9.374 0.598 3.179 448 2HD PRO 55 2HD PRO 55 8.367 -0.569 2.300 449 H GLN 56 H GLN 56 8.811 1.075 5.716 450 HA GLN 56 HA GLN 56 8.278 1.353 8.430 451 1HB GLN 56 1HB GLN 56 10.244 2.345 6.529 452 2HB GLN 56 2HB GLN 56 9.904 3.518 7.792 453 1HG GLN 56 1HG GLN 56 10.385 0.724 8.640 454 2HG GLN 56 2HG GLN 56 11.764 1.637 8.027 455 1HE2 GLN 56 1HE2 GLN 56 12.901 2.176 9.760 456 2HE2 GLN 56 2HE2 GLN 56 12.282 2.971 11.163 457 H HIS 57 H HIS 57 7.242 3.292 5.734 458 HA HIS 57 HA HIS 57 6.545 5.610 7.224 459 1HB HIS 57 1HB HIS 57 6.377 4.715 4.487 460 2HB HIS 57 2HB HIS 57 4.868 5.479 4.969 461 HD2 HIS 57 HD2 HIS 57 8.057 6.522 3.436 462 HE1 HIS 57 HE1 HIS 57 6.751 9.927 5.604 463 HE2 HIS 57 HE2 HIS 57 8.268 9.075 3.782 464 H LEU 58 H LEU 58 4.482 3.160 5.717 465 HA LEU 58 HA LEU 58 2.053 3.832 6.712 466 1HB LEU 58 1HB LEU 58 3.188 1.575 5.506 467 2HB LEU 58 2HB LEU 58 2.393 0.975 6.949 468 HG LEU 58 HG LEU 58 0.585 2.754 5.739 469 1HD1 LEU 58 1HD1 LEU 58 0.302 1.594 3.526 470 2HD1 LEU 58 2HD1 LEU 58 1.922 0.932 3.761 471 3HD1 LEU 58 3HD1 LEU 58 1.689 2.675 3.653 472 1HD2 LEU 58 1HD2 LEU 58 -0.600 1.093 6.644 473 2HD2 LEU 58 2HD2 LEU 58 0.750 -0.036 6.542 474 3HD2 LEU 58 3HD2 LEU 58 -0.302 0.210 5.148 475 H LEU 59 H LEU 59 4.506 1.909 8.370 476 HA LEU 59 HA LEU 59 3.059 1.295 10.677 477 1HB LEU 59 1HB LEU 59 6.007 1.653 10.192 478 2HB LEU 59 2HB LEU 59 5.369 1.160 11.750 479 HG LEU 59 HG LEU 59 4.977 -0.347 9.165 480 1HD1 LEU 59 1HD1 LEU 59 7.069 -0.420 11.229 481 2HD1 LEU 59 2HD1 LEU 59 7.116 -0.922 9.538 482 3HD1 LEU 59 3HD1 LEU 59 6.410 -1.985 10.755 483 1HD2 LEU 59 1HD2 LEU 59 3.159 -0.564 10.872 484 2HD2 LEU 59 2HD2 LEU 59 4.362 -1.222 11.981 485 3HD2 LEU 59 3HD2 LEU 59 3.987 -2.070 10.480 486 H LYS 60 H LYS 60 5.268 4.014 10.068 487 HA LYS 60 HA LYS 60 4.937 5.235 12.579 488 1HB LYS 60 1HB LYS 60 6.044 5.976 9.958 489 2HB LYS 60 2HB LYS 60 5.451 7.336 10.902 490 1HG LYS 60 1HG LYS 60 7.302 5.306 12.095 491 2HG LYS 60 2HG LYS 60 7.908 6.665 11.146 492 1HD LYS 60 1HD LYS 60 5.966 7.210 13.338 493 2HD LYS 60 2HD LYS 60 7.636 6.832 13.765 494 1HE LYS 60 1HE LYS 60 7.656 9.146 13.585 495 2HE LYS 60 2HE LYS 60 8.251 8.622 12.010 496 1HZ LYS 60 1HZ LYS 60 6.310 10.391 12.299 497 2HZ LYS 60 2HZ LYS 60 5.374 8.982 12.255 498 3HZ LYS 60 3HZ LYS 60 6.406 9.352 10.967 499 H PHE 61 H PHE 61 3.185 5.619 9.523 500 HA PHE 61 HA PHE 61 1.554 7.768 10.305 501 1HB PHE 61 1HB PHE 61 1.614 5.805 8.116 502 2HB PHE 61 2HB PHE 61 0.009 6.412 8.498 503 HD1 PHE 61 HD1 PHE 61 0.066 9.094 8.971 504 HD2 PHE 61 HD2 PHE 61 2.698 6.909 6.440 505 HE1 PHE 61 HE1 PHE 61 0.536 11.146 7.695 506 HE2 PHE 61 HE2 PHE 61 3.172 8.955 5.160 507 HZ PHE 61 HZ PHE 61 2.092 11.077 5.787 508 H LEU 62 H LEU 62 1.060 4.257 10.511 509 HA LEU 62 HA LEU 62 -1.552 4.248 11.457 510 1HB LEU 62 1HB LEU 62 0.734 2.390 11.530 511 2HB LEU 62 2HB LEU 62 -0.473 2.132 12.773 512 HG LEU 62 HG LEU 62 -2.201 1.836 11.086 513 1HD1 LEU 62 1HD1 LEU 62 -0.029 2.135 9.023 514 2HD1 LEU 62 2HD1 LEU 62 -1.189 3.403 9.424 515 3HD1 LEU 62 3HD1 LEU 62 -1.750 1.876 8.742 516 1HD2 LEU 62 1HD2 LEU 62 -1.555 -0.291 10.340 517 2HD2 LEU 62 2HD2 LEU 62 -0.635 -0.037 11.822 518 3HD2 LEU 62 3HD2 LEU 62 0.148 0.162 10.254 519 H LEU 63 H LEU 63 1.483 4.294 13.342 520 HA LEU 63 HA LEU 63 0.132 4.508 15.844 521 1HB LEU 63 1HB LEU 63 2.979 4.836 14.967 522 2HB LEU 63 2HB LEU 63 2.499 5.259 16.600 523 HG LEU 63 HG LEU 63 1.595 2.595 15.778 524 1HD1 LEU 63 1HD1 LEU 63 3.785 2.804 14.573 525 2HD1 LEU 63 2HD1 LEU 63 3.704 1.508 15.766 526 3HD1 LEU 63 3HD1 LEU 63 4.552 3.006 16.148 527 1HD2 LEU 63 1HD2 LEU 63 3.389 2.916 18.072 528 2HD2 LEU 63 2HD2 LEU 63 1.786 2.187 17.973 529 3HD2 LEU 63 3HD2 LEU 63 1.951 3.937 18.122 530 H ARG 64 H ARG 64 0.948 6.777 13.414 531 HA ARG 64 HA ARG 64 1.100 9.081 15.117 532 1HB ARG 64 1HB ARG 64 1.846 8.606 12.544 533 2HB ARG 64 2HB ARG 64 0.360 9.513 12.298 534 1HG ARG 64 1HG ARG 64 1.393 11.417 12.752 535 2HG ARG 64 2HG ARG 64 1.933 10.793 14.312 536 1HD ARG 64 1HD ARG 64 3.843 9.720 13.209 537 2HD ARG 64 2HD ARG 64 3.311 10.372 11.662 538 HE ARG 64 HE ARG 64 4.156 12.425 12.263 539 1HH1 ARG 64 1HH1 ARG 64 4.038 10.370 15.078 540 2HH1 ARG 64 2HH1 ARG 64 4.996 11.435 16.052 541 1HH2 ARG 64 1HH2 ARG 64 5.375 13.855 13.555 542 2HH2 ARG 64 2HH2 ARG 64 5.760 13.414 15.186 543 H GLU 65 H GLU 65 -1.380 7.706 12.991 544 HA GLU 65 HA GLU 65 -3.326 9.663 13.931 545 1HB GLU 65 1HB GLU 65 -2.932 8.314 11.510 546 2HB GLU 65 2HB GLU 65 -4.407 7.628 12.177 547 1HG GLU 65 1HG GLU 65 -4.009 10.591 12.010 548 2HG GLU 65 2HG GLU 65 -4.571 9.660 10.623 549 H LEU 66 H LEU 66 -2.185 6.881 15.165 550 HA LEU 66 HA LEU 66 -4.743 5.715 15.925 551 1HB LEU 66 1HB LEU 66 -1.943 4.847 15.908 552 2HB LEU 66 2HB LEU 66 -2.825 4.364 17.345 553 HG LEU 66 HG LEU 66 -4.387 3.106 16.102 554 1HD1 LEU 66 1HD1 LEU 66 -5.094 4.085 14.211 555 2HD1 LEU 66 2HD1 LEU 66 -3.858 3.077 13.463 556 3HD1 LEU 66 3HD1 LEU 66 -3.513 4.764 13.839 557 1HD2 LEU 66 1HD2 LEU 66 -3.023 1.394 15.729 558 2HD2 LEU 66 2HD2 LEU 66 -1.705 2.503 16.105 559 3HD2 LEU 66 3HD2 LEU 66 -2.183 2.238 14.429 560 H GLY 67 H GLY 67 -5.783 6.800 17.488 561 1HA GLY 67 1HA GLY 67 -4.258 8.046 19.643 562 2HA GLY 67 2HA GLY 67 -5.975 8.250 19.340 563 H THR 68 H THR 68 -5.176 5.021 19.154 564 HA THR 68 HA THR 68 -5.850 4.575 21.980 565 HB THR 68 HB THR 68 -7.273 2.783 21.427 566 HG1 THR 68 HG1 THR 68 -5.859 1.955 19.736 567 1HG2 THR 68 1HG2 THR 68 -8.992 3.716 20.221 568 2HG2 THR 68 2HG2 THR 68 -7.902 4.543 19.107 569 3HG2 THR 68 3HG2 THR 68 -8.093 5.135 20.757 570 H ALA 69 H ALA 69 -5.300 2.274 22.656 571 HA ALA 69 HA ALA 69 -2.761 1.770 23.023 572 1HB ALA 69 1HB ALA 69 -3.206 -0.476 23.410 573 2HB ALA 69 2HB ALA 69 -4.373 -0.576 22.092 574 3HB ALA 69 3HB ALA 69 -4.789 0.284 23.576 575 H GLY 70 H GLY 70 -4.221 0.092 20.227 576 1HA GLY 70 1HA GLY 70 -3.387 -0.069 18.055 577 2HA GLY 70 2HA GLY 70 -1.968 0.831 18.558 578 H ASN 71 H ASN 71 -3.245 -2.236 17.857 579 HA ASN 71 HA ASN 71 -0.676 -3.469 18.056 580 1HB ASN 71 1HB ASN 71 -1.233 -5.189 19.694 581 2HB ASN 71 2HB ASN 71 -1.385 -3.593 20.420 582 1HD2 ASN 71 1HD2 ASN 71 -2.993 -6.476 19.502 583 2HD2 ASN 71 2HD2 ASN 71 -4.540 -6.085 20.165 584 H LEU 72 H LEU 72 -0.740 -5.767 17.310 585 HA LEU 72 HA LEU 72 -2.642 -6.021 15.148 586 1HB LEU 72 1HB LEU 72 -0.237 -7.572 16.043 587 2HB LEU 72 2HB LEU 72 -1.336 -8.256 14.861 588 HG LEU 72 HG LEU 72 -0.807 -5.748 13.827 589 1HD1 LEU 72 1HD1 LEU 72 1.917 -6.385 13.986 590 2HD1 LEU 72 2HD1 LEU 72 1.316 -6.422 15.644 591 3HD1 LEU 72 3HD1 LEU 72 1.100 -4.975 14.658 592 1HD2 LEU 72 1HD2 LEU 72 0.966 -7.983 13.026 593 2HD2 LEU 72 2HD2 LEU 72 -0.044 -6.925 12.039 594 3HD2 LEU 72 3HD2 LEU 72 -0.775 -8.258 12.934 595 H GLU 73 H GLU 73 -4.625 -6.844 15.523 596 HA GLU 73 HA GLU 73 -4.916 -8.887 17.616 597 1HB GLU 73 1HB GLU 73 -6.804 -6.889 16.424 598 2HB GLU 73 2HB GLU 73 -7.436 -8.344 17.178 599 1HG GLU 73 1HG GLU 73 -5.504 -6.630 18.666 600 2HG GLU 73 2HG GLU 73 -7.191 -6.133 18.531 601 H GLY 74 H GLY 74 -6.228 -10.763 17.167 602 1HA GLY 74 1HA GLY 74 -6.831 -12.574 15.888 603 2HA GLY 74 2HA GLY 74 -7.306 -11.407 14.662 604 H GLY 75 H GLY 75 -6.483 -13.508 13.495 605 1HA GLY 75 1HA GLY 75 -3.753 -14.056 13.277 606 2HA GLY 75 2HA GLY 75 -4.948 -14.380 12.032 607 H ARG 76 H ARG 76 -5.652 -11.500 11.849 608 HA ARG 76 HA ARG 76 -3.492 -10.750 10.037 609 1HB ARG 76 1HB ARG 76 -5.050 -9.261 9.025 610 2HB ARG 76 2HB ARG 76 -5.919 -10.756 9.346 611 1HG ARG 76 1HG ARG 76 -6.749 -9.674 11.468 612 2HG ARG 76 2HG ARG 76 -6.090 -8.160 10.849 613 1HD ARG 76 1HD ARG 76 -8.593 -8.773 10.445 614 2HD ARG 76 2HD ARG 76 -7.648 -8.019 9.163 615 HE ARG 76 HE ARG 76 -7.664 -10.027 7.992 616 1HH1 ARG 76 1HH1 ARG 76 -9.193 -10.407 11.114 617 2HH1 ARG 76 2HH1 ARG 76 -9.930 -11.918 10.701 618 1HH2 ARG 76 1HH2 ARG 76 -8.631 -12.012 7.462 619 2HH2 ARG 76 2HH2 ARG 76 -9.610 -12.828 8.635 620 H ALA 77 H ALA 77 -3.895 -7.966 9.997 621 HA ALA 77 HA ALA 77 -2.611 -7.257 12.534 622 1HB ALA 77 1HB ALA 77 -1.753 -6.775 10.024 623 2HB ALA 77 2HB ALA 77 -1.325 -5.780 11.414 624 3HB ALA 77 3HB ALA 77 -2.636 -5.283 10.349 625 H ILE 78 H ILE 78 -4.914 -7.351 13.424 626 HA ILE 78 HA ILE 78 -6.606 -5.112 12.718 627 HB ILE 78 HB ILE 78 -6.909 -7.105 14.955 628 1HG1 ILE 78 1HG1 ILE 78 -8.316 -7.125 12.292 629 2HG1 ILE 78 2HG1 ILE 78 -6.885 -8.081 12.650 630 1HG2 ILE 78 1HG2 ILE 78 -8.433 -4.750 14.213 631 2HG2 ILE 78 2HG2 ILE 78 -8.484 -5.711 15.690 632 3HG2 ILE 78 3HG2 ILE 78 -9.427 -6.206 14.284 633 1HD1 ILE 78 1HD1 ILE 78 -8.632 -8.647 14.725 634 2HD1 ILE 78 2HD1 ILE 78 -8.241 -9.678 13.349 635 3HD1 ILE 78 3HD1 ILE 78 -9.641 -8.604 13.280 636 H LEU 79 H LEU 79 -5.310 -3.314 13.256 637 HA LEU 79 HA LEU 79 -4.353 -3.008 15.967 638 1HB LEU 79 1HB LEU 79 -3.479 -0.846 15.179 639 2HB LEU 79 2HB LEU 79 -2.959 -2.192 14.184 640 HG LEU 79 HG LEU 79 -5.067 -1.480 12.759 641 1HD1 LEU 79 1HD1 LEU 79 -5.980 0.468 13.261 642 2HD1 LEU 79 2HD1 LEU 79 -4.413 1.257 13.082 643 3HD1 LEU 79 3HD1 LEU 79 -4.899 0.611 14.649 644 1HD2 LEU 79 1HD2 LEU 79 -2.696 -1.624 12.049 645 2HD2 LEU 79 2HD2 LEU 79 -2.476 0.030 12.622 646 3HD2 LEU 79 3HD2 LEU 79 -3.590 -0.303 11.296 647 H GLN 80 H GLN 80 -4.742 -0.437 16.613 648 HA GLN 80 HA GLN 80 -7.620 0.065 16.509 649 1HB GLN 80 1HB GLN 80 -6.671 -1.313 18.573 650 2HB GLN 80 2HB GLN 80 -6.294 0.298 19.156 651 1HG GLN 80 1HG GLN 80 -8.565 0.939 19.168 652 2HG GLN 80 2HG GLN 80 -9.037 -0.473 18.224 653 1HE2 GLN 80 1HE2 GLN 80 -7.884 -2.530 19.453 654 2HE2 GLN 80 2HE2 GLN 80 -8.443 -2.681 21.080 655 H GLY 81 H GLY 81 -7.993 2.139 16.050 656 1HA GLY 81 1HA GLY 81 -6.867 4.329 17.380 657 2HA GLY 81 2HA GLY 81 -5.974 4.098 15.887 658 H LYS 82 H LYS 82 -6.739 4.980 14.084 659 HA LYS 82 HA LYS 82 -9.570 5.462 13.721 660 1HB LYS 82 1HB LYS 82 -7.586 7.650 14.176 661 2HB LYS 82 2HB LYS 82 -8.920 7.916 13.063 662 1HG LYS 82 1HG LYS 82 -10.215 8.435 14.771 663 2HG LYS 82 2HG LYS 82 -10.033 6.792 15.390 664 1HD LYS 82 1HD LYS 82 -8.927 7.604 17.139 665 2HD LYS 82 2HD LYS 82 -7.666 8.185 16.050 666 1HE LYS 82 1HE LYS 82 -8.596 9.963 17.497 667 2HE LYS 82 2HE LYS 82 -8.807 10.290 15.777 668 1HZ LYS 82 1HZ LYS 82 -11.020 10.214 15.961 669 2HZ LYS 82 2HZ LYS 82 -10.765 10.417 17.621 670 3HZ LYS 82 3HZ LYS 82 -11.005 8.868 16.987 671 H PHE 83 H PHE 83 -7.298 3.985 12.436 672 HA PHE 83 HA PHE 83 -6.941 5.324 9.895 673 1HB PHE 83 1HB PHE 83 -5.777 3.015 11.274 674 2HB PHE 83 2HB PHE 83 -6.025 2.747 9.548 675 HD1 PHE 83 HD1 PHE 83 -4.634 5.259 11.911 676 HD2 PHE 83 HD2 PHE 83 -4.440 3.494 8.069 677 HE1 PHE 83 HE1 PHE 83 -2.627 6.580 11.404 678 HE2 PHE 83 HE2 PHE 83 -2.438 4.818 7.535 679 HZ PHE 83 HZ PHE 83 -1.532 6.373 9.214 680 H THR 84 H THR 84 -9.589 5.094 10.304 681 HA THR 84 HA THR 84 -10.702 2.717 9.159 682 HB THR 84 HB THR 84 -12.065 5.386 9.481 683 HG1 THR 84 HG1 THR 84 -12.390 4.933 11.578 684 1HG2 THR 84 1HG2 THR 84 -13.183 2.626 9.768 685 2HG2 THR 84 2HG2 THR 84 -13.275 3.569 8.283 686 3HG2 THR 84 3HG2 THR 84 -14.071 4.147 9.748 687 H HIS 85 H HIS 85 -9.389 2.718 7.206 688 HA HIS 85 HA HIS 85 -8.880 3.233 5.034 689 1HB HIS 85 1HB HIS 85 -10.813 3.223 3.565 690 2HB HIS 85 2HB HIS 85 -11.062 2.067 4.868 691 HD2 HIS 85 HD2 HIS 85 -12.363 5.657 3.871 692 HE1 HIS 85 HE1 HIS 85 -15.141 3.830 6.504 693 HE2 HIS 85 HE2 HIS 85 -14.667 5.816 5.028 694 H PHE 86 H PHE 86 -8.588 5.457 6.754 695 HA PHE 86 HA PHE 86 -9.639 7.727 5.259 696 1HB PHE 86 1HB PHE 86 -8.985 7.301 7.974 697 2HB PHE 86 2HB PHE 86 -7.864 8.518 7.371 698 HD1 PHE 86 HD1 PHE 86 -10.563 8.437 9.249 699 HD2 PHE 86 HD2 PHE 86 -9.456 9.972 5.437 700 HE1 PHE 86 HE1 PHE 86 -12.323 10.149 9.430 701 HE2 PHE 86 HE2 PHE 86 -11.209 11.686 5.612 702 HZ PHE 86 HZ PHE 86 -12.646 11.777 7.608 703 H LEU 87 H LEU 87 -6.465 7.319 6.755 704 HA LEU 87 HA LEU 87 -5.151 8.731 4.662 705 1HB LEU 87 1HB LEU 87 -4.557 7.869 7.282 706 2HB LEU 87 2HB LEU 87 -3.352 7.139 6.241 707 HG LEU 87 HG LEU 87 -2.659 9.308 5.429 708 1HD1 LEU 87 1HD1 LEU 87 -4.629 10.589 7.301 709 2HD1 LEU 87 2HD1 LEU 87 -4.982 10.313 5.597 710 3HD1 LEU 87 3HD1 LEU 87 -3.638 11.353 6.059 711 1HD2 LEU 87 1HD2 LEU 87 -2.856 9.726 8.373 712 2HD2 LEU 87 2HD2 LEU 87 -1.480 9.950 7.292 713 3HD2 LEU 87 3HD2 LEU 87 -1.981 8.324 7.757 714 H ILE 88 H ILE 88 -5.583 5.330 5.489 715 HA ILE 88 HA ILE 88 -3.731 4.249 3.673 716 HB ILE 88 HB ILE 88 -6.321 2.967 4.512 717 1HG1 ILE 88 1HG1 ILE 88 -3.706 3.172 6.030 718 2HG1 ILE 88 2HG1 ILE 88 -5.310 3.686 6.549 719 1HG2 ILE 88 1HG2 ILE 88 -5.356 1.645 2.862 720 2HG2 ILE 88 2HG2 ILE 88 -4.843 0.893 4.369 721 3HG2 ILE 88 3HG2 ILE 88 -3.721 1.909 3.462 722 1HD1 ILE 88 1HD1 ILE 88 -5.552 1.734 7.557 723 2HD1 ILE 88 2HD1 ILE 88 -4.028 1.154 6.883 724 3HD1 ILE 88 3HD1 ILE 88 -5.527 0.953 5.976 725 H ASN 89 H ASN 89 -7.275 4.345 3.370 726 HA ASN 89 HA ASN 89 -7.427 3.511 0.737 727 1HB ASN 89 1HB ASN 89 -9.209 4.278 2.695 728 2HB ASN 89 2HB ASN 89 -9.470 5.479 1.435 729 1HD2 ASN 89 1HD2 ASN 89 -9.760 2.159 2.340 730 2HD2 ASN 89 2HD2 ASN 89 -10.708 1.659 0.984 731 H GLU 90 H GLU 90 -7.268 6.832 1.972 732 HA GLU 90 HA GLU 90 -7.571 8.183 -0.427 733 1HB GLU 90 1HB GLU 90 -6.192 8.821 2.148 734 2HB GLU 90 2HB GLU 90 -6.003 9.912 0.782 735 1HG GLU 90 1HG GLU 90 -8.745 9.410 0.945 736 2HG GLU 90 2HG GLU 90 -8.206 9.615 2.610 737 H ARG 91 H ARG 91 -4.495 7.271 1.145 738 HA ARG 91 HA ARG 91 -2.832 8.126 -0.945 739 1HB ARG 91 1HB ARG 91 -2.394 5.927 1.064 740 2HB ARG 91 2HB ARG 91 -1.139 6.622 0.054 741 1HG ARG 91 1HG ARG 91 -2.302 8.801 1.327 742 2HG ARG 91 2HG ARG 91 -2.221 7.547 2.561 743 1HD ARG 91 1HD ARG 91 -0.054 7.923 2.822 744 2HD ARG 91 2HD ARG 91 0.225 7.524 1.128 745 HE ARG 91 HE ARG 91 -0.624 10.235 1.853 746 1HH1 ARG 91 1HH1 ARG 91 1.824 8.081 0.601 747 2HH1 ARG 91 2HH1 ARG 91 2.775 9.359 -0.075 748 1HH2 ARG 91 1HH2 ARG 91 0.626 11.910 0.961 749 2HH2 ARG 91 2HH2 ARG 91 2.094 11.530 0.125 750 H ILE 92 H ILE 92 -4.069 4.872 -0.196 751 HA ILE 92 HA ILE 92 -2.859 3.468 -2.241 752 HB ILE 92 HB ILE 92 -5.621 3.061 -1.084 753 1HG1 ILE 92 1HG1 ILE 92 -3.005 1.650 -0.512 754 2HG1 ILE 92 2HG1 ILE 92 -3.724 2.885 0.509 755 1HG2 ILE 92 1HG2 ILE 92 -4.661 0.620 -2.032 756 2HG2 ILE 92 2HG2 ILE 92 -4.344 1.778 -3.322 757 3HG2 ILE 92 3HG2 ILE 92 -5.981 1.581 -2.699 758 1HD1 ILE 92 1HD1 ILE 92 -4.142 0.651 1.368 759 2HD1 ILE 92 2HD1 ILE 92 -4.951 0.218 -0.138 760 3HD1 ILE 92 3HD1 ILE 92 -5.645 1.453 0.912 761 H GLU 93 H GLU 93 -6.107 4.915 -2.303 762 HA GLU 93 HA GLU 93 -6.748 4.430 -4.951 763 1HB GLU 93 1HB GLU 93 -7.988 5.684 -2.875 764 2HB GLU 93 2HB GLU 93 -7.642 7.046 -3.930 765 1HG GLU 93 1HG GLU 93 -8.759 4.765 -5.350 766 2HG GLU 93 2HG GLU 93 -9.820 5.388 -4.088 767 H ASP 94 H ASP 94 -4.726 6.944 -3.589 768 HA ASP 94 HA ASP 94 -4.600 8.570 -5.916 769 1HB ASP 94 1HB ASP 94 -4.026 9.263 -3.542 770 2HB ASP 94 2HB ASP 94 -2.513 8.385 -3.737 771 H TYR 95 H TYR 95 -2.787 5.793 -4.784 772 HA TYR 95 HA TYR 95 -0.786 6.052 -6.860 773 1HB TYR 95 1HB TYR 95 -1.227 4.048 -4.653 774 2HB TYR 95 2HB TYR 95 0.001 3.819 -5.893 775 HD1 TYR 95 HD1 TYR 95 -0.903 5.595 -2.866 776 HD2 TYR 95 HD2 TYR 95 1.916 5.395 -6.040 777 HE1 TYR 95 HE1 TYR 95 0.658 6.961 -1.550 778 HE2 TYR 95 HE2 TYR 95 3.492 6.757 -4.732 779 HH TYR 95 HH TYR 95 2.568 8.356 -1.816 780 H VAL 96 H VAL 96 -3.102 3.501 -5.923 781 HA VAL 96 HA VAL 96 -2.837 1.897 -8.160 782 HB VAL 96 HB VAL 96 -5.110 1.056 -7.674 783 1HG1 VAL 96 1HG1 VAL 96 -2.855 1.093 -5.920 784 2HG1 VAL 96 2HG1 VAL 96 -4.028 -0.193 -6.198 785 3HG1 VAL 96 3HG1 VAL 96 -4.335 1.028 -4.967 786 1HG2 VAL 96 1HG2 VAL 96 -6.535 2.650 -6.952 787 2HG2 VAL 96 2HG2 VAL 96 -5.263 3.587 -6.169 788 3HG2 VAL 96 3HG2 VAL 96 -5.940 2.174 -5.361 789 H ASN 97 H ASN 97 -5.077 4.606 -7.646 790 HA ASN 97 HA ASN 97 -5.678 4.557 -10.524 791 1HB ASN 97 1HB ASN 97 -7.291 5.407 -8.138 792 2HB ASN 97 2HB ASN 97 -7.634 6.100 -9.720 793 1HD2 ASN 97 1HD2 ASN 97 -8.324 3.636 -7.634 794 2HD2 ASN 97 2HD2 ASN 97 -9.058 2.529 -8.740 795 H LYS 98 H LYS 98 -3.309 5.614 -10.062 796 HA LYS 98 HA LYS 98 -3.458 8.455 -9.575 797 1HB LYS 98 1HB LYS 98 -1.456 7.002 -8.996 798 2HB LYS 98 2HB LYS 98 -1.099 6.994 -10.721 799 1HG LYS 98 1HG LYS 98 -1.016 9.463 -10.676 800 2HG LYS 98 2HG LYS 98 -1.252 9.408 -8.928 801 1HD LYS 98 1HD LYS 98 0.940 7.763 -10.046 802 2HD LYS 98 2HD LYS 98 1.166 9.513 -10.067 803 1HE LYS 98 1HE LYS 98 0.219 8.183 -7.568 804 2HE LYS 98 2HE LYS 98 1.925 8.085 -8.002 805 1HZ LYS 98 1HZ LYS 98 0.534 10.223 -6.814 806 2HZ LYS 98 2HZ LYS 98 1.140 10.740 -8.307 807 3HZ LYS 98 3HZ LYS 98 2.188 10.096 -7.146 808 H PHE 99 H PHE 99 -3.082 6.312 -12.329 809 HA PHE 99 HA PHE 99 -2.456 8.122 -14.308 810 1HB PHE 99 1HB PHE 99 -3.336 5.447 -14.222 811 2HB PHE 99 2HB PHE 99 -4.409 6.276 -15.347 812 HD1 PHE 99 HD1 PHE 99 -3.752 6.476 -17.550 813 HD2 PHE 99 HD2 PHE 99 -0.780 5.970 -14.544 814 HE1 PHE 99 HE1 PHE 99 -2.014 6.364 -19.290 815 HE2 PHE 99 HE2 PHE 99 0.960 5.856 -16.280 816 HZ PHE 99 HZ PHE 99 0.345 6.055 -18.655 817 H VAL 100 H VAL 100 -5.708 7.350 -13.077 818 HA VAL 100 HA VAL 100 -6.892 9.355 -14.806 819 HB VAL 100 HB VAL 100 -9.023 8.708 -13.552 820 1HG1 VAL 100 1HG1 VAL 100 -9.429 7.064 -15.096 821 2HG1 VAL 100 2HG1 VAL 100 -7.841 6.324 -14.888 822 3HG1 VAL 100 3HG1 VAL 100 -8.003 7.823 -15.804 823 1HG2 VAL 100 1HG2 VAL 100 -7.933 6.121 -12.809 824 2HG2 VAL 100 2HG2 VAL 100 -8.985 7.203 -11.899 825 3HG2 VAL 100 3HG2 VAL 100 -7.237 7.434 -11.860 826 H ILE 101 H ILE 101 -5.996 9.069 -11.426 827 HA ILE 101 HA ILE 101 -7.486 11.411 -10.648 828 HB ILE 101 HB ILE 101 -6.953 9.492 -9.093 829 1HG1 ILE 101 1HG1 ILE 101 -6.152 12.288 -8.253 830 2HG1 ILE 101 2HG1 ILE 101 -7.774 11.610 -8.209 831 1HG2 ILE 101 1HG2 ILE 101 -4.857 9.042 -8.358 832 2HG2 ILE 101 2HG2 ILE 101 -4.325 10.719 -8.510 833 3HG2 ILE 101 3HG2 ILE 101 -4.451 9.699 -9.943 834 1HD1 ILE 101 1HD1 ILE 101 -6.733 9.869 -6.589 835 2HD1 ILE 101 2HD1 ILE 101 -7.095 11.494 -6.002 836 3HD1 ILE 101 3HD1 ILE 101 -5.441 11.059 -6.428 837 H CYS 102 H CYS 102 -4.039 10.664 -11.224 838 HA CYS 102 HA CYS 102 -3.285 13.418 -10.805 839 1HB CYS 102 1HB CYS 102 -1.840 11.451 -10.139 840 2HB CYS 102 2HB CYS 102 -1.529 11.202 -11.854 841 H HIS 103 H HIS 103 -4.979 12.315 -13.184 842 HA HIS 103 HA HIS 103 -5.246 12.711 -15.396 843 1HB HIS 103 1HB HIS 103 -3.648 15.153 -14.602 844 2HB HIS 103 2HB HIS 103 -4.366 14.948 -16.197 845 HD2 HIS 103 HD2 HIS 103 -5.625 17.408 -14.714 846 HE1 HIS 103 HE1 HIS 103 -8.735 14.814 -13.439 847 HE2 HIS 103 HE2 HIS 103 -7.980 17.209 -13.655 848 H GLU 104 H GLU 104 -3.425 10.807 -15.021 849 HA GLU 104 HA GLU 104 -1.564 9.763 -15.794 850 1HB GLU 104 1HB GLU 104 -1.398 9.696 -18.214 851 2HB GLU 104 2HB GLU 104 -3.071 9.609 -17.695 852 1HG GLU 104 1HG GLU 104 -3.008 12.196 -18.128 853 2HG GLU 104 2HG GLU 104 -1.641 11.769 -19.155 854 H CYS 105 H CYS 105 -0.144 11.071 -14.478 855 HA CYS 105 HA CYS 105 1.221 13.321 -15.542 856 1HB CYS 105 1HB CYS 105 1.001 12.225 -13.064 857 2HB CYS 105 2HB CYS 105 2.622 11.703 -13.505 858 H ASN 106 H ASN 106 1.388 11.784 -17.640 859 HA ASN 106 HA ASN 106 3.612 10.025 -17.702 860 1HB ASN 106 1HB ASN 106 1.446 10.462 -19.316 861 2HB ASN 106 2HB ASN 106 2.740 11.176 -20.268 862 1HD2 ASN 106 1HD2 ASN 106 3.159 9.761 -21.793 863 2HD2 ASN 106 2HD2 ASN 106 3.526 8.092 -21.543 864 H ARG 107 H ARG 107 3.593 12.422 -20.230 865 HA ARG 107 HA ARG 107 6.192 13.385 -19.280 866 1HB ARG 107 1HB ARG 107 5.433 13.891 -22.085 867 2HB ARG 107 2HB ARG 107 6.973 13.391 -21.405 868 1HG ARG 107 1HG ARG 107 5.589 11.140 -21.009 869 2HG ARG 107 2HG ARG 107 4.728 11.764 -22.419 870 1HD ARG 107 1HD ARG 107 6.368 10.653 -23.516 871 2HD ARG 107 2HD ARG 107 7.226 12.167 -23.249 872 HE ARG 107 HE ARG 107 7.516 9.892 -21.402 873 1HH1 ARG 107 1HH1 ARG 107 8.947 12.283 -23.521 874 2HH1 ARG 107 2HH1 ARG 107 10.565 11.925 -23.022 875 1HH2 ARG 107 1HH2 ARG 107 9.653 9.405 -20.793 876 2HH2 ARG 107 2HH2 ARG 107 10.965 10.300 -21.485 877 HA PRO 108 HA PRO 108 2.988 16.922 -19.019 878 1HB PRO 108 1HB PRO 108 4.687 17.416 -16.623 879 2HB PRO 108 2HB PRO 108 2.936 17.556 -16.807 880 1HG PRO 108 1HG PRO 108 4.032 15.492 -15.505 881 2HG PRO 108 2HG PRO 108 2.585 15.295 -16.511 882 1HD PRO 108 1HD PRO 108 5.397 14.486 -17.059 883 2HD PRO 108 2HD PRO 108 3.876 13.733 -17.565 884 H ASP 109 H ASP 109 3.410 18.991 -19.691 885 HA ASP 109 HA ASP 109 6.071 19.551 -20.679 886 1HB ASP 109 1HB ASP 109 3.548 21.223 -20.801 887 2HB ASP 109 2HB ASP 109 5.022 21.513 -21.721 888 H THR 110 H THR 110 5.175 19.622 -17.706 889 HA THR 110 HA THR 110 6.190 22.295 -17.051 890 HB THR 110 HB THR 110 3.931 21.934 -16.217 891 HG1 THR 110 HG1 THR 110 5.067 21.585 -13.795 892 1HG2 THR 110 1HG2 THR 110 3.672 20.160 -14.389 893 2HG2 THR 110 2HG2 THR 110 5.082 19.413 -15.143 894 3HG2 THR 110 3HG2 THR 110 3.612 19.644 -16.082 895 H ARG 111 H ARG 111 7.192 22.154 -14.677 896 HA ARG 111 HA ARG 111 9.387 20.261 -14.913 897 1HB ARG 111 1HB ARG 111 8.908 22.573 -13.028 898 2HB ARG 111 2HB ARG 111 10.359 21.580 -13.029 899 1HG ARG 111 1HG ARG 111 9.892 22.525 -15.678 900 2HG ARG 111 2HG ARG 111 9.808 23.884 -14.556 901 1HD ARG 111 1HD ARG 111 11.975 22.963 -13.564 902 2HD ARG 111 2HD ARG 111 12.078 21.976 -15.022 903 HE ARG 111 HE ARG 111 12.434 24.849 -14.821 904 1HH1 ARG 111 1HH1 ARG 111 12.001 22.085 -16.912 905 2HH1 ARG 111 2HH1 ARG 111 12.645 22.886 -18.305 906 1HH2 ARG 111 1HH2 ARG 111 13.293 25.892 -16.657 907 2HH2 ARG 111 2HH2 ARG 111 13.373 25.039 -18.163 908 H ILE 112 H ILE 112 8.814 18.276 -14.199 909 HA ILE 112 HA ILE 112 7.350 17.992 -11.683 910 HB ILE 112 HB ILE 112 8.309 15.644 -13.262 911 1HG1 ILE 112 1HG1 ILE 112 7.329 17.145 -14.946 912 2HG1 ILE 112 2HG1 ILE 112 6.310 15.732 -14.681 913 1HG2 ILE 112 1HG2 ILE 112 5.598 15.898 -12.072 914 2HG2 ILE 112 2HG2 ILE 112 6.974 15.733 -10.982 915 3HG2 ILE 112 3HG2 ILE 112 6.651 14.490 -12.191 916 1HD1 ILE 112 1HD1 ILE 112 5.828 18.572 -14.001 917 2HD1 ILE 112 2HD1 ILE 112 5.128 17.333 -12.962 918 3HD1 ILE 112 3HD1 ILE 112 4.732 17.367 -14.681 919 H ILE 113 H ILE 113 8.115 16.876 -9.912 920 HA ILE 113 HA ILE 113 10.874 15.927 -9.978 921 HB ILE 113 HB ILE 113 11.057 18.253 -9.212 922 1HG1 ILE 113 1HG1 ILE 113 12.443 16.267 -8.300 923 2HG1 ILE 113 2HG1 ILE 113 12.531 17.810 -7.461 924 1HG2 ILE 113 1HG2 ILE 113 8.862 17.429 -7.438 925 2HG2 ILE 113 2HG2 ILE 113 9.264 19.009 -8.104 926 3HG2 ILE 113 3HG2 ILE 113 10.119 18.413 -6.687 927 1HD1 ILE 113 1HD1 ILE 113 11.872 16.861 -5.569 928 2HD1 ILE 113 2HD1 ILE 113 11.918 15.296 -6.381 929 3HD1 ILE 113 3HD1 ILE 113 10.421 16.224 -6.340 930 H ARG 114 H ARG 114 11.327 14.320 -8.481 931 HA ARG 114 HA ARG 114 9.221 13.577 -6.612 932 1HB ARG 114 1HB ARG 114 9.150 12.365 -8.979 933 2HB ARG 114 2HB ARG 114 10.380 11.364 -8.224 934 1HG ARG 114 1HG ARG 114 8.899 10.680 -6.508 935 2HG ARG 114 2HG ARG 114 7.691 11.869 -6.992 936 1HD ARG 114 1HD ARG 114 8.016 10.512 -9.309 937 2HD ARG 114 2HD ARG 114 8.321 9.235 -8.132 938 HE ARG 114 HE ARG 114 6.055 10.297 -7.198 939 1HH1 ARG 114 1HH1 ARG 114 6.950 9.296 -10.431 940 2HH1 ARG 114 2HH1 ARG 114 5.329 8.882 -10.877 941 1HH2 ARG 114 1HH2 ARG 114 3.940 9.723 -7.790 942 2HH2 ARG 114 2HH2 ARG 114 3.626 9.130 -9.387 943 H GLU 115 H GLU 115 10.148 13.326 -4.697 944 HA GLU 115 HA GLU 115 12.812 12.081 -4.586 945 1HB GLU 115 1HB GLU 115 12.778 14.602 -4.228 946 2HB GLU 115 2HB GLU 115 11.920 14.279 -2.728 947 1HG GLU 115 1HG GLU 115 14.307 14.608 -2.365 948 2HG GLU 115 2HG GLU 115 13.796 12.982 -1.906 949 H GLY 116 H GLY 116 13.150 10.599 -2.982 950 1HA GLY 116 1HA GLY 116 12.637 9.675 -0.810 951 2HA GLY 116 2HA GLY 116 10.977 10.211 -1.030 952 H ARG 117 H ARG 117 12.632 8.712 -3.685 953 HA ARG 117 HA ARG 117 12.275 6.761 -4.801 954 1HB ARG 117 1HB ARG 117 11.620 5.652 -2.066 955 2HB ARG 117 2HB ARG 117 12.083 4.725 -3.487 956 1HG ARG 117 1HG ARG 117 14.160 6.509 -3.201 957 2HG ARG 117 2HG ARG 117 13.738 6.104 -1.535 958 1HD ARG 117 1HD ARG 117 13.715 3.649 -2.509 959 2HD ARG 117 2HD ARG 117 14.780 4.371 -3.715 960 HE ARG 117 HE ARG 117 15.437 4.771 -0.897 961 1HH1 ARG 117 1HH1 ARG 117 16.131 3.138 -3.916 962 2HH1 ARG 117 2HH1 ARG 117 17.717 2.650 -3.424 963 1HH2 ARG 117 1HH2 ARG 117 17.533 4.145 -0.271 964 2HH2 ARG 117 2HH2 ARG 117 18.510 3.214 -1.358 965 H ILE 118 H ILE 118 10.243 8.335 -5.221 966 HA ILE 118 HA ILE 118 8.095 8.335 -5.980 967 HB ILE 118 HB ILE 118 7.801 5.486 -5.050 968 1HG1 ILE 118 1HG1 ILE 118 8.866 6.372 -7.739 969 2HG1 ILE 118 2HG1 ILE 118 9.889 5.805 -6.423 970 1HG2 ILE 118 1HG2 ILE 118 6.004 7.218 -6.177 971 2HG2 ILE 118 2HG2 ILE 118 5.890 5.459 -6.208 972 3HG2 ILE 118 3HG2 ILE 118 6.598 6.319 -7.574 973 1HD1 ILE 118 1HD1 ILE 118 7.655 4.148 -7.535 974 2HD1 ILE 118 2HD1 ILE 118 9.016 3.634 -6.539 975 3HD1 ILE 118 3HD1 ILE 118 9.283 4.126 -8.211 976 H SER 119 H SER 119 8.354 9.582 -3.717 977 HA SER 119 HA SER 119 5.978 8.788 -2.192 978 1HB SER 119 1HB SER 119 8.692 9.410 -1.033 979 2HB SER 119 2HB SER 119 7.212 9.548 -0.083 980 HG SER 119 HG SER 119 6.834 7.287 -0.822 981 H LEU 120 H LEU 120 8.241 11.323 -3.109 982 HA LEU 120 HA LEU 120 6.155 13.312 -2.495 983 1HB LEU 120 1HB LEU 120 9.148 13.668 -2.309 984 2HB LEU 120 2HB LEU 120 7.959 14.931 -2.080 985 HG LEU 120 HG LEU 120 7.299 12.826 -0.297 986 1HD1 LEU 120 1HD1 LEU 120 9.460 11.926 -0.310 987 2HD1 LEU 120 2HD1 LEU 120 9.433 12.993 1.095 988 3HD1 LEU 120 3HD1 LEU 120 10.217 13.518 -0.395 989 1HD2 LEU 120 1HD2 LEU 120 6.974 15.364 -0.179 990 2HD2 LEU 120 2HD2 LEU 120 8.623 15.413 0.444 991 3HD2 LEU 120 3HD2 LEU 120 7.378 14.516 1.313 992 H LEU 121 H LEU 121 5.804 14.917 -4.011 993 HA LEU 121 HA LEU 121 7.491 15.396 -6.221 994 1HB LEU 121 1HB LEU 121 6.040 14.454 -7.997 995 2HB LEU 121 2HB LEU 121 6.823 13.243 -7.007 996 HG LEU 121 HG LEU 121 3.975 14.098 -6.535 997 1HD1 LEU 121 1HD1 LEU 121 3.720 13.251 -8.656 998 2HD1 LEU 121 2HD1 LEU 121 3.580 11.779 -7.694 999 3HD1 LEU 121 3HD1 LEU 121 5.099 12.160 -8.501 1000 1HD2 LEU 121 1HD2 LEU 121 5.015 12.959 -4.667 1001 2HD2 LEU 121 2HD2 LEU 121 5.558 11.659 -5.732 1002 3HD2 LEU 121 3HD2 LEU 121 3.836 11.897 -5.432 1003 H LYS 122 H LYS 122 6.610 16.934 -7.757 1004 HA LYS 122 HA LYS 122 4.324 18.431 -6.631 1005 1HB LYS 122 1HB LYS 122 5.260 20.471 -7.501 1006 2HB LYS 122 2HB LYS 122 6.463 19.659 -6.507 1007 1HG LYS 122 1HG LYS 122 7.748 19.072 -8.343 1008 2HG LYS 122 2HG LYS 122 6.424 19.295 -9.478 1009 1HD LYS 122 1HD LYS 122 7.399 21.265 -9.908 1010 2HD LYS 122 2HD LYS 122 6.639 21.783 -8.403 1011 1HE LYS 122 1HE LYS 122 9.435 20.686 -8.679 1012 2HE LYS 122 2HE LYS 122 9.013 22.385 -8.492 1013 1HZ LYS 122 1HZ LYS 122 9.167 20.307 -6.506 1014 2HZ LYS 122 2HZ LYS 122 7.756 21.237 -6.402 1015 3HZ LYS 122 3HZ LYS 122 9.269 21.988 -6.327 1016 H CYS 123 H CYS 123 2.684 19.069 -7.907 1017 HA CYS 123 HA CYS 123 2.826 18.516 -10.784 1018 1HB CYS 123 1HB CYS 123 0.683 17.568 -8.878 1019 2HB CYS 123 2HB CYS 123 0.469 17.605 -10.621 1020 H GLU 124 H GLU 124 3.177 20.976 -10.296 1021 HA GLU 124 HA GLU 124 0.963 22.576 -9.606 1022 1HB GLU 124 1HB GLU 124 2.267 24.385 -10.877 1023 2HB GLU 124 2HB GLU 124 3.030 23.661 -9.469 1024 1HG GLU 124 1HG GLU 124 4.389 22.249 -10.893 1025 2HG GLU 124 2HG GLU 124 3.579 22.881 -12.325 1026 H ALA 125 H ALA 125 1.813 20.956 -12.555 1027 HA ALA 125 HA ALA 125 0.113 22.581 -14.230 1028 1HB ALA 125 1HB ALA 125 0.606 20.175 -15.551 1029 2HB ALA 125 2HB ALA 125 2.048 20.489 -14.595 1030 3HB ALA 125 3HB ALA 125 1.482 21.695 -15.746 1031 H CYS 126 H CYS 126 0.018 19.066 -13.677 1032 HA CYS 126 HA CYS 126 -2.811 18.994 -14.158 1033 1HB CYS 126 1HB CYS 126 -2.601 16.576 -13.740 1034 2HB CYS 126 2HB CYS 126 -1.394 17.142 -14.889 1035 H GLY 127 H GLY 127 -2.764 20.697 -12.197 1036 1HA GLY 127 1HA GLY 127 -4.210 20.819 -10.303 1037 2HA GLY 127 2HA GLY 127 -3.769 19.168 -9.900 1038 H ALA 128 H ALA 128 -2.575 19.019 -8.147 1039 HA ALA 128 HA ALA 128 -0.310 20.773 -7.750 1040 1HB ALA 128 1HB ALA 128 -0.979 21.890 -5.901 1041 2HB ALA 128 2HB ALA 128 -2.064 20.604 -5.375 1042 3HB ALA 128 3HB ALA 128 -2.556 21.700 -6.667 1043 H LYS 129 H LYS 129 1.191 19.966 -6.225 1044 HA LYS 129 HA LYS 129 0.627 17.439 -4.913 1045 1HB LYS 129 1HB LYS 129 1.722 17.390 -7.447 1046 2HB LYS 129 2HB LYS 129 3.126 17.272 -6.414 1047 1HG LYS 129 1HG LYS 129 2.435 15.074 -6.981 1048 2HG LYS 129 2HG LYS 129 2.051 15.334 -5.278 1049 1HD LYS 129 1HD LYS 129 -0.206 16.181 -6.690 1050 2HD LYS 129 2HD LYS 129 0.309 14.695 -7.488 1051 1HE LYS 129 1HE LYS 129 0.182 14.783 -4.512 1052 2HE LYS 129 2HE LYS 129 -1.314 14.620 -5.432 1053 1HZ LYS 129 1HZ LYS 129 -0.236 12.487 -4.744 1054 2HZ LYS 129 2HZ LYS 129 1.023 12.838 -5.817 1055 3HZ LYS 129 3HZ LYS 129 -0.548 12.622 -6.401 1056 H ALA 130 H ALA 130 2.220 16.869 -3.336 1057 HA ALA 130 HA ALA 130 3.606 19.206 -2.299 1058 1HB ALA 130 1HB ALA 130 3.262 18.341 -0.267 1059 2HB ALA 130 2HB ALA 130 3.797 16.732 -0.752 1060 3HB ALA 130 3HB ALA 130 2.144 17.250 -1.088 1061 HA PRO 131 HA PRO 131 7.369 17.459 -4.188 1062 1HB PRO 131 1HB PRO 131 8.869 19.723 -3.870 1063 2HB PRO 131 2HB PRO 131 7.771 19.455 -5.227 1064 1HG PRO 131 1HG PRO 131 7.377 21.094 -2.768 1065 2HG PRO 131 2HG PRO 131 6.844 21.408 -4.429 1066 1HD PRO 131 1HD PRO 131 5.196 20.465 -2.459 1067 2HD PRO 131 2HD PRO 131 4.948 20.160 -4.186 1068 H LEU 132 H LEU 132 8.360 19.864 -1.771 1069 HA LEU 132 HA LEU 132 9.157 17.748 0.066 1070 1HB LEU 132 1HB LEU 132 11.405 19.080 0.282 1071 2HB LEU 132 2HB LEU 132 11.211 17.816 -0.912 1072 HG LEU 132 HG LEU 132 12.365 20.000 -1.603 1073 1HD1 LEU 132 1HD1 LEU 132 12.066 18.647 -3.380 1074 2HD1 LEU 132 2HD1 LEU 132 10.920 19.911 -3.832 1075 3HD1 LEU 132 3HD1 LEU 132 10.345 18.425 -3.075 1076 1HD2 LEU 132 1HD2 LEU 132 9.932 21.228 -2.519 1077 2HD2 LEU 132 2HD2 LEU 132 11.259 21.924 -1.592 1078 3HD2 LEU 132 3HD2 LEU 132 9.935 21.116 -0.761 1079 H LYS 133 H LYS 133 7.153 19.850 0.116 1080 HA LYS 133 HA LYS 133 7.784 20.945 2.704 1081 1HB LYS 133 1HB LYS 133 8.819 22.563 1.101 1082 2HB LYS 133 2HB LYS 133 7.223 22.853 0.426 1083 1HG LYS 133 1HG LYS 133 7.143 23.183 3.268 1084 2HG LYS 133 2HG LYS 133 8.451 24.152 2.587 1085 1HD LYS 133 1HD LYS 133 6.250 24.462 0.861 1086 2HD LYS 133 2HD LYS 133 5.618 24.608 2.502 1087 1HE LYS 133 1HE LYS 133 7.415 26.264 2.971 1088 2HE LYS 133 2HE LYS 133 7.868 26.188 1.270 1089 1HZ LYS 133 1HZ LYS 133 5.844 27.131 0.622 1090 2HZ LYS 133 2HZ LYS 133 6.319 28.046 1.965 1091 3HZ LYS 133 3HZ LYS 133 5.119 26.863 2.128 1092 H ASN 134 H ASN 134 5.922 21.862 3.767 1093 HA ASN 134 HA ASN 134 3.424 20.794 2.686 1094 1HB ASN 134 1HB ASN 134 3.913 21.904 5.454 1095 2HB ASN 134 2HB ASN 134 2.552 20.921 4.923 1096 1HD2 ASN 134 1HD2 ASN 134 4.033 19.055 3.393 1097 2HD2 ASN 134 2HD2 ASN 134 4.945 18.079 4.488 1098 H VAL 135 H VAL 135 3.042 22.432 1.136 1099 HA VAL 135 HA VAL 135 2.680 25.158 2.078 1100 HB VAL 135 HB VAL 135 2.038 25.627 -0.301 1101 1HG1 VAL 135 1HG1 VAL 135 4.683 24.297 -0.418 1102 2HG1 VAL 135 2HG1 VAL 135 4.447 25.551 0.801 1103 3HG1 VAL 135 3HG1 VAL 135 4.203 25.922 -0.907 1104 1HG2 VAL 135 1HG2 VAL 135 2.819 22.738 -0.674 1105 2HG2 VAL 135 2HG2 VAL 135 2.625 23.904 -1.981 1106 3HG2 VAL 135 3HG2 VAL 135 1.241 23.461 -0.984
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